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quantum-espresso/EPW/examples/diamond/epw/out.ref/epw.out

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Program EPW v.4.0.0 (svn rev. 11607) starts on 27Jul2015 at 16:25: 8
This program is part of the open-source Quantum ESPRESSO suite
for quantum simulation of materials; please cite
"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
URL http://www.quantum-espresso.org",
in publications or presentations arising from this work. More details at
http://www.quantum-espresso.org/quote
Parallel version (MPI), running on 1 processors
Reading data from directory:
./diam.save
Info: using nr1, nr2, nr3 values from input
Info: using nr1, nr2, nr3 values from input
IMPORTANT: XC functional enforced from input :
Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0)
Any further DFT definition will be discarded
Please, verify this is what you really want
file C_3.98148.UPF: wavefunction(s) 3d renormalized
G-vector sticks info
--------------------
sticks: dense smooth PW G-vecs: dense smooth PW
Sum 367 367 127 4645 4645 965
Possibly too few bands at point 2 -0.16667 0.16667 -0.16667
Possibly too few bands at point 3 -0.33333 0.33333 -0.33333
Possibly too few bands at point 4 -0.50000 0.50000 -0.50000
Possibly too few bands at point 5 -0.66667 0.66667 -0.66667
Possibly too few bands at point 6 -0.83333 0.83333 -0.83333
Possibly too few bands at point 7 0.16667 0.16667 0.16667
Possibly too few bands at point 8 0.00000 0.33333 0.00000
Possibly too few bands at point 9 -0.16667 0.50000 -0.16667
Possibly too few bands at point 10 -0.33333 0.66667 -0.33333
Possibly too few bands at point 11 -0.50000 0.83333 -0.50000
Possibly too few bands at point 12 -0.66667 1.00000 -0.66667
Possibly too few bands at point 13 0.33333 0.33333 0.33333
Possibly too few bands at point 14 0.16667 0.50000 0.16667
Possibly too few bands at point 15 0.00000 0.66667 0.00000
Possibly too few bands at point 16 -0.16667 0.83333 -0.16667
Possibly too few bands at point 17 -0.33333 1.00000 -0.33333
Possibly too few bands at point 18 -0.50000 1.16667 -0.50000
Possibly too few bands at point 19 0.50000 0.50000 0.50000
Possibly too few bands at point 20 0.33333 0.66667 0.33333
Possibly too few bands at point 21 0.16667 0.83333 0.16667
Possibly too few bands at point 22 0.00000 1.00000 0.00000
Possibly too few bands at point 23 -0.16667 1.16667 -0.16667
Possibly too few bands at point 24 -0.33333 1.33333 -0.33333
Possibly too few bands at point 25 0.66667 0.66667 0.66667
Possibly too few bands at point 26 0.50000 0.83333 0.50000
Possibly too few bands at point 27 0.33333 1.00000 0.33333
Possibly too few bands at point 28 0.16667 1.16667 0.16667
Possibly too few bands at point 29 0.00000 1.33333 0.00000
Possibly too few bands at point 30 -0.16667 1.50000 -0.16667
Possibly too few bands at point 31 0.83333 0.83333 0.83333
Possibly too few bands at point 32 0.66667 1.00000 0.66667
Possibly too few bands at point 33 0.50000 1.16667 0.50000
Possibly too few bands at point 34 0.33333 1.33333 0.33333
Possibly too few bands at point 35 0.16667 1.50000 0.16667
Possibly too few bands at point 36 0.00000 1.66667 0.00000
Possibly too few bands at point 37 -0.16667 -0.16667 0.16667
Possibly too few bands at point 38 -0.33333 0.00000 0.00000
Possibly too few bands at point 39 -0.50000 0.16667 -0.16667
Possibly too few bands at point 40 -0.66667 0.33333 -0.33333
Possibly too few bands at point 41 -0.83333 0.50000 -0.50000
Possibly too few bands at point 42 -1.00000 0.66667 -0.66667
Possibly too few bands at point 43 0.00000 0.00000 0.33333
Possibly too few bands at point 44 -0.16667 0.16667 0.16667
Possibly too few bands at point 45 -0.33333 0.33333 0.00000
Possibly too few bands at point 46 -0.50000 0.50000 -0.16667
Possibly too few bands at point 47 -0.66667 0.66667 -0.33333
Possibly too few bands at point 48 -0.83333 0.83333 -0.50000
Possibly too few bands at point 49 0.16667 0.16667 0.50000
Possibly too few bands at point 50 -0.00000 0.33333 0.33333
Possibly too few bands at point 51 -0.16667 0.50000 0.16667
Possibly too few bands at point 52 -0.33333 0.66667 0.00000
Possibly too few bands at point 53 -0.50000 0.83333 -0.16667
Possibly too few bands at point 54 -0.66667 1.00000 -0.33333
Possibly too few bands at point 55 0.33333 0.33333 0.66667
Possibly too few bands at point 56 0.16667 0.50000 0.50000
Possibly too few bands at point 57 0.00000 0.66667 0.33333
Possibly too few bands at point 58 -0.16667 0.83333 0.16667
Possibly too few bands at point 59 -0.33333 1.00000 0.00000
Possibly too few bands at point 60 -0.50000 1.16667 -0.16667
Possibly too few bands at point 61 0.50000 0.50000 0.83333
Possibly too few bands at point 62 0.33333 0.66667 0.66667
Possibly too few bands at point 63 0.16667 0.83333 0.50000
Possibly too few bands at point 64 0.00000 1.00000 0.33333
Possibly too few bands at point 65 -0.16667 1.16667 0.16667
Possibly too few bands at point 66 -0.33333 1.33333 0.00000
Possibly too few bands at point 67 0.66667 0.66667 1.00000
Possibly too few bands at point 68 0.50000 0.83333 0.83333
Possibly too few bands at point 69 0.33333 1.00000 0.66667
Possibly too few bands at point 70 0.16667 1.16667 0.50000
Possibly too few bands at point 71 -0.00000 1.33333 0.33333
Possibly too few bands at point 72 -0.16667 1.50000 0.16667
Possibly too few bands at point 73 -0.33333 -0.33333 0.33333
Possibly too few bands at point 74 -0.50000 -0.16667 0.16667
Possibly too few bands at point 75 -0.66667 0.00000 0.00000
Possibly too few bands at point 76 -0.83333 0.16667 -0.16667
Possibly too few bands at point 77 -1.00000 0.33333 -0.33333
Possibly too few bands at point 78 -1.16667 0.50000 -0.50000
Possibly too few bands at point 79 -0.16667 -0.16667 0.50000
Possibly too few bands at point 80 -0.33333 0.00000 0.33333
Possibly too few bands at point 81 -0.50000 0.16667 0.16667
Possibly too few bands at point 82 -0.66667 0.33333 0.00000
Possibly too few bands at point 83 -0.83333 0.50000 -0.16667
Possibly too few bands at point 84 -1.00000 0.66667 -0.33333
Possibly too few bands at point 85 0.00000 0.00000 0.66667
Possibly too few bands at point 86 -0.16667 0.16667 0.50000
Possibly too few bands at point 87 -0.33333 0.33333 0.33333
Possibly too few bands at point 88 -0.50000 0.50000 0.16667
Possibly too few bands at point 89 -0.66667 0.66667 -0.00000
Possibly too few bands at point 90 -0.83333 0.83333 -0.16667
Possibly too few bands at point 91 0.16667 0.16667 0.83333
Possibly too few bands at point 92 0.00000 0.33333 0.66667
Possibly too few bands at point 93 -0.16667 0.50000 0.50000
Possibly too few bands at point 94 -0.33333 0.66667 0.33333
Possibly too few bands at point 95 -0.50000 0.83333 0.16667
Possibly too few bands at point 96 -0.66667 1.00000 0.00000
Possibly too few bands at point 97 0.33333 0.33333 1.00000
Possibly too few bands at point 98 0.16667 0.50000 0.83333
Possibly too few bands at point 99 0.00000 0.66667 0.66667
Possibly too few bands at point 100 -0.16667 0.83333 0.50000
Possibly too few bands at point 101 -0.33333 1.00000 0.33333
Possibly too few bands at point 102 -0.50000 1.16667 0.16667
Possibly too few bands at point 103 0.50000 0.50000 1.16667
Possibly too few bands at point 104 0.33333 0.66667 1.00000
Possibly too few bands at point 105 0.16667 0.83333 0.83333
Possibly too few bands at point 106 0.00000 1.00000 0.66667
Possibly too few bands at point 107 -0.16667 1.16667 0.50000
Possibly too few bands at point 108 -0.33333 1.33333 0.33333
Possibly too few bands at point 109 -0.50000 -0.50000 0.50000
Possibly too few bands at point 110 -0.66667 -0.33333 0.33333
Possibly too few bands at point 111 -0.83333 -0.16667 0.16667
Possibly too few bands at point 112 -1.00000 0.00000 0.00000
Possibly too few bands at point 113 -1.16667 0.16667 -0.16667
Possibly too few bands at point 114 -1.33333 0.33333 -0.33333
Possibly too few bands at point 115 -0.33333 -0.33333 0.66667
Possibly too few bands at point 116 -0.50000 -0.16667 0.50000
Possibly too few bands at point 117 -0.66667 0.00000 0.33333
Possibly too few bands at point 118 -0.83333 0.16667 0.16667
Possibly too few bands at point 119 -1.00000 0.33333 0.00000
Possibly too few bands at point 120 -1.16667 0.50000 -0.16667
Possibly too few bands at point 121 -0.16667 -0.16667 0.83333
Possibly too few bands at point 122 -0.33333 -0.00000 0.66667
Possibly too few bands at point 123 -0.50000 0.16667 0.50000
Possibly too few bands at point 124 -0.66667 0.33333 0.33333
Possibly too few bands at point 125 -0.83333 0.50000 0.16667
Possibly too few bands at point 126 -1.00000 0.66667 0.00000
Possibly too few bands at point 127 0.00000 0.00000 1.00000
Possibly too few bands at point 128 -0.16667 0.16667 0.83333
Possibly too few bands at point 129 -0.33333 0.33333 0.66667
Possibly too few bands at point 130 -0.50000 0.50000 0.50000
Possibly too few bands at point 131 -0.66667 0.66667 0.33333
Possibly too few bands at point 132 -0.83333 0.83333 0.16667
Possibly too few bands at point 133 0.16667 0.16667 1.16667
Possibly too few bands at point 134 0.00000 0.33333 1.00000
Possibly too few bands at point 135 -0.16667 0.50000 0.83333
Possibly too few bands at point 136 -0.33333 0.66667 0.66667
Possibly too few bands at point 137 -0.50000 0.83333 0.50000
Possibly too few bands at point 138 -0.66667 1.00000 0.33333
Possibly too few bands at point 139 0.33333 0.33333 1.33333
Possibly too few bands at point 140 0.16667 0.50000 1.16667
Possibly too few bands at point 141 0.00000 0.66667 1.00000
Possibly too few bands at point 142 -0.16667 0.83333 0.83333
Possibly too few bands at point 143 -0.33333 1.00000 0.66667
Possibly too few bands at point 144 -0.50000 1.16667 0.50000
Possibly too few bands at point 145 -0.66667 -0.66667 0.66667
Possibly too few bands at point 146 -0.83333 -0.50000 0.50000
Possibly too few bands at point 147 -1.00000 -0.33333 0.33333
Possibly too few bands at point 148 -1.16667 -0.16667 0.16667
Possibly too few bands at point 149 -1.33333 0.00000 0.00000
Possibly too few bands at point 150 -1.50000 0.16667 -0.16667
Possibly too few bands at point 151 -0.50000 -0.50000 0.83333
Possibly too few bands at point 152 -0.66667 -0.33333 0.66667
Possibly too few bands at point 153 -0.83333 -0.16667 0.50000
Possibly too few bands at point 154 -1.00000 0.00000 0.33333
Possibly too few bands at point 155 -1.16667 0.16667 0.16667
Possibly too few bands at point 156 -1.33333 0.33333 0.00000
Possibly too few bands at point 157 -0.33333 -0.33333 1.00000
Possibly too few bands at point 158 -0.50000 -0.16667 0.83333
Possibly too few bands at point 159 -0.66667 -0.00000 0.66667
Possibly too few bands at point 160 -0.83333 0.16667 0.50000
Possibly too few bands at point 161 -1.00000 0.33333 0.33333
Possibly too few bands at point 162 -1.16667 0.50000 0.16667
Possibly too few bands at point 163 -0.16667 -0.16667 1.16667
Possibly too few bands at point 164 -0.33333 -0.00000 1.00000
Possibly too few bands at point 165 -0.50000 0.16667 0.83333
Possibly too few bands at point 166 -0.66667 0.33333 0.66667
Possibly too few bands at point 167 -0.83333 0.50000 0.50000
Possibly too few bands at point 168 -1.00000 0.66667 0.33333
Possibly too few bands at point 169 0.00000 0.00000 1.33333
Possibly too few bands at point 170 -0.16667 0.16667 1.16667
Possibly too few bands at point 171 -0.33333 0.33333 1.00000
Possibly too few bands at point 172 -0.50000 0.50000 0.83333
Possibly too few bands at point 173 -0.66667 0.66667 0.66667
Possibly too few bands at point 174 -0.83333 0.83333 0.50000
Possibly too few bands at point 175 0.16667 0.16667 1.50000
Possibly too few bands at point 176 -0.00000 0.33333 1.33333
Possibly too few bands at point 177 -0.16667 0.50000 1.16667
Possibly too few bands at point 178 -0.33333 0.66667 1.00000
Possibly too few bands at point 179 -0.50000 0.83333 0.83333
Possibly too few bands at point 180 -0.66667 1.00000 0.66667
Possibly too few bands at point 181 -0.83333 -0.83333 0.83333
Possibly too few bands at point 182 -1.00000 -0.66667 0.66667
Possibly too few bands at point 183 -1.16667 -0.50000 0.50000
Possibly too few bands at point 184 -1.33333 -0.33333 0.33333
Possibly too few bands at point 185 -1.50000 -0.16667 0.16667
Possibly too few bands at point 186 -1.66667 0.00000 0.00000
Possibly too few bands at point 187 -0.66667 -0.66667 1.00000
Possibly too few bands at point 188 -0.83333 -0.50000 0.83333
Possibly too few bands at point 189 -1.00000 -0.33333 0.66667
Possibly too few bands at point 190 -1.16667 -0.16667 0.50000
Possibly too few bands at point 191 -1.33333 0.00000 0.33333
Possibly too few bands at point 192 -1.50000 0.16667 0.16667
Possibly too few bands at point 193 -0.50000 -0.50000 1.16667
Possibly too few bands at point 194 -0.66667 -0.33333 1.00000
Possibly too few bands at point 195 -0.83333 -0.16667 0.83333
Possibly too few bands at point 196 -1.00000 0.00000 0.66667
Possibly too few bands at point 197 -1.16667 0.16667 0.50000
Possibly too few bands at point 198 -1.33333 0.33333 0.33333
Possibly too few bands at point 199 -0.33333 -0.33333 1.33333
Possibly too few bands at point 200 -0.50000 -0.16667 1.16667
Possibly too few bands at point 201 -0.66667 0.00000 1.00000
Possibly too few bands at point 202 -0.83333 0.16667 0.83333
Possibly too few bands at point 203 -1.00000 0.33333 0.66667
Possibly too few bands at point 204 -1.16667 0.50000 0.50000
Possibly too few bands at point 205 -0.16667 -0.16667 1.50000
Possibly too few bands at point 206 -0.33333 0.00000 1.33333
Possibly too few bands at point 207 -0.50000 0.16667 1.16667
Possibly too few bands at point 208 -0.66667 0.33333 1.00000
Possibly too few bands at point 209 -0.83333 0.50000 0.83333
Possibly too few bands at point 210 -1.00000 0.66667 0.66667
Possibly too few bands at point 211 0.00000 0.00000 1.66667
Possibly too few bands at point 212 -0.16667 0.16667 1.50000
Possibly too few bands at point 213 -0.33333 0.33333 1.33333
Possibly too few bands at point 214 -0.50000 0.50000 1.16667
Possibly too few bands at point 215 -0.66667 0.66667 1.00000
Possibly too few bands at point 216 -0.83333 0.83333 0.83333
--
bravais-lattice index = 2
lattice parameter (a_0) = 6.6425 a.u.
unit-cell volume = 73.2698 (a.u.)^3
number of atoms/cell = 2
number of atomic types = 1
kinetic-energy cut-off = 60.0000 Ry
charge density cut-off = 240.0000 Ry
convergence threshold = 0.0E+00
beta = 0.0000
number of iterations used = 0
Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0)
celldm(1)= 6.64245 celldm(2)= 0.00000 celldm(3)= 0.00000
celldm(4)= 0.00000 celldm(5)= 0.00000 celldm(6)= 0.00000
crystal axes: (cart. coord. in units of a_0)
a(1) = ( -0.5000 0.0000 0.5000 )
a(2) = ( 0.0000 0.5000 0.5000 )
a(3) = ( -0.5000 0.5000 0.0000 )
reciprocal axes: (cart. coord. in units 2 pi/a_0)
b(1) = ( -1.0000 -1.0000 1.0000 )
b(2) = ( 1.0000 1.0000 1.0000 )
b(3) = ( -1.0000 1.0000 -1.0000 )
Atoms inside the unit cell:
Cartesian axes
site n. atom mass positions (a_0 units)
1 C 12.0118 tau( 1) = ( 0.00000 0.00000 0.00000 )
2 C 12.0118 tau( 2) = ( 0.25000 0.25000 0.25000 )
49 Sym.Ops. (with q -> -q+G )
G cutoff = 268.2305 ( 4645 G-vectors) FFT grid: ( 24, 24, 24)
number of k points= 216 gaussian broad. (Ry)= 0.0200 ngauss = 1
cart. coord. in units 2pi/a_0
k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0092593
k( 2) = ( -0.1666667 0.1666667 -0.1666667), wk = 0.0092593
k( 3) = ( -0.3333333 0.3333333 -0.3333333), wk = 0.0092593
k( 4) = ( -0.5000000 0.5000000 -0.5000000), wk = 0.0092593
k( 5) = ( -0.6666667 0.6666667 -0.6666667), wk = 0.0092593
k( 6) = ( -0.8333333 0.8333333 -0.8333333), wk = 0.0092593
k( 7) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0092593
k( 8) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0092593
k( 9) = ( -0.1666667 0.5000000 -0.1666667), wk = 0.0092593
k( 10) = ( -0.3333333 0.6666667 -0.3333333), wk = 0.0092593
k( 11) = ( -0.5000000 0.8333333 -0.5000000), wk = 0.0092593
k( 12) = ( -0.6666667 1.0000000 -0.6666667), wk = 0.0092593
k( 13) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0092593
k( 14) = ( 0.1666667 0.5000000 0.1666667), wk = 0.0092593
k( 15) = ( 0.0000000 0.6666667 0.0000000), wk = 0.0092593
k( 16) = ( -0.1666667 0.8333333 -0.1666667), wk = 0.0092593
k( 17) = ( -0.3333333 1.0000000 -0.3333333), wk = 0.0092593
k( 18) = ( -0.5000000 1.1666667 -0.5000000), wk = 0.0092593
k( 19) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0092593
k( 20) = ( 0.3333333 0.6666667 0.3333333), wk = 0.0092593
k( 21) = ( 0.1666667 0.8333333 0.1666667), wk = 0.0092593
k( 22) = ( 0.0000000 1.0000000 0.0000000), wk = 0.0092593
k( 23) = ( -0.1666667 1.1666667 -0.1666667), wk = 0.0092593
k( 24) = ( -0.3333333 1.3333333 -0.3333333), wk = 0.0092593
k( 25) = ( 0.6666667 0.6666667 0.6666667), wk = 0.0092593
k( 26) = ( 0.5000000 0.8333333 0.5000000), wk = 0.0092593
k( 27) = ( 0.3333333 1.0000000 0.3333333), wk = 0.0092593
k( 28) = ( 0.1666667 1.1666667 0.1666667), wk = 0.0092593
k( 29) = ( 0.0000000 1.3333333 0.0000000), wk = 0.0092593
k( 30) = ( -0.1666667 1.5000000 -0.1666667), wk = 0.0092593
k( 31) = ( 0.8333333 0.8333333 0.8333333), wk = 0.0092593
k( 32) = ( 0.6666667 1.0000000 0.6666667), wk = 0.0092593
k( 33) = ( 0.5000000 1.1666667 0.5000000), wk = 0.0092593
k( 34) = ( 0.3333333 1.3333333 0.3333333), wk = 0.0092593
k( 35) = ( 0.1666667 1.5000000 0.1666667), wk = 0.0092593
k( 36) = ( 0.0000000 1.6666667 0.0000000), wk = 0.0092593
k( 37) = ( -0.1666667 -0.1666667 0.1666667), wk = 0.0092593
k( 38) = ( -0.3333333 0.0000000 0.0000000), wk = 0.0092593
k( 39) = ( -0.5000000 0.1666667 -0.1666667), wk = 0.0092593
k( 40) = ( -0.6666667 0.3333333 -0.3333333), wk = 0.0092593
k( 41) = ( -0.8333333 0.5000000 -0.5000000), wk = 0.0092593
k( 42) = ( -1.0000000 0.6666667 -0.6666667), wk = 0.0092593
k( 43) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0092593
k( 44) = ( -0.1666667 0.1666667 0.1666667), wk = 0.0092593
k( 45) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0092593
k( 46) = ( -0.5000000 0.5000000 -0.1666667), wk = 0.0092593
k( 47) = ( -0.6666667 0.6666667 -0.3333333), wk = 0.0092593
k( 48) = ( -0.8333333 0.8333333 -0.5000000), wk = 0.0092593
k( 49) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0092593
k( 50) = ( -0.0000000 0.3333333 0.3333333), wk = 0.0092593
k( 51) = ( -0.1666667 0.5000000 0.1666667), wk = 0.0092593
k( 52) = ( -0.3333333 0.6666667 0.0000000), wk = 0.0092593
k( 53) = ( -0.5000000 0.8333333 -0.1666667), wk = 0.0092593
k( 54) = ( -0.6666667 1.0000000 -0.3333333), wk = 0.0092593
k( 55) = ( 0.3333333 0.3333333 0.6666667), wk = 0.0092593
k( 56) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0092593
k( 57) = ( 0.0000000 0.6666667 0.3333333), wk = 0.0092593
k( 58) = ( -0.1666667 0.8333333 0.1666667), wk = 0.0092593
k( 59) = ( -0.3333333 1.0000000 0.0000000), wk = 0.0092593
k( 60) = ( -0.5000000 1.1666667 -0.1666667), wk = 0.0092593
k( 61) = ( 0.5000000 0.5000000 0.8333333), wk = 0.0092593
k( 62) = ( 0.3333333 0.6666667 0.6666667), wk = 0.0092593
k( 63) = ( 0.1666667 0.8333333 0.5000000), wk = 0.0092593
k( 64) = ( 0.0000000 1.0000000 0.3333333), wk = 0.0092593
k( 65) = ( -0.1666667 1.1666667 0.1666667), wk = 0.0092593
k( 66) = ( -0.3333333 1.3333333 0.0000000), wk = 0.0092593
k( 67) = ( 0.6666667 0.6666667 1.0000000), wk = 0.0092593
k( 68) = ( 0.5000000 0.8333333 0.8333333), wk = 0.0092593
k( 69) = ( 0.3333333 1.0000000 0.6666667), wk = 0.0092593
k( 70) = ( 0.1666667 1.1666667 0.5000000), wk = 0.0092593
k( 71) = ( -0.0000000 1.3333333 0.3333333), wk = 0.0092593
k( 72) = ( -0.1666667 1.5000000 0.1666667), wk = 0.0092593
k( 73) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0092593
k( 74) = ( -0.5000000 -0.1666667 0.1666667), wk = 0.0092593
k( 75) = ( -0.6666667 0.0000000 0.0000000), wk = 0.0092593
k( 76) = ( -0.8333333 0.1666667 -0.1666667), wk = 0.0092593
k( 77) = ( -1.0000000 0.3333333 -0.3333333), wk = 0.0092593
k( 78) = ( -1.1666667 0.5000000 -0.5000000), wk = 0.0092593
k( 79) = ( -0.1666667 -0.1666667 0.5000000), wk = 0.0092593
k( 80) = ( -0.3333333 0.0000000 0.3333333), wk = 0.0092593
k( 81) = ( -0.5000000 0.1666667 0.1666667), wk = 0.0092593
k( 82) = ( -0.6666667 0.3333333 0.0000000), wk = 0.0092593
k( 83) = ( -0.8333333 0.5000000 -0.1666667), wk = 0.0092593
k( 84) = ( -1.0000000 0.6666667 -0.3333333), wk = 0.0092593
k( 85) = ( 0.0000000 0.0000000 0.6666667), wk = 0.0092593
k( 86) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0092593
k( 87) = ( -0.3333333 0.3333333 0.3333333), wk = 0.0092593
k( 88) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0092593
k( 89) = ( -0.6666667 0.6666667 -0.0000000), wk = 0.0092593
k( 90) = ( -0.8333333 0.8333333 -0.1666667), wk = 0.0092593
k( 91) = ( 0.1666667 0.1666667 0.8333333), wk = 0.0092593
k( 92) = ( 0.0000000 0.3333333 0.6666667), wk = 0.0092593
k( 93) = ( -0.1666667 0.5000000 0.5000000), wk = 0.0092593
k( 94) = ( -0.3333333 0.6666667 0.3333333), wk = 0.0092593
k( 95) = ( -0.5000000 0.8333333 0.1666667), wk = 0.0092593
k( 96) = ( -0.6666667 1.0000000 0.0000000), wk = 0.0092593
k( 97) = ( 0.3333333 0.3333333 1.0000000), wk = 0.0092593
k( 98) = ( 0.1666667 0.5000000 0.8333333), wk = 0.0092593
k( 99) = ( 0.0000000 0.6666667 0.6666667), wk = 0.0092593
k( 100) = ( -0.1666667 0.8333333 0.5000000), wk = 0.0092593
k( 101) = ( -0.3333333 1.0000000 0.3333333), wk = 0.0092593
k( 102) = ( -0.5000000 1.1666667 0.1666667), wk = 0.0092593
k( 103) = ( 0.5000000 0.5000000 1.1666667), wk = 0.0092593
k( 104) = ( 0.3333333 0.6666667 1.0000000), wk = 0.0092593
k( 105) = ( 0.1666667 0.8333333 0.8333333), wk = 0.0092593
k( 106) = ( 0.0000000 1.0000000 0.6666667), wk = 0.0092593
k( 107) = ( -0.1666667 1.1666667 0.5000000), wk = 0.0092593
k( 108) = ( -0.3333333 1.3333333 0.3333333), wk = 0.0092593
k( 109) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0092593
k( 110) = ( -0.6666667 -0.3333333 0.3333333), wk = 0.0092593
k( 111) = ( -0.8333333 -0.1666667 0.1666667), wk = 0.0092593
k( 112) = ( -1.0000000 0.0000000 0.0000000), wk = 0.0092593
k( 113) = ( -1.1666667 0.1666667 -0.1666667), wk = 0.0092593
k( 114) = ( -1.3333333 0.3333333 -0.3333333), wk = 0.0092593
k( 115) = ( -0.3333333 -0.3333333 0.6666667), wk = 0.0092593
k( 116) = ( -0.5000000 -0.1666667 0.5000000), wk = 0.0092593
k( 117) = ( -0.6666667 0.0000000 0.3333333), wk = 0.0092593
k( 118) = ( -0.8333333 0.1666667 0.1666667), wk = 0.0092593
k( 119) = ( -1.0000000 0.3333333 0.0000000), wk = 0.0092593
k( 120) = ( -1.1666667 0.5000000 -0.1666667), wk = 0.0092593
k( 121) = ( -0.1666667 -0.1666667 0.8333333), wk = 0.0092593
k( 122) = ( -0.3333333 -0.0000000 0.6666667), wk = 0.0092593
k( 123) = ( -0.5000000 0.1666667 0.5000000), wk = 0.0092593
k( 124) = ( -0.6666667 0.3333333 0.3333333), wk = 0.0092593
k( 125) = ( -0.8333333 0.5000000 0.1666667), wk = 0.0092593
k( 126) = ( -1.0000000 0.6666667 0.0000000), wk = 0.0092593
k( 127) = ( 0.0000000 0.0000000 1.0000000), wk = 0.0092593
k( 128) = ( -0.1666667 0.1666667 0.8333333), wk = 0.0092593
k( 129) = ( -0.3333333 0.3333333 0.6666667), wk = 0.0092593
k( 130) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0092593
k( 131) = ( -0.6666667 0.6666667 0.3333333), wk = 0.0092593
k( 132) = ( -0.8333333 0.8333333 0.1666667), wk = 0.0092593
k( 133) = ( 0.1666667 0.1666667 1.1666667), wk = 0.0092593
k( 134) = ( 0.0000000 0.3333333 1.0000000), wk = 0.0092593
k( 135) = ( -0.1666667 0.5000000 0.8333333), wk = 0.0092593
k( 136) = ( -0.3333333 0.6666667 0.6666667), wk = 0.0092593
k( 137) = ( -0.5000000 0.8333333 0.5000000), wk = 0.0092593
k( 138) = ( -0.6666667 1.0000000 0.3333333), wk = 0.0092593
k( 139) = ( 0.3333333 0.3333333 1.3333333), wk = 0.0092593
k( 140) = ( 0.1666667 0.5000000 1.1666667), wk = 0.0092593
k( 141) = ( 0.0000000 0.6666667 1.0000000), wk = 0.0092593
k( 142) = ( -0.1666667 0.8333333 0.8333333), wk = 0.0092593
k( 143) = ( -0.3333333 1.0000000 0.6666667), wk = 0.0092593
k( 144) = ( -0.5000000 1.1666667 0.5000000), wk = 0.0092593
k( 145) = ( -0.6666667 -0.6666667 0.6666667), wk = 0.0092593
k( 146) = ( -0.8333333 -0.5000000 0.5000000), wk = 0.0092593
k( 147) = ( -1.0000000 -0.3333333 0.3333333), wk = 0.0092593
k( 148) = ( -1.1666667 -0.1666667 0.1666667), wk = 0.0092593
k( 149) = ( -1.3333333 0.0000000 0.0000000), wk = 0.0092593
k( 150) = ( -1.5000000 0.1666667 -0.1666667), wk = 0.0092593
k( 151) = ( -0.5000000 -0.5000000 0.8333333), wk = 0.0092593
k( 152) = ( -0.6666667 -0.3333333 0.6666667), wk = 0.0092593
k( 153) = ( -0.8333333 -0.1666667 0.5000000), wk = 0.0092593
k( 154) = ( -1.0000000 0.0000000 0.3333333), wk = 0.0092593
k( 155) = ( -1.1666667 0.1666667 0.1666667), wk = 0.0092593
k( 156) = ( -1.3333333 0.3333333 0.0000000), wk = 0.0092593
k( 157) = ( -0.3333333 -0.3333333 1.0000000), wk = 0.0092593
k( 158) = ( -0.5000000 -0.1666667 0.8333333), wk = 0.0092593
k( 159) = ( -0.6666667 -0.0000000 0.6666667), wk = 0.0092593
k( 160) = ( -0.8333333 0.1666667 0.5000000), wk = 0.0092593
k( 161) = ( -1.0000000 0.3333333 0.3333333), wk = 0.0092593
k( 162) = ( -1.1666667 0.5000000 0.1666667), wk = 0.0092593
k( 163) = ( -0.1666667 -0.1666667 1.1666667), wk = 0.0092593
k( 164) = ( -0.3333333 -0.0000000 1.0000000), wk = 0.0092593
k( 165) = ( -0.5000000 0.1666667 0.8333333), wk = 0.0092593
k( 166) = ( -0.6666667 0.3333333 0.6666667), wk = 0.0092593
k( 167) = ( -0.8333333 0.5000000 0.5000000), wk = 0.0092593
k( 168) = ( -1.0000000 0.6666667 0.3333333), wk = 0.0092593
k( 169) = ( 0.0000000 0.0000000 1.3333333), wk = 0.0092593
k( 170) = ( -0.1666667 0.1666667 1.1666667), wk = 0.0092593
k( 171) = ( -0.3333333 0.3333333 1.0000000), wk = 0.0092593
k( 172) = ( -0.5000000 0.5000000 0.8333333), wk = 0.0092593
k( 173) = ( -0.6666667 0.6666667 0.6666667), wk = 0.0092593
k( 174) = ( -0.8333333 0.8333333 0.5000000), wk = 0.0092593
k( 175) = ( 0.1666667 0.1666667 1.5000000), wk = 0.0092593
k( 176) = ( -0.0000000 0.3333333 1.3333333), wk = 0.0092593
k( 177) = ( -0.1666667 0.5000000 1.1666667), wk = 0.0092593
k( 178) = ( -0.3333333 0.6666667 1.0000000), wk = 0.0092593
k( 179) = ( -0.5000000 0.8333333 0.8333333), wk = 0.0092593
k( 180) = ( -0.6666667 1.0000000 0.6666667), wk = 0.0092593
k( 181) = ( -0.8333333 -0.8333333 0.8333333), wk = 0.0092593
k( 182) = ( -1.0000000 -0.6666667 0.6666667), wk = 0.0092593
k( 183) = ( -1.1666667 -0.5000000 0.5000000), wk = 0.0092593
k( 184) = ( -1.3333333 -0.3333333 0.3333333), wk = 0.0092593
k( 185) = ( -1.5000000 -0.1666667 0.1666667), wk = 0.0092593
k( 186) = ( -1.6666667 0.0000000 0.0000000), wk = 0.0092593
k( 187) = ( -0.6666667 -0.6666667 1.0000000), wk = 0.0092593
k( 188) = ( -0.8333333 -0.5000000 0.8333333), wk = 0.0092593
k( 189) = ( -1.0000000 -0.3333333 0.6666667), wk = 0.0092593
k( 190) = ( -1.1666667 -0.1666667 0.5000000), wk = 0.0092593
k( 191) = ( -1.3333333 0.0000000 0.3333333), wk = 0.0092593
k( 192) = ( -1.5000000 0.1666667 0.1666667), wk = 0.0092593
k( 193) = ( -0.5000000 -0.5000000 1.1666667), wk = 0.0092593
k( 194) = ( -0.6666667 -0.3333333 1.0000000), wk = 0.0092593
k( 195) = ( -0.8333333 -0.1666667 0.8333333), wk = 0.0092593
k( 196) = ( -1.0000000 0.0000000 0.6666667), wk = 0.0092593
k( 197) = ( -1.1666667 0.1666667 0.5000000), wk = 0.0092593
k( 198) = ( -1.3333333 0.3333333 0.3333333), wk = 0.0092593
k( 199) = ( -0.3333333 -0.3333333 1.3333333), wk = 0.0092593
k( 200) = ( -0.5000000 -0.1666667 1.1666667), wk = 0.0092593
k( 201) = ( -0.6666667 0.0000000 1.0000000), wk = 0.0092593
k( 202) = ( -0.8333333 0.1666667 0.8333333), wk = 0.0092593
k( 203) = ( -1.0000000 0.3333333 0.6666667), wk = 0.0092593
k( 204) = ( -1.1666667 0.5000000 0.5000000), wk = 0.0092593
k( 205) = ( -0.1666667 -0.1666667 1.5000000), wk = 0.0092593
k( 206) = ( -0.3333333 0.0000000 1.3333333), wk = 0.0092593
k( 207) = ( -0.5000000 0.1666667 1.1666667), wk = 0.0092593
k( 208) = ( -0.6666667 0.3333333 1.0000000), wk = 0.0092593
k( 209) = ( -0.8333333 0.5000000 0.8333333), wk = 0.0092593
k( 210) = ( -1.0000000 0.6666667 0.6666667), wk = 0.0092593
k( 211) = ( 0.0000000 0.0000000 1.6666667), wk = 0.0092593
k( 212) = ( -0.1666667 0.1666667 1.5000000), wk = 0.0092593
k( 213) = ( -0.3333333 0.3333333 1.3333333), wk = 0.0092593
k( 214) = ( -0.5000000 0.5000000 1.1666667), wk = 0.0092593
k( 215) = ( -0.6666667 0.6666667 1.0000000), wk = 0.0092593
k( 216) = ( -0.8333333 0.8333333 0.8333333), wk = 0.0092593
PseudoPot. # 1 for C read from file:
../pp/C_3.98148.UPF
MD5 check sum: 8b65adcd36341f53911399f4b6efa59f
Pseudo is Norm-conserving, Zval = 4.0
Generated by new atomic code, or converted to UPF format
Using radial grid of 461 points, 2 beta functions with:
l(1) = 0
l(2) = 1
EPW : 2.31s CPU 2.33s WALL
EPW : 2.41s CPU 2.43s WALL
No wavefunction gauge setting applied
-------------------------------------------------------------------
Wannierization on 6 x 6 x 6 electronic grid
-------------------------------------------------------------------
Spin CASE ( default = unpolarized )
Initializing Wannier90
Initial Wannier projections
( 0.00000 0.00000 0.00000) : l = -3 mr = 1
( 0.00000 0.00000 0.00000) : l = -3 mr = 2
( 0.00000 0.00000 0.00000) : l = -3 mr = 3
( 0.00000 0.00000 0.00000) : l = -3 mr = 4
- Number of bands is ( 4)
- Number of wannier functions is ( 4)
- All guiding functions are given
- All neighbours are found
AMN
k points = 216 in 1 pools
1 of 216 on ionode
2 of 216 on ionode
3 of 216 on ionode
4 of 216 on ionode
5 of 216 on ionode
6 of 216 on ionode
7 of 216 on ionode
8 of 216 on ionode
9 of 216 on ionode
10 of 216 on ionode
11 of 216 on ionode
12 of 216 on ionode
13 of 216 on ionode
14 of 216 on ionode
15 of 216 on ionode
16 of 216 on ionode
17 of 216 on ionode
18 of 216 on ionode
19 of 216 on ionode
20 of 216 on ionode
21 of 216 on ionode
22 of 216 on ionode
23 of 216 on ionode
24 of 216 on ionode
25 of 216 on ionode
26 of 216 on ionode
27 of 216 on ionode
28 of 216 on ionode
29 of 216 on ionode
30 of 216 on ionode
31 of 216 on ionode
32 of 216 on ionode
33 of 216 on ionode
34 of 216 on ionode
35 of 216 on ionode
36 of 216 on ionode
37 of 216 on ionode
38 of 216 on ionode
39 of 216 on ionode
40 of 216 on ionode
41 of 216 on ionode
42 of 216 on ionode
43 of 216 on ionode
44 of 216 on ionode
45 of 216 on ionode
46 of 216 on ionode
47 of 216 on ionode
48 of 216 on ionode
49 of 216 on ionode
50 of 216 on ionode
51 of 216 on ionode
52 of 216 on ionode
53 of 216 on ionode
54 of 216 on ionode
55 of 216 on ionode
56 of 216 on ionode
57 of 216 on ionode
58 of 216 on ionode
59 of 216 on ionode
60 of 216 on ionode
61 of 216 on ionode
62 of 216 on ionode
63 of 216 on ionode
64 of 216 on ionode
65 of 216 on ionode
66 of 216 on ionode
67 of 216 on ionode
68 of 216 on ionode
69 of 216 on ionode
70 of 216 on ionode
71 of 216 on ionode
72 of 216 on ionode
73 of 216 on ionode
74 of 216 on ionode
75 of 216 on ionode
76 of 216 on ionode
77 of 216 on ionode
78 of 216 on ionode
79 of 216 on ionode
80 of 216 on ionode
81 of 216 on ionode
82 of 216 on ionode
83 of 216 on ionode
84 of 216 on ionode
85 of 216 on ionode
86 of 216 on ionode
87 of 216 on ionode
88 of 216 on ionode
89 of 216 on ionode
90 of 216 on ionode
91 of 216 on ionode
92 of 216 on ionode
93 of 216 on ionode
94 of 216 on ionode
95 of 216 on ionode
96 of 216 on ionode
97 of 216 on ionode
98 of 216 on ionode
99 of 216 on ionode
100 of 216 on ionode
101 of 216 on ionode
102 of 216 on ionode
103 of 216 on ionode
104 of 216 on ionode
105 of 216 on ionode
106 of 216 on ionode
107 of 216 on ionode
108 of 216 on ionode
109 of 216 on ionode
110 of 216 on ionode
111 of 216 on ionode
112 of 216 on ionode
113 of 216 on ionode
114 of 216 on ionode
115 of 216 on ionode
116 of 216 on ionode
117 of 216 on ionode
118 of 216 on ionode
119 of 216 on ionode
120 of 216 on ionode
121 of 216 on ionode
122 of 216 on ionode
123 of 216 on ionode
124 of 216 on ionode
125 of 216 on ionode
126 of 216 on ionode
127 of 216 on ionode
128 of 216 on ionode
129 of 216 on ionode
130 of 216 on ionode
131 of 216 on ionode
132 of 216 on ionode
133 of 216 on ionode
134 of 216 on ionode
135 of 216 on ionode
136 of 216 on ionode
137 of 216 on ionode
138 of 216 on ionode
139 of 216 on ionode
140 of 216 on ionode
141 of 216 on ionode
142 of 216 on ionode
143 of 216 on ionode
144 of 216 on ionode
145 of 216 on ionode
146 of 216 on ionode
147 of 216 on ionode
148 of 216 on ionode
149 of 216 on ionode
150 of 216 on ionode
151 of 216 on ionode
152 of 216 on ionode
153 of 216 on ionode
154 of 216 on ionode
155 of 216 on ionode
156 of 216 on ionode
157 of 216 on ionode
158 of 216 on ionode
159 of 216 on ionode
160 of 216 on ionode
161 of 216 on ionode
162 of 216 on ionode
163 of 216 on ionode
164 of 216 on ionode
165 of 216 on ionode
166 of 216 on ionode
167 of 216 on ionode
168 of 216 on ionode
169 of 216 on ionode
170 of 216 on ionode
171 of 216 on ionode
172 of 216 on ionode
173 of 216 on ionode
174 of 216 on ionode
175 of 216 on ionode
176 of 216 on ionode
177 of 216 on ionode
178 of 216 on ionode
179 of 216 on ionode
180 of 216 on ionode
181 of 216 on ionode
182 of 216 on ionode
183 of 216 on ionode
184 of 216 on ionode
185 of 216 on ionode
186 of 216 on ionode
187 of 216 on ionode
188 of 216 on ionode
189 of 216 on ionode
190 of 216 on ionode
191 of 216 on ionode
192 of 216 on ionode
193 of 216 on ionode
194 of 216 on ionode
195 of 216 on ionode
196 of 216 on ionode
197 of 216 on ionode
198 of 216 on ionode
199 of 216 on ionode
200 of 216 on ionode
201 of 216 on ionode
202 of 216 on ionode
203 of 216 on ionode
204 of 216 on ionode
205 of 216 on ionode
206 of 216 on ionode
207 of 216 on ionode
208 of 216 on ionode
209 of 216 on ionode
210 of 216 on ionode
211 of 216 on ionode
212 of 216 on ionode
213 of 216 on ionode
214 of 216 on ionode
215 of 216 on ionode
216 of 216 on ionode
AMN calculated
MMN
k points = 216 in 1 pools
1 of 216 on ionode
2 of 216 on ionode
3 of 216 on ionode
4 of 216 on ionode
5 of 216 on ionode
6 of 216 on ionode
7 of 216 on ionode
8 of 216 on ionode
9 of 216 on ionode
10 of 216 on ionode
11 of 216 on ionode
12 of 216 on ionode
13 of 216 on ionode
14 of 216 on ionode
15 of 216 on ionode
16 of 216 on ionode
17 of 216 on ionode
18 of 216 on ionode
19 of 216 on ionode
20 of 216 on ionode
21 of 216 on ionode
22 of 216 on ionode
23 of 216 on ionode
24 of 216 on ionode
25 of 216 on ionode
26 of 216 on ionode
27 of 216 on ionode
28 of 216 on ionode
29 of 216 on ionode
30 of 216 on ionode
31 of 216 on ionode
32 of 216 on ionode
33 of 216 on ionode
34 of 216 on ionode
35 of 216 on ionode
36 of 216 on ionode
37 of 216 on ionode
38 of 216 on ionode
39 of 216 on ionode
40 of 216 on ionode
41 of 216 on ionode
42 of 216 on ionode
43 of 216 on ionode
44 of 216 on ionode
45 of 216 on ionode
46 of 216 on ionode
47 of 216 on ionode
48 of 216 on ionode
49 of 216 on ionode
50 of 216 on ionode
51 of 216 on ionode
52 of 216 on ionode
53 of 216 on ionode
54 of 216 on ionode
55 of 216 on ionode
56 of 216 on ionode
57 of 216 on ionode
58 of 216 on ionode
59 of 216 on ionode
60 of 216 on ionode
61 of 216 on ionode
62 of 216 on ionode
63 of 216 on ionode
64 of 216 on ionode
65 of 216 on ionode
66 of 216 on ionode
67 of 216 on ionode
68 of 216 on ionode
69 of 216 on ionode
70 of 216 on ionode
71 of 216 on ionode
72 of 216 on ionode
73 of 216 on ionode
74 of 216 on ionode
75 of 216 on ionode
76 of 216 on ionode
77 of 216 on ionode
78 of 216 on ionode
79 of 216 on ionode
80 of 216 on ionode
81 of 216 on ionode
82 of 216 on ionode
83 of 216 on ionode
84 of 216 on ionode
85 of 216 on ionode
86 of 216 on ionode
87 of 216 on ionode
88 of 216 on ionode
89 of 216 on ionode
90 of 216 on ionode
91 of 216 on ionode
92 of 216 on ionode
93 of 216 on ionode
94 of 216 on ionode
95 of 216 on ionode
96 of 216 on ionode
97 of 216 on ionode
98 of 216 on ionode
99 of 216 on ionode
100 of 216 on ionode
101 of 216 on ionode
102 of 216 on ionode
103 of 216 on ionode
104 of 216 on ionode
105 of 216 on ionode
106 of 216 on ionode
107 of 216 on ionode
108 of 216 on ionode
109 of 216 on ionode
110 of 216 on ionode
111 of 216 on ionode
112 of 216 on ionode
113 of 216 on ionode
114 of 216 on ionode
115 of 216 on ionode
116 of 216 on ionode
117 of 216 on ionode
118 of 216 on ionode
119 of 216 on ionode
120 of 216 on ionode
121 of 216 on ionode
122 of 216 on ionode
123 of 216 on ionode
124 of 216 on ionode
125 of 216 on ionode
126 of 216 on ionode
127 of 216 on ionode
128 of 216 on ionode
129 of 216 on ionode
130 of 216 on ionode
131 of 216 on ionode
132 of 216 on ionode
133 of 216 on ionode
134 of 216 on ionode
135 of 216 on ionode
136 of 216 on ionode
137 of 216 on ionode
138 of 216 on ionode
139 of 216 on ionode
140 of 216 on ionode
141 of 216 on ionode
142 of 216 on ionode
143 of 216 on ionode
144 of 216 on ionode
145 of 216 on ionode
146 of 216 on ionode
147 of 216 on ionode
148 of 216 on ionode
149 of 216 on ionode
150 of 216 on ionode
151 of 216 on ionode
152 of 216 on ionode
153 of 216 on ionode
154 of 216 on ionode
155 of 216 on ionode
156 of 216 on ionode
157 of 216 on ionode
158 of 216 on ionode
159 of 216 on ionode
160 of 216 on ionode
161 of 216 on ionode
162 of 216 on ionode
163 of 216 on ionode
164 of 216 on ionode
165 of 216 on ionode
166 of 216 on ionode
167 of 216 on ionode
168 of 216 on ionode
169 of 216 on ionode
170 of 216 on ionode
171 of 216 on ionode
172 of 216 on ionode
173 of 216 on ionode
174 of 216 on ionode
175 of 216 on ionode
176 of 216 on ionode
177 of 216 on ionode
178 of 216 on ionode
179 of 216 on ionode
180 of 216 on ionode
181 of 216 on ionode
182 of 216 on ionode
183 of 216 on ionode
184 of 216 on ionode
185 of 216 on ionode
186 of 216 on ionode
187 of 216 on ionode
188 of 216 on ionode
189 of 216 on ionode
190 of 216 on ionode
191 of 216 on ionode
192 of 216 on ionode
193 of 216 on ionode
194 of 216 on ionode
195 of 216 on ionode
196 of 216 on ionode
197 of 216 on ionode
198 of 216 on ionode
199 of 216 on ionode
200 of 216 on ionode
201 of 216 on ionode
202 of 216 on ionode
203 of 216 on ionode
204 of 216 on ionode
205 of 216 on ionode
206 of 216 on ionode
207 of 216 on ionode
208 of 216 on ionode
209 of 216 on ionode
210 of 216 on ionode
211 of 216 on ionode
212 of 216 on ionode
213 of 216 on ionode
214 of 216 on ionode
215 of 216 on ionode
216 of 216 on ionode
MMN calculated
Running Wannier90
Wannier Function centers (cartesian, alat) and spreads (ang):
( 0.12500 0.12500 0.12500) : 0.71730
( 0.12500 -0.12500 -0.12500) : 0.71730
( -0.12500 0.12500 -0.12500) : 0.71730
( -0.12500 -0.12500 0.12500) : 0.71730
-------------------------------------------------------------------
WANNIER : 24.95s CPU 25.32s WALL ( 1 calls)
-------------------------------------------------------------------
Dipole matrix elements calculated
Calculating kmap and kgmap
Progress kmap: ########################################
Progress kgmap: ########################################
kmaps : 2.69s CPU 2.78s WALL ( 1 calls)
===================================================================
irreducible q point # 1
===================================================================
Number of q in the star = 1
List of q in the star:
1 0.000000000 0.000000000 0.000000000
Imposing acoustic sum rule on the dynamical matrix
q( 1 ) = ( 0.0000000 0.0000000 0.0000000 )
elphmat(:,:,:)**2 1.996111
elphmat(:,:,:)**2 3.7069060E-02
el_ph_mat(:,:,215,:)**2 2.033180
===================================================================
irreducible q point # 2
===================================================================
Number of q in the star = 8
List of q in the star:
1 -0.166666700 0.166666700 -0.166666700
2 0.166666700 -0.166666700 -0.166666700
3 0.166666700 0.166666700 0.166666700
4 -0.166666700 -0.166666700 0.166666700
5 0.166666700 -0.166666700 0.166666700
6 -0.166666700 0.166666700 0.166666700
7 0.166666700 0.166666700 -0.166666700
8 -0.166666700 -0.166666700 -0.166666700
q( 2 ) = ( -0.1666667 0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.4770591
elphmat(:,:,:)**2 0.4770592
elphmat(:,:,:)**2 0.9003204
elphmat(:,:,:)**2 0.9003206
el_ph_mat(:,:,215,:)**2 2.754759
q( 3 ) = ( 0.1666667 -0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.2461126
elphmat(:,:,:)**2 0.2461126
elphmat(:,:,:)**2 0.7544200
elphmat(:,:,:)**2 0.7544203
el_ph_mat(:,:,215,:)**2 2.001065
q( 4 ) = ( 0.1666667 0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.4971961
elphmat(:,:,:)**2 0.4971962
elphmat(:,:,:)**2 0.5997871
elphmat(:,:,:)**2 0.5997871
el_ph_mat(:,:,215,:)**2 2.193967
q( 5 ) = ( -0.1666667 -0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.4971961
elphmat(:,:,:)**2 0.4971962
elphmat(:,:,:)**2 0.5997870
elphmat(:,:,:)**2 0.5997871
el_ph_mat(:,:,215,:)**2 2.193966
q( 6 ) = ( 0.1666667 -0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.2461126
elphmat(:,:,:)**2 0.2461126
elphmat(:,:,:)**2 0.7544200
elphmat(:,:,:)**2 0.7544202
el_ph_mat(:,:,215,:)**2 2.001065
q( 7 ) = ( -0.1666667 0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.4770592
elphmat(:,:,:)**2 0.4770592
elphmat(:,:,:)**2 0.9003205
elphmat(:,:,:)**2 0.9003205
el_ph_mat(:,:,215,:)**2 2.754759
q( 8 ) = ( 0.1666667 0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.4971962
elphmat(:,:,:)**2 0.4971962
elphmat(:,:,:)**2 0.5997870
elphmat(:,:,:)**2 0.5997870
el_ph_mat(:,:,215,:)**2 2.193966
q( 9 ) = ( -0.1666667 -0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.4971961
elphmat(:,:,:)**2 0.4971962
elphmat(:,:,:)**2 0.5997870
elphmat(:,:,:)**2 0.5997870
el_ph_mat(:,:,215,:)**2 2.193966
===================================================================
irreducible q point # 3
===================================================================
Number of q in the star = 8
List of q in the star:
1 -0.333333300 0.333333300 -0.333333300
2 0.333333300 -0.333333300 -0.333333300
3 0.333333300 0.333333300 0.333333300
4 -0.333333300 -0.333333300 0.333333300
5 0.333333300 -0.333333300 0.333333300
6 -0.333333300 0.333333300 0.333333300
7 0.333333300 0.333333300 -0.333333300
8 -0.333333300 -0.333333300 -0.333333300
q( 10 ) = ( -0.3333333 0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.7315281
elphmat(:,:,:)**2 0.7315282
elphmat(:,:,:)**2 0.9076785
elphmat(:,:,:)**2 0.9076785
el_ph_mat(:,:,215,:)**2 3.278413
q( 11 ) = ( 0.3333333 -0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.4570173
elphmat(:,:,:)**2 0.4570173
elphmat(:,:,:)**2 0.7806790
elphmat(:,:,:)**2 0.7806792
el_ph_mat(:,:,215,:)**2 2.475393
q( 12 ) = ( 0.3333333 0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.5630953
elphmat(:,:,:)**2 0.5630955
elphmat(:,:,:)**2 0.6218637
elphmat(:,:,:)**2 0.6218639
el_ph_mat(:,:,215,:)**2 2.369919
q( 13 ) = ( -0.3333333 -0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.5630953
elphmat(:,:,:)**2 0.5630953
elphmat(:,:,:)**2 0.6218637
elphmat(:,:,:)**2 0.6218638
el_ph_mat(:,:,215,:)**2 2.369918
q( 14 ) = ( 0.3333333 -0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.4570173
elphmat(:,:,:)**2 0.4570173
elphmat(:,:,:)**2 0.7806789
elphmat(:,:,:)**2 0.7806791
el_ph_mat(:,:,215,:)**2 2.475393
q( 15 ) = ( -0.3333333 0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.7315283
elphmat(:,:,:)**2 0.7315283
elphmat(:,:,:)**2 0.9076785
elphmat(:,:,:)**2 0.9076784
el_ph_mat(:,:,215,:)**2 3.278413
q( 16 ) = ( 0.3333333 0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.5630953
elphmat(:,:,:)**2 0.5630955
elphmat(:,:,:)**2 0.6218637
elphmat(:,:,:)**2 0.6218638
el_ph_mat(:,:,215,:)**2 2.369918
q( 17 ) = ( -0.3333333 -0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.5630954
elphmat(:,:,:)**2 0.5630955
elphmat(:,:,:)**2 0.6218638
elphmat(:,:,:)**2 0.6218639
el_ph_mat(:,:,215,:)**2 2.369918
===================================================================
irreducible q point # 4
===================================================================
Number of q in the star = 4
List of q in the star:
1 0.500000000 -0.500000000 0.500000000
2 -0.500000000 0.500000000 0.500000000
3 -0.500000000 -0.500000000 -0.500000000
4 0.500000000 0.500000000 -0.500000000
q( 18 ) = ( 0.5000000 -0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.6036745
elphmat(:,:,:)**2 0.7009463
elphmat(:,:,:)**2 4.8980772E-02
elphmat(:,:,:)**2 1.618388
el_ph_mat(:,:,215,:)**2 2.971990
q( 19 ) = ( -0.5000000 0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.6036745
elphmat(:,:,:)**2 0.7009463
elphmat(:,:,:)**2 4.8980765E-02
elphmat(:,:,:)**2 1.618388
el_ph_mat(:,:,215,:)**2 2.971990
q( 20 ) = ( -0.5000000 -0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.4548423
elphmat(:,:,:)**2 0.7041895
elphmat(:,:,:)**2 6.5057121E-02
elphmat(:,:,:)**2 1.163253
el_ph_mat(:,:,215,:)**2 2.387342
q( 21 ) = ( 0.5000000 0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.4548423
elphmat(:,:,:)**2 0.7041895
elphmat(:,:,:)**2 6.5057106E-02
elphmat(:,:,:)**2 1.163253
el_ph_mat(:,:,215,:)**2 2.387342
===================================================================
irreducible q point # 5
===================================================================
Number of q in the star = 6
List of q in the star:
1 0.000000000 0.333333300 0.000000000
2 0.000000000 -0.333333300 0.000000000
3 0.333333300 0.000000000 0.000000000
4 -0.333333300 0.000000000 0.000000000
5 0.000000000 0.000000000 0.333333300
6 0.000000000 0.000000000 -0.333333300
q( 22 ) = ( 0.0000000 0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.1159083
elphmat(:,:,:)**2 0.9511036
elphmat(:,:,:)**2 1.306178
elphmat(:,:,:)**2 0.3075519
el_ph_mat(:,:,215,:)**2 2.680742
q( 23 ) = ( 0.0000000 -0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.1725838
elphmat(:,:,:)**2 0.5134646
elphmat(:,:,:)**2 0.9800900
elphmat(:,:,:)**2 0.2811199
el_ph_mat(:,:,215,:)**2 1.947258
q( 24 ) = ( 0.3333333 0.0000000 0.0000000 )
elphmat(:,:,:)**2 0.1725838
elphmat(:,:,:)**2 0.5134645
elphmat(:,:,:)**2 0.9800898
elphmat(:,:,:)**2 0.2811199
el_ph_mat(:,:,215,:)**2 1.947258
q( 25 ) = ( -0.3333333 0.0000000 0.0000000 )
elphmat(:,:,:)**2 0.1159084
elphmat(:,:,:)**2 0.9511035
elphmat(:,:,:)**2 1.306178
elphmat(:,:,:)**2 0.3075519
el_ph_mat(:,:,215,:)**2 2.680741
q( 26 ) = ( 0.0000000 0.0000000 0.3333333 )
elphmat(:,:,:)**2 0.1328468
elphmat(:,:,:)**2 0.8234712
elphmat(:,:,:)**2 1.180627
elphmat(:,:,:)**2 0.3005324
el_ph_mat(:,:,215,:)**2 2.437477
q( 27 ) = ( 0.0000000 0.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.1328468
elphmat(:,:,:)**2 0.8234710
elphmat(:,:,:)**2 1.180627
elphmat(:,:,:)**2 0.3005324
el_ph_mat(:,:,215,:)**2 2.437478
===================================================================
irreducible q point # 6
===================================================================
Number of q in the star = 24
List of q in the star:
1 -0.166666700 0.500000000 -0.166666700
2 0.166666700 -0.500000000 -0.166666700
3 0.166666700 0.500000000 0.166666700
4 -0.166666700 -0.500000000 0.166666700
5 0.500000000 -0.166666700 0.166666700
6 -0.500000000 0.166666700 0.166666700
7 0.500000000 0.166666700 -0.166666700
8 -0.500000000 -0.166666700 -0.166666700
9 -0.166666700 -0.500000000 -0.166666700
10 0.166666700 -0.500000000 0.166666700
11 -0.166666700 0.500000000 0.166666700
12 0.166666700 0.500000000 -0.166666700
13 0.166666700 -0.166666700 0.500000000
14 0.166666700 0.166666700 -0.500000000
15 -0.166666700 -0.166666700 -0.500000000
16 -0.166666700 0.166666700 0.500000000
17 0.500000000 -0.166666700 -0.166666700
18 -0.500000000 -0.166666700 0.166666700
19 0.500000000 0.166666700 0.166666700
20 -0.500000000 0.166666700 -0.166666700
21 -0.166666700 -0.166666700 0.500000000
22 -0.166666700 0.166666700 -0.500000000
23 0.166666700 0.166666700 0.500000000
24 0.166666700 -0.166666700 -0.500000000
q( 28 ) = ( -0.1666667 0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.5675458
elphmat(:,:,:)**2 0.6729478
elphmat(:,:,:)**2 0.6551896
elphmat(:,:,:)**2 0.5497680
elphmat(:,:,:)**2 0.4030650
elphmat(:,:,:)**2 0.4030650
el_ph_mat(:,:,215,:)**2 3.251581
q( 29 ) = ( 0.1666667 -0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.3174961
elphmat(:,:,:)**2 0.4456227
elphmat(:,:,:)**2 0.4230502
elphmat(:,:,:)**2 0.2949080
elphmat(:,:,:)**2 0.3233494
elphmat(:,:,:)**2 0.3233494
el_ph_mat(:,:,215,:)**2 2.127776
q( 30 ) = ( 0.1666667 0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.4738122
elphmat(:,:,:)**2 0.4940929
elphmat(:,:,:)**2 0.4085160
elphmat(:,:,:)**2 0.3882174
elphmat(:,:,:)**2 0.3962498
elphmat(:,:,:)**2 0.3962498
el_ph_mat(:,:,215,:)**2 2.557138
q( 31 ) = ( -0.1666667 -0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.3248652
elphmat(:,:,:)**2 0.4227991
elphmat(:,:,:)**2 0.4412191
elphmat(:,:,:)**2 0.3432752
elphmat(:,:,:)**2 0.3052785
elphmat(:,:,:)**2 0.3052785
el_ph_mat(:,:,215,:)**2 2.142716
q( 32 ) = ( 0.5000000 -0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.3174961
elphmat(:,:,:)**2 0.4456228
elphmat(:,:,:)**2 0.4230502
elphmat(:,:,:)**2 0.2949079
elphmat(:,:,:)**2 0.3233494
elphmat(:,:,:)**2 0.3233494
el_ph_mat(:,:,215,:)**2 2.127776
q( 33 ) = ( -0.5000000 0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.5675460
elphmat(:,:,:)**2 0.6729478
elphmat(:,:,:)**2 0.6551896
elphmat(:,:,:)**2 0.5497681
elphmat(:,:,:)**2 0.4030651
elphmat(:,:,:)**2 0.4030651
el_ph_mat(:,:,215,:)**2 3.251582
q( 34 ) = ( 0.5000000 0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.3248652
elphmat(:,:,:)**2 0.4227991
elphmat(:,:,:)**2 0.4412192
elphmat(:,:,:)**2 0.3432752
elphmat(:,:,:)**2 0.3052785
elphmat(:,:,:)**2 0.3052785
el_ph_mat(:,:,215,:)**2 2.142716
q( 35 ) = ( -0.5000000 -0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.4738122
elphmat(:,:,:)**2 0.4940928
elphmat(:,:,:)**2 0.4085161
elphmat(:,:,:)**2 0.3882174
elphmat(:,:,:)**2 0.3962498
elphmat(:,:,:)**2 0.3962498
el_ph_mat(:,:,215,:)**2 2.557138
q( 36 ) = ( -0.1666667 -0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.3248652
elphmat(:,:,:)**2 0.4227992
elphmat(:,:,:)**2 0.4412192
elphmat(:,:,:)**2 0.3432752
elphmat(:,:,:)**2 0.3052785
elphmat(:,:,:)**2 0.3052786
el_ph_mat(:,:,215,:)**2 2.142716
q( 37 ) = ( 0.1666667 -0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.3174960
elphmat(:,:,:)**2 0.4456227
elphmat(:,:,:)**2 0.4230502
elphmat(:,:,:)**2 0.2949080
elphmat(:,:,:)**2 0.3233493
elphmat(:,:,:)**2 0.3233494
el_ph_mat(:,:,215,:)**2 2.127775
q( 38 ) = ( -0.1666667 0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.5675459
elphmat(:,:,:)**2 0.6729477
elphmat(:,:,:)**2 0.6551898
elphmat(:,:,:)**2 0.5497680
elphmat(:,:,:)**2 0.4030651
elphmat(:,:,:)**2 0.4030651
el_ph_mat(:,:,215,:)**2 3.251581
q( 39 ) = ( 0.1666667 0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.4738122
elphmat(:,:,:)**2 0.4940928
elphmat(:,:,:)**2 0.4085160
elphmat(:,:,:)**2 0.3882174
elphmat(:,:,:)**2 0.3962498
elphmat(:,:,:)**2 0.3962498
el_ph_mat(:,:,215,:)**2 2.557138
q( 40 ) = ( 0.1666667 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4149035
elphmat(:,:,:)**2 0.5067775
elphmat(:,:,:)**2 0.4148640
elphmat(:,:,:)**2 0.3229662
elphmat(:,:,:)**2 0.4988950
elphmat(:,:,:)**2 0.4988950
el_ph_mat(:,:,215,:)**2 2.657301
q( 41 ) = ( 0.1666667 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4329772
elphmat(:,:,:)**2 0.5479940
elphmat(:,:,:)**2 0.5502273
elphmat(:,:,:)**2 0.4351998
elphmat(:,:,:)**2 0.2735846
elphmat(:,:,:)**2 0.2735846
el_ph_mat(:,:,215,:)**2 2.513568
q( 42 ) = ( -0.1666667 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4329773
elphmat(:,:,:)**2 0.5479940
elphmat(:,:,:)**2 0.5502273
elphmat(:,:,:)**2 0.4351998
elphmat(:,:,:)**2 0.2735846
elphmat(:,:,:)**2 0.2735846
el_ph_mat(:,:,215,:)**2 2.513568
q( 43 ) = ( -0.1666667 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4912581
elphmat(:,:,:)**2 0.5031996
elphmat(:,:,:)**2 0.3991033
elphmat(:,:,:)**2 0.3871444
elphmat(:,:,:)**2 0.4866869
elphmat(:,:,:)**2 0.4866870
el_ph_mat(:,:,215,:)**2 2.754079
q( 44 ) = ( 0.5000000 -0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.3174960
elphmat(:,:,:)**2 0.4456227
elphmat(:,:,:)**2 0.4230502
elphmat(:,:,:)**2 0.2949079
elphmat(:,:,:)**2 0.3233494
elphmat(:,:,:)**2 0.3233494
el_ph_mat(:,:,215,:)**2 2.127775
q( 45 ) = ( -0.5000000 -0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.4738122
elphmat(:,:,:)**2 0.4940929
elphmat(:,:,:)**2 0.4085160
elphmat(:,:,:)**2 0.3882175
elphmat(:,:,:)**2 0.3962498
elphmat(:,:,:)**2 0.3962498
el_ph_mat(:,:,215,:)**2 2.557138
q( 46 ) = ( 0.5000000 0.1666667 0.1666667 )
elphmat(:,:,:)**2 0.3248652
elphmat(:,:,:)**2 0.4227991
elphmat(:,:,:)**2 0.4412192
elphmat(:,:,:)**2 0.3432753
elphmat(:,:,:)**2 0.3052786
elphmat(:,:,:)**2 0.3052785
el_ph_mat(:,:,215,:)**2 2.142716
q( 47 ) = ( -0.5000000 0.1666667 -0.1666667 )
elphmat(:,:,:)**2 0.5675458
elphmat(:,:,:)**2 0.6729478
elphmat(:,:,:)**2 0.6551896
elphmat(:,:,:)**2 0.5497680
elphmat(:,:,:)**2 0.4030650
elphmat(:,:,:)**2 0.4030651
el_ph_mat(:,:,215,:)**2 3.251581
q( 48 ) = ( -0.1666667 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4329772
elphmat(:,:,:)**2 0.5479941
elphmat(:,:,:)**2 0.5502273
elphmat(:,:,:)**2 0.4351998
elphmat(:,:,:)**2 0.2735846
elphmat(:,:,:)**2 0.2735846
el_ph_mat(:,:,215,:)**2 2.513567
q( 49 ) = ( -0.1666667 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4912580
elphmat(:,:,:)**2 0.5031996
elphmat(:,:,:)**2 0.3991033
elphmat(:,:,:)**2 0.3871443
elphmat(:,:,:)**2 0.4866871
elphmat(:,:,:)**2 0.4866870
el_ph_mat(:,:,215,:)**2 2.754079
q( 50 ) = ( 0.1666667 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4329773
elphmat(:,:,:)**2 0.5479941
elphmat(:,:,:)**2 0.5502273
elphmat(:,:,:)**2 0.4351998
elphmat(:,:,:)**2 0.2735845
elphmat(:,:,:)**2 0.2735846
el_ph_mat(:,:,215,:)**2 2.513568
q( 51 ) = ( 0.1666667 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4149035
elphmat(:,:,:)**2 0.5067775
elphmat(:,:,:)**2 0.4148640
elphmat(:,:,:)**2 0.3229662
elphmat(:,:,:)**2 0.4988950
elphmat(:,:,:)**2 0.4988950
el_ph_mat(:,:,215,:)**2 2.657301
===================================================================
irreducible q point # 7
===================================================================
Number of q in the star = 24
List of q in the star:
1 0.666666700 -0.333333300 0.666666700
2 -0.666666700 0.333333300 0.666666700
3 -0.666666700 -0.333333300 -0.666666700
4 0.666666700 0.333333300 -0.666666700
5 -0.333333300 0.666666700 -0.666666700
6 0.333333300 -0.666666700 -0.666666700
7 -0.333333300 -0.666666700 0.666666700
8 0.333333300 0.666666700 0.666666700
9 0.666666700 0.333333300 0.666666700
10 -0.666666700 0.333333300 -0.666666700
11 0.666666700 -0.333333300 -0.666666700
12 -0.666666700 -0.333333300 0.666666700
13 -0.666666700 0.666666700 -0.333333300
14 -0.666666700 -0.666666700 0.333333300
15 0.666666700 0.666666700 0.333333300
16 0.666666700 -0.666666700 -0.333333300
17 -0.333333300 0.666666700 0.666666700
18 0.333333300 0.666666700 -0.666666700
19 -0.333333300 -0.666666700 -0.666666700
20 0.333333300 -0.666666700 0.666666700
21 0.666666700 0.666666700 -0.333333300
22 0.666666700 -0.666666700 0.333333300
23 -0.666666700 -0.666666700 -0.333333300
24 -0.666666700 0.666666700 0.333333300
q( 52 ) = ( 0.6666667 -0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.4983734
elphmat(:,:,:)**2 0.6361965
elphmat(:,:,:)**2 0.6734195
elphmat(:,:,:)**2 0.5355986
elphmat(:,:,:)**2 0.3943561
elphmat(:,:,:)**2 0.3943561
el_ph_mat(:,:,215,:)**2 3.132300
q( 53 ) = ( -0.6666667 0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.3690152
elphmat(:,:,:)**2 0.5378419
elphmat(:,:,:)**2 0.5401778
elphmat(:,:,:)**2 0.3713467
elphmat(:,:,:)**2 0.3465182
elphmat(:,:,:)**2 0.3465182
el_ph_mat(:,:,215,:)**2 2.511418
q( 54 ) = ( -0.6666667 -0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.4746550
elphmat(:,:,:)**2 0.4338498
elphmat(:,:,:)**2 0.4028704
elphmat(:,:,:)**2 0.4436688
elphmat(:,:,:)**2 0.3766114
elphmat(:,:,:)**2 0.3766114
el_ph_mat(:,:,215,:)**2 2.508266
q( 55 ) = ( 0.6666667 0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.2803517
elphmat(:,:,:)**2 0.4936786
elphmat(:,:,:)**2 0.5589252
elphmat(:,:,:)**2 0.3456055
elphmat(:,:,:)**2 0.3099976
elphmat(:,:,:)**2 0.3099976
el_ph_mat(:,:,215,:)**2 2.298556
q( 56 ) = ( -0.3333333 0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.3690152
elphmat(:,:,:)**2 0.5378417
elphmat(:,:,:)**2 0.5401778
elphmat(:,:,:)**2 0.3713466
elphmat(:,:,:)**2 0.3465182
elphmat(:,:,:)**2 0.3465182
el_ph_mat(:,:,215,:)**2 2.511418
q( 57 ) = ( 0.3333333 -0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.4983734
elphmat(:,:,:)**2 0.6361966
elphmat(:,:,:)**2 0.6734195
elphmat(:,:,:)**2 0.5355986
elphmat(:,:,:)**2 0.3943562
elphmat(:,:,:)**2 0.3943562
el_ph_mat(:,:,215,:)**2 3.132300
q( 58 ) = ( -0.3333333 -0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.2803516
elphmat(:,:,:)**2 0.4936786
elphmat(:,:,:)**2 0.5589252
elphmat(:,:,:)**2 0.3456055
elphmat(:,:,:)**2 0.3099976
elphmat(:,:,:)**2 0.3099976
el_ph_mat(:,:,215,:)**2 2.298556
q( 59 ) = ( 0.3333333 0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.4746550
elphmat(:,:,:)**2 0.4338499
elphmat(:,:,:)**2 0.4028704
elphmat(:,:,:)**2 0.4436688
elphmat(:,:,:)**2 0.3766115
elphmat(:,:,:)**2 0.3766115
el_ph_mat(:,:,215,:)**2 2.508267
q( 60 ) = ( 0.6666667 0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.2803517
elphmat(:,:,:)**2 0.4936786
elphmat(:,:,:)**2 0.5589252
elphmat(:,:,:)**2 0.3456055
elphmat(:,:,:)**2 0.3099976
elphmat(:,:,:)**2 0.3099976
el_ph_mat(:,:,215,:)**2 2.298556
q( 61 ) = ( -0.6666667 0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.3690151
elphmat(:,:,:)**2 0.5378418
elphmat(:,:,:)**2 0.5401778
elphmat(:,:,:)**2 0.3713466
elphmat(:,:,:)**2 0.3465182
elphmat(:,:,:)**2 0.3465182
el_ph_mat(:,:,215,:)**2 2.511418
q( 62 ) = ( 0.6666667 -0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.4983734
elphmat(:,:,:)**2 0.6361966
elphmat(:,:,:)**2 0.6734196
elphmat(:,:,:)**2 0.5355986
elphmat(:,:,:)**2 0.3943562
elphmat(:,:,:)**2 0.3943562
el_ph_mat(:,:,215,:)**2 3.132300
q( 63 ) = ( -0.6666667 -0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.4746550
elphmat(:,:,:)**2 0.4338498
elphmat(:,:,:)**2 0.4028704
elphmat(:,:,:)**2 0.4436688
elphmat(:,:,:)**2 0.3766115
elphmat(:,:,:)**2 0.3766115
el_ph_mat(:,:,215,:)**2 2.508267
q( 64 ) = ( -0.6666667 0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.4870161
elphmat(:,:,:)**2 0.6141216
elphmat(:,:,:)**2 0.5754805
elphmat(:,:,:)**2 0.4483694
elphmat(:,:,:)**2 0.5095136
elphmat(:,:,:)**2 0.5095137
el_ph_mat(:,:,215,:)**2 3.144015
q( 65 ) = ( -0.6666667 -0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.3954475
elphmat(:,:,:)**2 0.5332971
elphmat(:,:,:)**2 0.5413803
elphmat(:,:,:)**2 0.4035279
elphmat(:,:,:)**2 0.2769572
elphmat(:,:,:)**2 0.2769572
el_ph_mat(:,:,215,:)**2 2.427567
q( 66 ) = ( 0.6666667 0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.3954476
elphmat(:,:,:)**2 0.5332971
elphmat(:,:,:)**2 0.5413802
elphmat(:,:,:)**2 0.4035279
elphmat(:,:,:)**2 0.2769572
elphmat(:,:,:)**2 0.2769571
el_ph_mat(:,:,215,:)**2 2.427567
q( 67 ) = ( 0.6666667 -0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.4526339
elphmat(:,:,:)**2 0.4661480
elphmat(:,:,:)**2 0.4447462
elphmat(:,:,:)**2 0.4312325
elphmat(:,:,:)**2 0.4312063
elphmat(:,:,:)**2 0.4312062
el_ph_mat(:,:,215,:)**2 2.657173
q( 68 ) = ( -0.3333333 0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.3690151
elphmat(:,:,:)**2 0.5378419
elphmat(:,:,:)**2 0.5401778
elphmat(:,:,:)**2 0.3713465
elphmat(:,:,:)**2 0.3465182
elphmat(:,:,:)**2 0.3465182
el_ph_mat(:,:,215,:)**2 2.511418
q( 69 ) = ( 0.3333333 0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.4746550
elphmat(:,:,:)**2 0.4338498
elphmat(:,:,:)**2 0.4028705
elphmat(:,:,:)**2 0.4436688
elphmat(:,:,:)**2 0.3766115
elphmat(:,:,:)**2 0.3766114
el_ph_mat(:,:,215,:)**2 2.508267
q( 70 ) = ( -0.3333333 -0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.2803517
elphmat(:,:,:)**2 0.4936785
elphmat(:,:,:)**2 0.5589252
elphmat(:,:,:)**2 0.3456055
elphmat(:,:,:)**2 0.3099977
elphmat(:,:,:)**2 0.3099976
el_ph_mat(:,:,215,:)**2 2.298556
q( 71 ) = ( 0.3333333 -0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.4983734
elphmat(:,:,:)**2 0.6361966
elphmat(:,:,:)**2 0.6734195
elphmat(:,:,:)**2 0.5355986
elphmat(:,:,:)**2 0.3943561
elphmat(:,:,:)**2 0.3943562
el_ph_mat(:,:,215,:)**2 3.132300
q( 72 ) = ( 0.6666667 0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.3954476
elphmat(:,:,:)**2 0.5332972
elphmat(:,:,:)**2 0.5413802
elphmat(:,:,:)**2 0.4035279
elphmat(:,:,:)**2 0.2769571
elphmat(:,:,:)**2 0.2769572
el_ph_mat(:,:,215,:)**2 2.427567
q( 73 ) = ( 0.6666667 -0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.4526339
elphmat(:,:,:)**2 0.4661480
elphmat(:,:,:)**2 0.4447461
elphmat(:,:,:)**2 0.4312325
elphmat(:,:,:)**2 0.4312063
elphmat(:,:,:)**2 0.4312062
el_ph_mat(:,:,215,:)**2 2.657173
q( 74 ) = ( -0.6666667 -0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.3954475
elphmat(:,:,:)**2 0.5332972
elphmat(:,:,:)**2 0.5413803
elphmat(:,:,:)**2 0.4035279
elphmat(:,:,:)**2 0.2769571
elphmat(:,:,:)**2 0.2769572
el_ph_mat(:,:,215,:)**2 2.427567
q( 75 ) = ( -0.6666667 0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.4870161
elphmat(:,:,:)**2 0.6141217
elphmat(:,:,:)**2 0.5754805
elphmat(:,:,:)**2 0.4483693
elphmat(:,:,:)**2 0.5095138
elphmat(:,:,:)**2 0.5095137
el_ph_mat(:,:,215,:)**2 3.144015
===================================================================
irreducible q point # 8
===================================================================
Number of q in the star = 24
List of q in the star:
1 0.500000000 -0.166666700 0.500000000
2 -0.500000000 0.166666700 0.500000000
3 -0.500000000 -0.166666700 -0.500000000
4 0.500000000 0.166666700 -0.500000000
5 -0.166666700 0.500000000 -0.500000000
6 0.166666700 -0.500000000 -0.500000000
7 -0.166666700 -0.500000000 0.500000000
8 0.166666700 0.500000000 0.500000000
9 0.500000000 0.166666700 0.500000000
10 -0.500000000 0.166666700 -0.500000000
11 0.500000000 -0.166666700 -0.500000000
12 -0.500000000 -0.166666700 0.500000000
13 -0.500000000 0.500000000 -0.166666700
14 -0.500000000 -0.500000000 0.166666700
15 0.500000000 0.500000000 0.166666700
16 0.500000000 -0.500000000 -0.166666700
17 -0.166666700 0.500000000 0.500000000
18 0.166666700 0.500000000 -0.500000000
19 -0.166666700 -0.500000000 -0.500000000
20 0.166666700 -0.500000000 0.500000000
21 0.500000000 0.500000000 -0.166666700
22 0.500000000 -0.500000000 0.166666700
23 -0.500000000 -0.500000000 -0.166666700
24 -0.500000000 0.500000000 0.166666700
q( 76 ) = ( 0.5000000 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4194306
elphmat(:,:,:)**2 0.4919114
elphmat(:,:,:)**2 0.5328239
elphmat(:,:,:)**2 0.4603112
elphmat(:,:,:)**2 0.3630070
elphmat(:,:,:)**2 0.3630069
el_ph_mat(:,:,215,:)**2 2.630490
q( 77 ) = ( -0.5000000 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4590434
elphmat(:,:,:)**2 0.5031855
elphmat(:,:,:)**2 0.5519085
elphmat(:,:,:)**2 0.5078086
elphmat(:,:,:)**2 0.3746212
elphmat(:,:,:)**2 0.3746212
el_ph_mat(:,:,215,:)**2 2.771189
q( 78 ) = ( -0.5000000 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4883534
elphmat(:,:,:)**2 0.3706962
elphmat(:,:,:)**2 0.4097959
elphmat(:,:,:)**2 0.5274656
elphmat(:,:,:)**2 0.3679958
elphmat(:,:,:)**2 0.3679958
el_ph_mat(:,:,215,:)**2 2.532303
q( 79 ) = ( 0.5000000 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.2636250
elphmat(:,:,:)**2 0.5105515
elphmat(:,:,:)**2 0.5682013
elphmat(:,:,:)**2 0.3212866
elphmat(:,:,:)**2 0.3269164
elphmat(:,:,:)**2 0.3269164
el_ph_mat(:,:,215,:)**2 2.317497
q( 80 ) = ( -0.1666667 0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.4590435
elphmat(:,:,:)**2 0.5031855
elphmat(:,:,:)**2 0.5519085
elphmat(:,:,:)**2 0.5078086
elphmat(:,:,:)**2 0.3746213
elphmat(:,:,:)**2 0.3746213
el_ph_mat(:,:,215,:)**2 2.771188
q( 81 ) = ( 0.1666667 -0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.4194306
elphmat(:,:,:)**2 0.4919115
elphmat(:,:,:)**2 0.5328239
elphmat(:,:,:)**2 0.4603112
elphmat(:,:,:)**2 0.3630069
elphmat(:,:,:)**2 0.3630069
el_ph_mat(:,:,215,:)**2 2.630491
q( 82 ) = ( -0.1666667 -0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.2636250
elphmat(:,:,:)**2 0.5105516
elphmat(:,:,:)**2 0.5682013
elphmat(:,:,:)**2 0.3212866
elphmat(:,:,:)**2 0.3269164
elphmat(:,:,:)**2 0.3269165
el_ph_mat(:,:,215,:)**2 2.317497
q( 83 ) = ( 0.1666667 0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.4883533
elphmat(:,:,:)**2 0.3706962
elphmat(:,:,:)**2 0.4097960
elphmat(:,:,:)**2 0.5274656
elphmat(:,:,:)**2 0.3679958
elphmat(:,:,:)**2 0.3679958
el_ph_mat(:,:,215,:)**2 2.532303
q( 84 ) = ( 0.5000000 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.2636250
elphmat(:,:,:)**2 0.5105516
elphmat(:,:,:)**2 0.5682013
elphmat(:,:,:)**2 0.3212866
elphmat(:,:,:)**2 0.3269164
elphmat(:,:,:)**2 0.3269164
el_ph_mat(:,:,215,:)**2 2.317497
q( 85 ) = ( -0.5000000 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4590435
elphmat(:,:,:)**2 0.5031856
elphmat(:,:,:)**2 0.5519085
elphmat(:,:,:)**2 0.5078086
elphmat(:,:,:)**2 0.3746212
elphmat(:,:,:)**2 0.3746213
el_ph_mat(:,:,215,:)**2 2.771189
q( 86 ) = ( 0.5000000 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4194306
elphmat(:,:,:)**2 0.4919115
elphmat(:,:,:)**2 0.5328239
elphmat(:,:,:)**2 0.4603112
elphmat(:,:,:)**2 0.3630070
elphmat(:,:,:)**2 0.3630070
el_ph_mat(:,:,215,:)**2 2.630491
q( 87 ) = ( -0.5000000 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4883534
elphmat(:,:,:)**2 0.3706962
elphmat(:,:,:)**2 0.4097960
elphmat(:,:,:)**2 0.5274657
elphmat(:,:,:)**2 0.3679958
elphmat(:,:,:)**2 0.3679958
el_ph_mat(:,:,215,:)**2 2.532303
q( 88 ) = ( -0.5000000 0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.5605462
elphmat(:,:,:)**2 0.7074099
elphmat(:,:,:)**2 0.7210870
elphmat(:,:,:)**2 0.5742787
elphmat(:,:,:)**2 0.5523882
elphmat(:,:,:)**2 0.5523882
el_ph_mat(:,:,215,:)**2 3.668098
q( 89 ) = ( -0.5000000 -0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.3935338
elphmat(:,:,:)**2 0.4735907
elphmat(:,:,:)**2 0.4953549
elphmat(:,:,:)**2 0.4153110
elphmat(:,:,:)**2 0.2617050
elphmat(:,:,:)**2 0.2617050
el_ph_mat(:,:,215,:)**2 2.301201
q( 90 ) = ( 0.5000000 0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.3935339
elphmat(:,:,:)**2 0.4735908
elphmat(:,:,:)**2 0.4953549
elphmat(:,:,:)**2 0.4153110
elphmat(:,:,:)**2 0.2617050
elphmat(:,:,:)**2 0.2617050
el_ph_mat(:,:,215,:)**2 2.301201
q( 91 ) = ( 0.5000000 -0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.3305066
elphmat(:,:,:)**2 0.3751408
elphmat(:,:,:)**2 0.4241509
elphmat(:,:,:)**2 0.3794795
elphmat(:,:,:)**2 0.3969140
elphmat(:,:,:)**2 0.3969140
el_ph_mat(:,:,215,:)**2 2.303106
q( 92 ) = ( -0.1666667 0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.4590434
elphmat(:,:,:)**2 0.5031855
elphmat(:,:,:)**2 0.5519086
elphmat(:,:,:)**2 0.5078086
elphmat(:,:,:)**2 0.3746213
elphmat(:,:,:)**2 0.3746213
el_ph_mat(:,:,215,:)**2 2.771188
q( 93 ) = ( 0.1666667 0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.4883533
elphmat(:,:,:)**2 0.3706962
elphmat(:,:,:)**2 0.4097959
elphmat(:,:,:)**2 0.5274656
elphmat(:,:,:)**2 0.3679958
elphmat(:,:,:)**2 0.3679958
el_ph_mat(:,:,215,:)**2 2.532303
q( 94 ) = ( -0.1666667 -0.5000000 -0.5000000 )
elphmat(:,:,:)**2 0.2636250
elphmat(:,:,:)**2 0.5105516
elphmat(:,:,:)**2 0.5682013
elphmat(:,:,:)**2 0.3212866
elphmat(:,:,:)**2 0.3269164
elphmat(:,:,:)**2 0.3269164
el_ph_mat(:,:,215,:)**2 2.317497
q( 95 ) = ( 0.1666667 -0.5000000 0.5000000 )
elphmat(:,:,:)**2 0.4194305
elphmat(:,:,:)**2 0.4919115
elphmat(:,:,:)**2 0.5328239
elphmat(:,:,:)**2 0.4603112
elphmat(:,:,:)**2 0.3630069
elphmat(:,:,:)**2 0.3630070
el_ph_mat(:,:,215,:)**2 2.630491
q( 96 ) = ( 0.5000000 0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.3935339
elphmat(:,:,:)**2 0.4735908
elphmat(:,:,:)**2 0.4953549
elphmat(:,:,:)**2 0.4153111
elphmat(:,:,:)**2 0.2617050
elphmat(:,:,:)**2 0.2617050
el_ph_mat(:,:,215,:)**2 2.301200
q( 97 ) = ( 0.5000000 -0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.3305066
elphmat(:,:,:)**2 0.3751408
elphmat(:,:,:)**2 0.4241509
elphmat(:,:,:)**2 0.3794795
elphmat(:,:,:)**2 0.3969139
elphmat(:,:,:)**2 0.3969139
el_ph_mat(:,:,215,:)**2 2.303106
q( 98 ) = ( -0.5000000 -0.5000000 -0.1666667 )
elphmat(:,:,:)**2 0.3935338
elphmat(:,:,:)**2 0.4735908
elphmat(:,:,:)**2 0.4953550
elphmat(:,:,:)**2 0.4153111
elphmat(:,:,:)**2 0.2617050
elphmat(:,:,:)**2 0.2617050
el_ph_mat(:,:,215,:)**2 2.301200
q( 99 ) = ( -0.5000000 0.5000000 0.1666667 )
elphmat(:,:,:)**2 0.5605462
elphmat(:,:,:)**2 0.7074099
elphmat(:,:,:)**2 0.7210870
elphmat(:,:,:)**2 0.5742787
elphmat(:,:,:)**2 0.5523882
elphmat(:,:,:)**2 0.5523883
el_ph_mat(:,:,215,:)**2 3.668098
===================================================================
irreducible q point # 9
===================================================================
Number of q in the star = 12
List of q in the star:
1 0.333333300 0.000000000 0.333333300
2 -0.333333300 0.000000000 0.333333300
3 -0.333333300 0.000000000 -0.333333300
4 0.333333300 0.000000000 -0.333333300
5 0.000000000 0.333333300 -0.333333300
6 0.000000000 -0.333333300 -0.333333300
7 0.000000000 -0.333333300 0.333333300
8 0.000000000 0.333333300 0.333333300
9 -0.333333300 0.333333300 0.000000000
10 -0.333333300 -0.333333300 0.000000000
11 0.333333300 0.333333300 0.000000000
12 0.333333300 -0.333333300 0.000000000
q( 100 ) = ( 0.3333333 0.0000000 0.3333333 )
elphmat(:,:,:)**2 0.5236074
elphmat(:,:,:)**2 0.4596863
elphmat(:,:,:)**2 0.6578963
elphmat(:,:,:)**2 3.9961137E-02
elphmat(:,:,:)**2 0.4596291
elphmat(:,:,:)**2 8.6306795E-02
el_ph_mat(:,:,215,:)**2 2.227087
q( 101 ) = ( -0.3333333 0.0000000 0.3333333 )
elphmat(:,:,:)**2 0.5287151
elphmat(:,:,:)**2 0.3070382
elphmat(:,:,:)**2 0.7409544
elphmat(:,:,:)**2 2.5919255E-02
elphmat(:,:,:)**2 0.9555851
elphmat(:,:,:)**2 0.1066984
el_ph_mat(:,:,215,:)**2 2.664911
q( 102 ) = ( -0.3333333 0.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.5287150
elphmat(:,:,:)**2 0.3070382
elphmat(:,:,:)**2 0.7409544
elphmat(:,:,:)**2 2.5919236E-02
elphmat(:,:,:)**2 0.9555851
elphmat(:,:,:)**2 0.1066984
el_ph_mat(:,:,215,:)**2 2.664910
q( 103 ) = ( 0.3333333 0.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.5236075
elphmat(:,:,:)**2 0.4596863
elphmat(:,:,:)**2 0.6578962
elphmat(:,:,:)**2 3.9961159E-02
elphmat(:,:,:)**2 0.4596292
elphmat(:,:,:)**2 8.6306766E-02
el_ph_mat(:,:,215,:)**2 2.227087
q( 104 ) = ( 0.0000000 0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.5287151
elphmat(:,:,:)**2 0.3070382
elphmat(:,:,:)**2 0.7409544
elphmat(:,:,:)**2 2.5919240E-02
elphmat(:,:,:)**2 0.9555851
elphmat(:,:,:)**2 0.1066984
el_ph_mat(:,:,215,:)**2 2.664911
q( 105 ) = ( 0.0000000 -0.3333333 -0.3333333 )
elphmat(:,:,:)**2 0.5236074
elphmat(:,:,:)**2 0.4596863
elphmat(:,:,:)**2 0.6578963
elphmat(:,:,:)**2 3.9961170E-02
elphmat(:,:,:)**2 0.4596291
elphmat(:,:,:)**2 8.6306810E-02
el_ph_mat(:,:,215,:)**2 2.227086
q( 106 ) = ( 0.0000000 -0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.5236075
elphmat(:,:,:)**2 0.4596863
elphmat(:,:,:)**2 0.6578962
elphmat(:,:,:)**2 3.9961144E-02
elphmat(:,:,:)**2 0.4596292
elphmat(:,:,:)**2 8.6306795E-02
el_ph_mat(:,:,215,:)**2 2.227087
q( 107 ) = ( 0.0000000 0.3333333 0.3333333 )
elphmat(:,:,:)**2 0.5287151
elphmat(:,:,:)**2 0.3070382
elphmat(:,:,:)**2 0.7409544
elphmat(:,:,:)**2 2.5919231E-02
elphmat(:,:,:)**2 0.9555851
elphmat(:,:,:)**2 0.1066984
el_ph_mat(:,:,215,:)**2 2.664910
q( 108 ) = ( -0.3333333 0.3333333 0.0000000 )
elphmat(:,:,:)**2 1.025565
elphmat(:,:,:)**2 0.4240966
elphmat(:,:,:)**2 1.262315
elphmat(:,:,:)**2 4.7338501E-02
elphmat(:,:,:)**2 0.9360221
elphmat(:,:,:)**2 8.8536769E-02
el_ph_mat(:,:,215,:)**2 3.783873
q( 109 ) = ( -0.3333333 -0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.5515365
elphmat(:,:,:)**2 0.3272463
elphmat(:,:,:)**2 0.4159691
elphmat(:,:,:)**2 3.8289219E-02
elphmat(:,:,:)**2 0.7494538
elphmat(:,:,:)**2 0.1158688
el_ph_mat(:,:,215,:)**2 2.198364
q( 110 ) = ( 0.3333333 0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.5515364
elphmat(:,:,:)**2 0.3272462
elphmat(:,:,:)**2 0.4159691
elphmat(:,:,:)**2 3.8289212E-02
elphmat(:,:,:)**2 0.7494538
elphmat(:,:,:)**2 0.1158688
el_ph_mat(:,:,215,:)**2 2.198364
q( 111 ) = ( 0.3333333 -0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.4037202
elphmat(:,:,:)**2 0.4814893
elphmat(:,:,:)**2 0.7976568
elphmat(:,:,:)**2 1.7729435E-02
elphmat(:,:,:)**2 0.2364650
elphmat(:,:,:)**2 5.9933204E-02
el_ph_mat(:,:,215,:)**2 1.996994
===================================================================
irreducible q point # 10
===================================================================
Number of q in the star = 6
List of q in the star:
1 0.000000000 0.666666700 0.000000000
2 0.000000000 -0.666666700 0.000000000
3 0.666666700 0.000000000 0.000000000
4 -0.666666700 0.000000000 0.000000000
5 0.000000000 0.000000000 0.666666700
6 0.000000000 0.000000000 -0.666666700
q( 112 ) = ( 0.0000000 0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.2571189
elphmat(:,:,:)**2 1.041154
elphmat(:,:,:)**2 1.272840
elphmat(:,:,:)**2 0.3393419
el_ph_mat(:,:,215,:)**2 2.910454
q( 113 ) = ( 0.0000000 -0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.5440578
elphmat(:,:,:)**2 0.4274424
elphmat(:,:,:)**2 0.8988918
elphmat(:,:,:)**2 0.3340464
el_ph_mat(:,:,215,:)**2 2.204438
q( 114 ) = ( 0.6666667 0.0000000 0.0000000 )
elphmat(:,:,:)**2 0.5440578
elphmat(:,:,:)**2 0.4274424
elphmat(:,:,:)**2 0.8988919
elphmat(:,:,:)**2 0.3340464
el_ph_mat(:,:,215,:)**2 2.204439
q( 115 ) = ( -0.6666667 0.0000000 0.0000000 )
elphmat(:,:,:)**2 0.2571189
elphmat(:,:,:)**2 1.041154
elphmat(:,:,:)**2 1.272840
elphmat(:,:,:)**2 0.3393419
el_ph_mat(:,:,215,:)**2 2.910455
q( 116 ) = ( 0.0000000 0.0000000 0.6666667 )
elphmat(:,:,:)**2 0.4068627
elphmat(:,:,:)**2 0.8061914
elphmat(:,:,:)**2 1.155374
elphmat(:,:,:)**2 0.3621055
el_ph_mat(:,:,215,:)**2 2.730533
q( 117 ) = ( 0.0000000 0.0000000 -0.6666667 )
elphmat(:,:,:)**2 0.4068628
elphmat(:,:,:)**2 0.8061914
elphmat(:,:,:)**2 1.155374
elphmat(:,:,:)**2 0.3621055
el_ph_mat(:,:,215,:)**2 2.730534
===================================================================
irreducible q point # 11
===================================================================
Number of q in the star = 24
List of q in the star:
1 0.833333300 -0.166666700 0.833333300
2 -0.833333300 0.166666700 0.833333300
3 -0.833333300 -0.166666700 -0.833333300
4 0.833333300 0.166666700 -0.833333300
5 -0.166666700 0.833333300 -0.833333300
6 0.166666700 -0.833333300 -0.833333300
7 -0.166666700 -0.833333300 0.833333300
8 0.166666700 0.833333300 0.833333300
9 0.833333300 0.166666700 0.833333300
10 -0.833333300 0.166666700 -0.833333300
11 0.833333300 -0.166666700 -0.833333300
12 -0.833333300 -0.166666700 0.833333300
13 -0.833333300 0.833333300 -0.166666700
14 -0.833333300 -0.833333300 0.166666700
15 0.833333300 0.833333300 0.166666700
16 0.833333300 -0.833333300 -0.166666700
17 -0.166666700 0.833333300 0.833333300
18 0.166666700 0.833333300 -0.833333300
19 -0.166666700 -0.833333300 -0.833333300
20 0.166666700 -0.833333300 0.833333300
21 0.833333300 0.833333300 -0.166666700
22 0.833333300 -0.833333300 0.166666700
23 -0.833333300 -0.833333300 -0.166666700
24 -0.833333300 0.833333300 0.166666700
q( 118 ) = ( 0.8333333 -0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.5355266
elphmat(:,:,:)**2 0.6246096
elphmat(:,:,:)**2 0.5681792
elphmat(:,:,:)**2 0.4790961
elphmat(:,:,:)**2 0.3690301
elphmat(:,:,:)**2 0.3690300
el_ph_mat(:,:,215,:)**2 2.945471
q( 119 ) = ( -0.8333333 0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.3699294
elphmat(:,:,:)**2 0.5646493
elphmat(:,:,:)**2 0.4918692
elphmat(:,:,:)**2 0.2971562
elphmat(:,:,:)**2 0.3331438
elphmat(:,:,:)**2 0.3331438
el_ph_mat(:,:,215,:)**2 2.389892
q( 120 ) = ( -0.8333333 -0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.4851919
elphmat(:,:,:)**2 0.5432271
elphmat(:,:,:)**2 0.4451931
elphmat(:,:,:)**2 0.3871643
elphmat(:,:,:)**2 0.3812335
elphmat(:,:,:)**2 0.3812336
el_ph_mat(:,:,215,:)**2 2.623243
q( 121 ) = ( 0.8333333 0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.4270627
elphmat(:,:,:)**2 0.5180752
elphmat(:,:,:)**2 0.4778213
elphmat(:,:,:)**2 0.3868020
elphmat(:,:,:)**2 0.3173560
elphmat(:,:,:)**2 0.3173560
el_ph_mat(:,:,215,:)**2 2.444473
q( 122 ) = ( -0.1666667 0.8333333 -0.8333333 )
elphmat(:,:,:)**2 0.3699295
elphmat(:,:,:)**2 0.5646493
elphmat(:,:,:)**2 0.4918691
elphmat(:,:,:)**2 0.2971562
elphmat(:,:,:)**2 0.3331438
elphmat(:,:,:)**2 0.3331438
el_ph_mat(:,:,215,:)**2 2.389892
q( 123 ) = ( 0.1666667 -0.8333333 -0.8333333 )
elphmat(:,:,:)**2 0.5355266
elphmat(:,:,:)**2 0.6246096
elphmat(:,:,:)**2 0.5681792
elphmat(:,:,:)**2 0.4790960
elphmat(:,:,:)**2 0.3690301
elphmat(:,:,:)**2 0.3690301
el_ph_mat(:,:,215,:)**2 2.945472
q( 124 ) = ( -0.1666667 -0.8333333 0.8333333 )
elphmat(:,:,:)**2 0.4270627
elphmat(:,:,:)**2 0.5180751
elphmat(:,:,:)**2 0.4778213
elphmat(:,:,:)**2 0.3868020
elphmat(:,:,:)**2 0.3173560
elphmat(:,:,:)**2 0.3173560
el_ph_mat(:,:,215,:)**2 2.444473
q( 125 ) = ( 0.1666667 0.8333333 0.8333333 )
elphmat(:,:,:)**2 0.4851920
elphmat(:,:,:)**2 0.5432271
elphmat(:,:,:)**2 0.4451931
elphmat(:,:,:)**2 0.3871643
elphmat(:,:,:)**2 0.3812335
elphmat(:,:,:)**2 0.3812335
el_ph_mat(:,:,215,:)**2 2.623244
q( 126 ) = ( 0.8333333 0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.4270627
elphmat(:,:,:)**2 0.5180752
elphmat(:,:,:)**2 0.4778213
elphmat(:,:,:)**2 0.3868020
elphmat(:,:,:)**2 0.3173560
elphmat(:,:,:)**2 0.3173560
el_ph_mat(:,:,215,:)**2 2.444473
q( 127 ) = ( -0.8333333 0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.3699294
elphmat(:,:,:)**2 0.5646493
elphmat(:,:,:)**2 0.4918691
elphmat(:,:,:)**2 0.2971562
elphmat(:,:,:)**2 0.3331438
elphmat(:,:,:)**2 0.3331438
el_ph_mat(:,:,215,:)**2 2.389892
q( 128 ) = ( 0.8333333 -0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.5355266
elphmat(:,:,:)**2 0.6246097
elphmat(:,:,:)**2 0.5681792
elphmat(:,:,:)**2 0.4790959
elphmat(:,:,:)**2 0.3690301
elphmat(:,:,:)**2 0.3690301
el_ph_mat(:,:,215,:)**2 2.945472
q( 129 ) = ( -0.8333333 -0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.4851920
elphmat(:,:,:)**2 0.5432271
elphmat(:,:,:)**2 0.4451931
elphmat(:,:,:)**2 0.3871643
elphmat(:,:,:)**2 0.3812335
elphmat(:,:,:)**2 0.3812335
el_ph_mat(:,:,215,:)**2 2.623244
q( 130 ) = ( -0.8333333 0.8333333 -0.1666667 )
elphmat(:,:,:)**2 0.4461474
elphmat(:,:,:)**2 0.6928201
elphmat(:,:,:)**2 0.5929315
elphmat(:,:,:)**2 0.3462826
elphmat(:,:,:)**2 0.4509410
elphmat(:,:,:)**2 0.4509410
el_ph_mat(:,:,215,:)**2 2.980064
q( 131 ) = ( -0.8333333 -0.8333333 0.1666667 )
elphmat(:,:,:)**2 0.4270413
elphmat(:,:,:)**2 0.6078241
elphmat(:,:,:)**2 0.5575308
elphmat(:,:,:)**2 0.3767495
elphmat(:,:,:)**2 0.3110859
elphmat(:,:,:)**2 0.3110859
el_ph_mat(:,:,215,:)**2 2.591318
q( 132 ) = ( 0.8333333 0.8333333 0.1666667 )
elphmat(:,:,:)**2 0.4270414
elphmat(:,:,:)**2 0.6078241
elphmat(:,:,:)**2 0.5575306
elphmat(:,:,:)**2 0.3767496
elphmat(:,:,:)**2 0.3110860
elphmat(:,:,:)**2 0.3110860
el_ph_mat(:,:,215,:)**2 2.591318
q( 133 ) = ( 0.8333333 -0.8333333 -0.1666667 )
elphmat(:,:,:)**2 0.5537199
elphmat(:,:,:)**2 0.4669912
elphmat(:,:,:)**2 0.3378393
elphmat(:,:,:)**2 0.4245507
elphmat(:,:,:)**2 0.4065033
elphmat(:,:,:)**2 0.4065033
el_ph_mat(:,:,215,:)**2 2.596107
q( 134 ) = ( -0.1666667 0.8333333 0.8333333 )
elphmat(:,:,:)**2 0.3699295
elphmat(:,:,:)**2 0.5646493
elphmat(:,:,:)**2 0.4918691
elphmat(:,:,:)**2 0.2971562
elphmat(:,:,:)**2 0.3331438
elphmat(:,:,:)**2 0.3331438
el_ph_mat(:,:,215,:)**2 2.389891
q( 135 ) = ( 0.1666667 0.8333333 -0.8333333 )
elphmat(:,:,:)**2 0.4851920
elphmat(:,:,:)**2 0.5432271
elphmat(:,:,:)**2 0.4451930
elphmat(:,:,:)**2 0.3871643
elphmat(:,:,:)**2 0.3812335
elphmat(:,:,:)**2 0.3812336
el_ph_mat(:,:,215,:)**2 2.623244
q( 136 ) = ( -0.1666667 -0.8333333 -0.8333333 )
elphmat(:,:,:)**2 0.4270627
elphmat(:,:,:)**2 0.5180751
elphmat(:,:,:)**2 0.4778213
elphmat(:,:,:)**2 0.3868020
elphmat(:,:,:)**2 0.3173560
elphmat(:,:,:)**2 0.3173560
el_ph_mat(:,:,215,:)**2 2.444473
q( 137 ) = ( 0.1666667 -0.8333333 0.8333333 )
elphmat(:,:,:)**2 0.5355266
elphmat(:,:,:)**2 0.6246096
elphmat(:,:,:)**2 0.5681791
elphmat(:,:,:)**2 0.4790960
elphmat(:,:,:)**2 0.3690301
elphmat(:,:,:)**2 0.3690301
el_ph_mat(:,:,215,:)**2 2.945472
q( 138 ) = ( 0.8333333 0.8333333 -0.1666667 )
elphmat(:,:,:)**2 0.4270414
elphmat(:,:,:)**2 0.6078242
elphmat(:,:,:)**2 0.5575307
elphmat(:,:,:)**2 0.3767496
elphmat(:,:,:)**2 0.3110860
elphmat(:,:,:)**2 0.3110860
el_ph_mat(:,:,215,:)**2 2.591318
q( 139 ) = ( 0.8333333 -0.8333333 0.1666667 )
elphmat(:,:,:)**2 0.5537199
elphmat(:,:,:)**2 0.4669912
elphmat(:,:,:)**2 0.3378393
elphmat(:,:,:)**2 0.4245507
elphmat(:,:,:)**2 0.4065033
elphmat(:,:,:)**2 0.4065033
el_ph_mat(:,:,215,:)**2 2.596108
q( 140 ) = ( -0.8333333 -0.8333333 -0.1666667 )
elphmat(:,:,:)**2 0.4270413
elphmat(:,:,:)**2 0.6078242
elphmat(:,:,:)**2 0.5575307
elphmat(:,:,:)**2 0.3767496
elphmat(:,:,:)**2 0.3110859
elphmat(:,:,:)**2 0.3110860
el_ph_mat(:,:,215,:)**2 2.591318
q( 141 ) = ( -0.8333333 0.8333333 0.1666667 )
elphmat(:,:,:)**2 0.4461474
elphmat(:,:,:)**2 0.6928202
elphmat(:,:,:)**2 0.5929315
elphmat(:,:,:)**2 0.3462826
elphmat(:,:,:)**2 0.4509411
elphmat(:,:,:)**2 0.4509411
el_ph_mat(:,:,215,:)**2 2.980064
===================================================================
irreducible q point # 12
===================================================================
Number of q in the star = 12
List of q in the star:
1 0.666666700 0.000000000 0.666666700
2 -0.666666700 0.000000000 0.666666700
3 -0.666666700 0.000000000 -0.666666700
4 0.666666700 0.000000000 -0.666666700
5 0.000000000 0.666666700 -0.666666700
6 0.000000000 -0.666666700 -0.666666700
7 0.000000000 -0.666666700 0.666666700
8 0.000000000 0.666666700 0.666666700
9 -0.666666700 0.666666700 0.000000000
10 -0.666666700 -0.666666700 0.000000000
11 0.666666700 0.666666700 0.000000000
12 0.666666700 -0.666666700 0.000000000
q( 142 ) = ( 0.6666667 0.0000000 0.6666667 )
elphmat(:,:,:)**2 0.5338545
elphmat(:,:,:)**2 0.8564294
elphmat(:,:,:)**2 0.6208853
elphmat(:,:,:)**2 5.6227449E-02
elphmat(:,:,:)**2 0.1713627
elphmat(:,:,:)**2 0.3356706
el_ph_mat(:,:,215,:)**2 2.574430
q( 143 ) = ( -0.6666667 0.0000000 0.6666667 )
elphmat(:,:,:)**2 0.4303632
elphmat(:,:,:)**2 0.6804932
elphmat(:,:,:)**2 0.6870179
elphmat(:,:,:)**2 4.2094737E-02
elphmat(:,:,:)**2 0.3402640
elphmat(:,:,:)**2 0.3461828
el_ph_mat(:,:,215,:)**2 2.526416
q( 144 ) = ( -0.6666667 0.0000000 -0.6666667 )
elphmat(:,:,:)**2 0.4303632
elphmat(:,:,:)**2 0.6804932
elphmat(:,:,:)**2 0.6870179
elphmat(:,:,:)**2 4.2094737E-02
elphmat(:,:,:)**2 0.3402640
elphmat(:,:,:)**2 0.3461827
el_ph_mat(:,:,215,:)**2 2.526416
q( 145 ) = ( 0.6666667 0.0000000 -0.6666667 )
elphmat(:,:,:)**2 0.5338545
elphmat(:,:,:)**2 0.8564295
elphmat(:,:,:)**2 0.6208853
elphmat(:,:,:)**2 5.6227475E-02
elphmat(:,:,:)**2 0.1713627
elphmat(:,:,:)**2 0.3356706
el_ph_mat(:,:,215,:)**2 2.574430
q( 146 ) = ( 0.0000000 0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.4303632
elphmat(:,:,:)**2 0.6804932
elphmat(:,:,:)**2 0.6870178
elphmat(:,:,:)**2 4.2094745E-02
elphmat(:,:,:)**2 0.3402640
elphmat(:,:,:)**2 0.3461828
el_ph_mat(:,:,215,:)**2 2.526416
q( 147 ) = ( 0.0000000 -0.6666667 -0.6666667 )
elphmat(:,:,:)**2 0.5338546
elphmat(:,:,:)**2 0.8564295
elphmat(:,:,:)**2 0.6208853
elphmat(:,:,:)**2 5.6227468E-02
elphmat(:,:,:)**2 0.1713628
elphmat(:,:,:)**2 0.3356705
el_ph_mat(:,:,215,:)**2 2.574430
q( 148 ) = ( 0.0000000 -0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.5338544
elphmat(:,:,:)**2 0.8564295
elphmat(:,:,:)**2 0.6208853
elphmat(:,:,:)**2 5.6227464E-02
elphmat(:,:,:)**2 0.1713628
elphmat(:,:,:)**2 0.3356707
el_ph_mat(:,:,215,:)**2 2.574430
q( 149 ) = ( 0.0000000 0.6666667 0.6666667 )
elphmat(:,:,:)**2 0.4303633
elphmat(:,:,:)**2 0.6804931
elphmat(:,:,:)**2 0.6870179
elphmat(:,:,:)**2 4.2094734E-02
elphmat(:,:,:)**2 0.3402640
elphmat(:,:,:)**2 0.3461827
el_ph_mat(:,:,215,:)**2 2.526416
q( 150 ) = ( -0.6666667 0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.5592400
elphmat(:,:,:)**2 1.014230
elphmat(:,:,:)**2 0.8872620
elphmat(:,:,:)**2 8.0572739E-02
elphmat(:,:,:)**2 0.4971011
elphmat(:,:,:)**2 0.3398695
el_ph_mat(:,:,215,:)**2 3.378275
q( 151 ) = ( -0.6666667 -0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.4114892
elphmat(:,:,:)**2 0.7683418
elphmat(:,:,:)**2 0.5246321
elphmat(:,:,:)**2 6.4931378E-02
elphmat(:,:,:)**2 0.2002414
elphmat(:,:,:)**2 0.4162775
el_ph_mat(:,:,215,:)**2 2.385913
q( 152 ) = ( 0.6666667 0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.4114892
elphmat(:,:,:)**2 0.7683417
elphmat(:,:,:)**2 0.5246320
elphmat(:,:,:)**2 6.4931363E-02
elphmat(:,:,:)**2 0.2002413
elphmat(:,:,:)**2 0.4162776
el_ph_mat(:,:,215,:)**2 2.385913
q( 153 ) = ( 0.6666667 -0.6666667 0.0000000 )
elphmat(:,:,:)**2 0.5844891
elphmat(:,:,:)**2 0.5885977
elphmat(:,:,:)**2 0.7567593
elphmat(:,:,:)**2 1.2729936E-02
elphmat(:,:,:)**2 9.1904193E-02
elphmat(:,:,:)**2 0.3361413
el_ph_mat(:,:,215,:)**2 2.370621
===================================================================
irreducible q point # 13
===================================================================
Number of q in the star = 3
List of q in the star:
1 0.000000000 -1.000000000 0.000000000
2 -1.000000000 0.000000000 0.000000000
3 0.000000000 0.000000000 -1.000000000
q( 154 ) = ( 0.0000000 -1.0000000 0.0000000 )
elphmat(:,:,:)**2 1.299298
elphmat(:,:,:)**2 8.8467240E-02
elphmat(:,:,:)**2 1.249001
el_ph_mat(:,:,215,:)**2 2.636766
q( 155 ) = ( -1.0000000 0.0000000 0.0000000 )
elphmat(:,:,:)**2 1.299294
elphmat(:,:,:)**2 8.8465035E-02
elphmat(:,:,:)**2 1.248988
el_ph_mat(:,:,215,:)**2 2.636748
q( 156 ) = ( 0.0000000 0.0000000 -1.0000000 )
elphmat(:,:,:)**2 1.382373
elphmat(:,:,:)**2 9.2121460E-02
elphmat(:,:,:)**2 1.295549
el_ph_mat(:,:,215,:)**2 2.770043
===================================================================
irreducible q point # 14
===================================================================
Number of q in the star = 24
List of q in the star:
1 0.666666700 -0.333333300 1.000000000
2 -0.666666700 0.333333300 1.000000000
3 -0.666666700 -0.333333300 -1.000000000
4 0.666666700 0.333333300 -1.000000000
5 -0.333333300 0.666666700 -1.000000000
6 0.333333300 -0.666666700 -1.000000000
7 -0.333333300 -0.666666700 1.000000000
8 0.333333300 0.666666700 1.000000000
9 1.000000000 0.333333300 0.666666700
10 -1.000000000 0.333333300 -0.666666700
11 1.000000000 -0.333333300 -0.666666700
12 -1.000000000 -0.333333300 0.666666700
13 -0.666666700 1.000000000 -0.333333300
14 -0.666666700 -1.000000000 0.333333300
15 0.666666700 1.000000000 0.333333300
16 0.666666700 -1.000000000 -0.333333300
17 -0.333333300 1.000000000 0.666666700
18 0.333333300 1.000000000 -0.666666700
19 -0.333333300 -1.000000000 -0.666666700
20 0.333333300 -1.000000000 0.666666700
21 1.000000000 0.666666700 -0.333333300
22 1.000000000 -0.666666700 0.333333300
23 -1.000000000 -0.666666700 -0.333333300
24 -1.000000000 0.666666700 0.333333300
q( 157 ) = ( 0.6666667 -0.3333333 1.0000000 )
elphmat(:,:,:)**2 0.7338239
elphmat(:,:,:)**2 0.4834279
elphmat(:,:,:)**2 0.5963960
elphmat(:,:,:)**2 0.4523373
elphmat(:,:,:)**2 0.9512014
elphmat(:,:,:)**2 0.2554859
el_ph_mat(:,:,215,:)**2 3.472672
q( 158 ) = ( -0.6666667 0.3333333 1.0000000 )
elphmat(:,:,:)**2 0.3069376
elphmat(:,:,:)**2 0.4928766
elphmat(:,:,:)**2 0.1916050
elphmat(:,:,:)**2 0.6632822
elphmat(:,:,:)**2 0.4010861
elphmat(:,:,:)**2 0.1404748
el_ph_mat(:,:,215,:)**2 2.196262
q( 159 ) = ( -0.6666667 -0.3333333 -1.0000000 )
elphmat(:,:,:)**2 0.4832195
elphmat(:,:,:)**2 0.2605079
elphmat(:,:,:)**2 0.2620030
elphmat(:,:,:)**2 0.4547214
elphmat(:,:,:)**2 0.6980034
elphmat(:,:,:)**2 0.2560013
el_ph_mat(:,:,215,:)**2 2.414456
q( 160 ) = ( 0.6666667 0.3333333 -1.0000000 )
elphmat(:,:,:)**2 0.3516524
elphmat(:,:,:)**2 0.5052816
elphmat(:,:,:)**2 0.3281863
elphmat(:,:,:)**2 0.5510079
elphmat(:,:,:)**2 0.3147423
elphmat(:,:,:)**2 0.2271709
el_ph_mat(:,:,215,:)**2 2.278041
q( 161 ) = ( -0.3333333 0.6666667 -1.0000000 )
elphmat(:,:,:)**2 0.3069376
elphmat(:,:,:)**2 0.4928766
elphmat(:,:,:)**2 0.1916050
elphmat(:,:,:)**2 0.6632821
elphmat(:,:,:)**2 0.4010861
elphmat(:,:,:)**2 0.1404748
el_ph_mat(:,:,215,:)**2 2.196262
q( 162 ) = ( 0.3333333 -0.6666667 -1.0000000 )
elphmat(:,:,:)**2 0.7338239
elphmat(:,:,:)**2 0.4834279
elphmat(:,:,:)**2 0.5963960
elphmat(:,:,:)**2 0.4523373
elphmat(:,:,:)**2 0.9512014
elphmat(:,:,:)**2 0.2554859
el_ph_mat(:,:,215,:)**2 3.472672
q( 163 ) = ( -0.3333333 -0.6666667 1.0000000 )
elphmat(:,:,:)**2 0.3516524
elphmat(:,:,:)**2 0.5052815
elphmat(:,:,:)**2 0.3281863
elphmat(:,:,:)**2 0.5510079
elphmat(:,:,:)**2 0.3147422
elphmat(:,:,:)**2 0.2271709
el_ph_mat(:,:,215,:)**2 2.278041
q( 164 ) = ( 0.3333333 0.6666667 1.0000000 )
elphmat(:,:,:)**2 0.4832195
elphmat(:,:,:)**2 0.2605080
elphmat(:,:,:)**2 0.2620029
elphmat(:,:,:)**2 0.4547214
elphmat(:,:,:)**2 0.6980033
elphmat(:,:,:)**2 0.2560013
el_ph_mat(:,:,215,:)**2 2.414456
q( 165 ) = ( 1.0000000 0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.3782873
elphmat(:,:,:)**2 0.4090906
elphmat(:,:,:)**2 0.2525946
elphmat(:,:,:)**2 0.6853928
elphmat(:,:,:)**2 0.3593552
elphmat(:,:,:)**2 0.2353978
el_ph_mat(:,:,215,:)**2 2.320118
q( 166 ) = ( -1.0000000 0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.3782873
elphmat(:,:,:)**2 0.4090906
elphmat(:,:,:)**2 0.2525946
elphmat(:,:,:)**2 0.6853929
elphmat(:,:,:)**2 0.3593551
elphmat(:,:,:)**2 0.2353978
el_ph_mat(:,:,215,:)**2 2.320118
q( 167 ) = ( 1.0000000 -0.3333333 -0.6666667 )
elphmat(:,:,:)**2 0.4480067
elphmat(:,:,:)**2 0.5062656
elphmat(:,:,:)**2 0.5091482
elphmat(:,:,:)**2 0.3706816
elphmat(:,:,:)**2 0.8024316
elphmat(:,:,:)**2 0.1670892
el_ph_mat(:,:,215,:)**2 2.803622
q( 168 ) = ( -1.0000000 -0.3333333 0.6666667 )
elphmat(:,:,:)**2 0.4480066
elphmat(:,:,:)**2 0.5062657
elphmat(:,:,:)**2 0.5091482
elphmat(:,:,:)**2 0.3706816
elphmat(:,:,:)**2 0.8024316
elphmat(:,:,:)**2 0.1670893
el_ph_mat(:,:,215,:)**2 2.803623
q( 169 ) = ( -0.6666667 1.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.4613324
elphmat(:,:,:)**2 0.4585097
elphmat(:,:,:)**2 0.2709117
elphmat(:,:,:)**2 0.6465971
elphmat(:,:,:)**2 0.6101075
elphmat(:,:,:)**2 0.2158196
el_ph_mat(:,:,215,:)**2 2.663278
q( 170 ) = ( -0.6666667 -1.0000000 0.3333333 )
elphmat(:,:,:)**2 0.4613324
elphmat(:,:,:)**2 0.4585097
elphmat(:,:,:)**2 0.2709118
elphmat(:,:,:)**2 0.6465972
elphmat(:,:,:)**2 0.6101074
elphmat(:,:,:)**2 0.2158196
el_ph_mat(:,:,215,:)**2 2.663278
q( 171 ) = ( 0.6666667 1.0000000 0.3333333 )
elphmat(:,:,:)**2 0.4064420
elphmat(:,:,:)**2 0.4045405
elphmat(:,:,:)**2 0.4372616
elphmat(:,:,:)**2 0.4518270
elphmat(:,:,:)**2 0.6342449
elphmat(:,:,:)**2 0.2028876
el_ph_mat(:,:,215,:)**2 2.537204
q( 172 ) = ( 0.6666667 -1.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.4064420
elphmat(:,:,:)**2 0.4045406
elphmat(:,:,:)**2 0.4372615
elphmat(:,:,:)**2 0.4518270
elphmat(:,:,:)**2 0.6342449
elphmat(:,:,:)**2 0.2028876
el_ph_mat(:,:,215,:)**2 2.537204
q( 173 ) = ( -0.3333333 1.0000000 0.6666667 )
elphmat(:,:,:)**2 0.3782873
elphmat(:,:,:)**2 0.4090906
elphmat(:,:,:)**2 0.2525946
elphmat(:,:,:)**2 0.6853929
elphmat(:,:,:)**2 0.3593551
elphmat(:,:,:)**2 0.2353978
el_ph_mat(:,:,215,:)**2 2.320118
q( 174 ) = ( 0.3333333 1.0000000 -0.6666667 )
elphmat(:,:,:)**2 0.4480067
elphmat(:,:,:)**2 0.5062657
elphmat(:,:,:)**2 0.5091483
elphmat(:,:,:)**2 0.3706817
elphmat(:,:,:)**2 0.8024317
elphmat(:,:,:)**2 0.1670893
el_ph_mat(:,:,215,:)**2 2.803624
q( 175 ) = ( -0.3333333 -1.0000000 -0.6666667 )
elphmat(:,:,:)**2 0.3782873
elphmat(:,:,:)**2 0.4090905
elphmat(:,:,:)**2 0.2525946
elphmat(:,:,:)**2 0.6853927
elphmat(:,:,:)**2 0.3593551
elphmat(:,:,:)**2 0.2353978
el_ph_mat(:,:,215,:)**2 2.320118
q( 176 ) = ( 0.3333333 -1.0000000 0.6666667 )
elphmat(:,:,:)**2 0.4480067
elphmat(:,:,:)**2 0.5062656
elphmat(:,:,:)**2 0.5091483
elphmat(:,:,:)**2 0.3706817
elphmat(:,:,:)**2 0.8024315
elphmat(:,:,:)**2 0.1670892
el_ph_mat(:,:,215,:)**2 2.803623
q( 177 ) = ( 1.0000000 0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.4613324
elphmat(:,:,:)**2 0.4585098
elphmat(:,:,:)**2 0.2709118
elphmat(:,:,:)**2 0.6465971
elphmat(:,:,:)**2 0.6101075
elphmat(:,:,:)**2 0.2158196
el_ph_mat(:,:,215,:)**2 2.663278
q( 178 ) = ( 1.0000000 -0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.4064420
elphmat(:,:,:)**2 0.4045406
elphmat(:,:,:)**2 0.4372615
elphmat(:,:,:)**2 0.4518270
elphmat(:,:,:)**2 0.6342447
elphmat(:,:,:)**2 0.2028876
el_ph_mat(:,:,215,:)**2 2.537203
q( 179 ) = ( -1.0000000 -0.6666667 -0.3333333 )
elphmat(:,:,:)**2 0.4064419
elphmat(:,:,:)**2 0.4045406
elphmat(:,:,:)**2 0.4372615
elphmat(:,:,:)**2 0.4518271
elphmat(:,:,:)**2 0.6342448
elphmat(:,:,:)**2 0.2028875
el_ph_mat(:,:,215,:)**2 2.537204
q( 180 ) = ( -1.0000000 0.6666667 0.3333333 )
elphmat(:,:,:)**2 0.4613324
elphmat(:,:,:)**2 0.4585098
elphmat(:,:,:)**2 0.2709117
elphmat(:,:,:)**2 0.6465971
elphmat(:,:,:)**2 0.6101074
elphmat(:,:,:)**2 0.2158196
el_ph_mat(:,:,215,:)**2 2.663278
===================================================================
irreducible q point # 15
===================================================================
Number of q in the star = 24
List of q in the star:
1 0.500000000 -0.166666700 0.833333300
2 -0.500000000 0.166666700 0.833333300
3 -0.500000000 -0.166666700 -0.833333300
4 0.500000000 0.166666700 -0.833333300
5 -0.166666700 0.500000000 -0.833333300
6 0.166666700 -0.500000000 -0.833333300
7 -0.166666700 -0.500000000 0.833333300
8 0.166666700 0.500000000 0.833333300
9 0.833333300 0.166666700 0.500000000
10 -0.833333300 0.166666700 -0.500000000
11 0.833333300 -0.166666700 -0.500000000
12 -0.833333300 -0.166666700 0.500000000
13 -0.500000000 0.166666700 -0.833333300
14 0.500000000 -0.166666700 -0.833333300
15 0.500000000 0.166666700 0.833333300
16 -0.500000000 -0.166666700 0.833333300
17 0.166666700 -0.500000000 0.833333300
18 -0.166666700 0.500000000 0.833333300
19 0.166666700 0.500000000 -0.833333300
20 -0.166666700 -0.500000000 -0.833333300
21 -0.833333300 -0.166666700 -0.500000000
22 0.833333300 -0.166666700 0.500000000
23 -0.833333300 0.166666700 0.500000000
24 0.833333300 0.166666700 -0.500000000
q( 181 ) = ( 0.5000000 -0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.4710512
elphmat(:,:,:)**2 0.5293837
elphmat(:,:,:)**2 0.7467327
elphmat(:,:,:)**2 0.5761988
elphmat(:,:,:)**2 0.3323852
elphmat(:,:,:)**2 0.4030778
el_ph_mat(:,:,215,:)**2 3.058829
q( 182 ) = ( -0.5000000 0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.4239827
elphmat(:,:,:)**2 0.5977101
elphmat(:,:,:)**2 0.3394277
elphmat(:,:,:)**2 0.5459274
elphmat(:,:,:)**2 0.2246051
elphmat(:,:,:)**2 0.2478872
el_ph_mat(:,:,215,:)**2 2.379540
q( 183 ) = ( -0.5000000 -0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.3140522
elphmat(:,:,:)**2 0.3412073
elphmat(:,:,:)**2 0.5028031
elphmat(:,:,:)**2 0.5630374
elphmat(:,:,:)**2 0.2568682
elphmat(:,:,:)**2 0.4139845
el_ph_mat(:,:,215,:)**2 2.391953
q( 184 ) = ( 0.5000000 0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.3769342
elphmat(:,:,:)**2 0.5670993
elphmat(:,:,:)**2 0.3349674
elphmat(:,:,:)**2 0.5856917
elphmat(:,:,:)**2 0.2494871
elphmat(:,:,:)**2 0.3575287
el_ph_mat(:,:,215,:)**2 2.471708
q( 185 ) = ( -0.1666667 0.5000000 -0.8333333 )
elphmat(:,:,:)**2 0.4239828
elphmat(:,:,:)**2 0.5977101
elphmat(:,:,:)**2 0.3394277
elphmat(:,:,:)**2 0.5459273
elphmat(:,:,:)**2 0.2246051
elphmat(:,:,:)**2 0.2478871
el_ph_mat(:,:,215,:)**2 2.379540
q( 186 ) = ( 0.1666667 -0.5000000 -0.8333333 )
elphmat(:,:,:)**2 0.4710512
elphmat(:,:,:)**2 0.5293837
elphmat(:,:,:)**2 0.7467327
elphmat(:,:,:)**2 0.5761990
elphmat(:,:,:)**2 0.3323853
elphmat(:,:,:)**2 0.4030778
el_ph_mat(:,:,215,:)**2 3.058829
q( 187 ) = ( -0.1666667 -0.5000000 0.8333333 )
elphmat(:,:,:)**2 0.3769342
elphmat(:,:,:)**2 0.5670993
elphmat(:,:,:)**2 0.3349674
elphmat(:,:,:)**2 0.5856918
elphmat(:,:,:)**2 0.2494871
elphmat(:,:,:)**2 0.3575287
el_ph_mat(:,:,215,:)**2 2.471708
q( 188 ) = ( 0.1666667 0.5000000 0.8333333 )
elphmat(:,:,:)**2 0.3140521
elphmat(:,:,:)**2 0.3412073
elphmat(:,:,:)**2 0.5028032
elphmat(:,:,:)**2 0.5630374
elphmat(:,:,:)**2 0.2568683
elphmat(:,:,:)**2 0.4139845
el_ph_mat(:,:,215,:)**2 2.391953
q( 189 ) = ( 0.8333333 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.3443072
elphmat(:,:,:)**2 0.5443400
elphmat(:,:,:)**2 0.2926294
elphmat(:,:,:)**2 0.5673153
elphmat(:,:,:)**2 0.2616754
elphmat(:,:,:)**2 0.3703530
el_ph_mat(:,:,215,:)**2 2.380620
q( 190 ) = ( -0.8333333 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4383622
elphmat(:,:,:)**2 0.4901369
elphmat(:,:,:)**2 0.4904097
elphmat(:,:,:)**2 0.5773058
elphmat(:,:,:)**2 0.2529461
elphmat(:,:,:)**2 0.3909779
el_ph_mat(:,:,215,:)**2 2.640139
q( 191 ) = ( 0.8333333 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4383622
elphmat(:,:,:)**2 0.4901368
elphmat(:,:,:)**2 0.4904096
elphmat(:,:,:)**2 0.5773059
elphmat(:,:,:)**2 0.2529461
elphmat(:,:,:)**2 0.3909779
el_ph_mat(:,:,215,:)**2 2.640139
q( 192 ) = ( -0.8333333 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4116228
elphmat(:,:,:)**2 0.6094051
elphmat(:,:,:)**2 0.5742921
elphmat(:,:,:)**2 0.5013290
elphmat(:,:,:)**2 0.2929287
elphmat(:,:,:)**2 0.2610446
el_ph_mat(:,:,215,:)**2 2.650622
q( 193 ) = ( -0.5000000 0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.4239827
elphmat(:,:,:)**2 0.5977100
elphmat(:,:,:)**2 0.3394276
elphmat(:,:,:)**2 0.5459274
elphmat(:,:,:)**2 0.2246051
elphmat(:,:,:)**2 0.2478872
el_ph_mat(:,:,215,:)**2 2.379540
q( 194 ) = ( 0.5000000 -0.1666667 -0.8333333 )
elphmat(:,:,:)**2 0.4710512
elphmat(:,:,:)**2 0.5293838
elphmat(:,:,:)**2 0.7467327
elphmat(:,:,:)**2 0.5761989
elphmat(:,:,:)**2 0.3323852
elphmat(:,:,:)**2 0.4030778
el_ph_mat(:,:,215,:)**2 3.058830
q( 195 ) = ( 0.5000000 0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.3769342
elphmat(:,:,:)**2 0.5670993
elphmat(:,:,:)**2 0.3349674
elphmat(:,:,:)**2 0.5856918
elphmat(:,:,:)**2 0.2494871
elphmat(:,:,:)**2 0.3575287
el_ph_mat(:,:,215,:)**2 2.471709
q( 196 ) = ( -0.5000000 -0.1666667 0.8333333 )
elphmat(:,:,:)**2 0.3140522
elphmat(:,:,:)**2 0.3412073
elphmat(:,:,:)**2 0.5028031
elphmat(:,:,:)**2 0.5630375
elphmat(:,:,:)**2 0.2568682
elphmat(:,:,:)**2 0.4139845
el_ph_mat(:,:,215,:)**2 2.391953
q( 197 ) = ( 0.1666667 -0.5000000 0.8333333 )
elphmat(:,:,:)**2 0.4710512
elphmat(:,:,:)**2 0.5293837
elphmat(:,:,:)**2 0.7467326
elphmat(:,:,:)**2 0.5761989
elphmat(:,:,:)**2 0.3323852
elphmat(:,:,:)**2 0.4030778
el_ph_mat(:,:,215,:)**2 3.058829
q( 198 ) = ( -0.1666667 0.5000000 0.8333333 )
elphmat(:,:,:)**2 0.4239829
elphmat(:,:,:)**2 0.5977101
elphmat(:,:,:)**2 0.3394276
elphmat(:,:,:)**2 0.5459274
elphmat(:,:,:)**2 0.2246051
elphmat(:,:,:)**2 0.2478872
el_ph_mat(:,:,215,:)**2 2.379540
q( 199 ) = ( 0.1666667 0.5000000 -0.8333333 )
elphmat(:,:,:)**2 0.3140521
elphmat(:,:,:)**2 0.3412073
elphmat(:,:,:)**2 0.5028031
elphmat(:,:,:)**2 0.5630375
elphmat(:,:,:)**2 0.2568683
elphmat(:,:,:)**2 0.4139845
el_ph_mat(:,:,215,:)**2 2.391953
q( 200 ) = ( -0.1666667 -0.5000000 -0.8333333 )
elphmat(:,:,:)**2 0.3769342
elphmat(:,:,:)**2 0.5670993
elphmat(:,:,:)**2 0.3349674
elphmat(:,:,:)**2 0.5856918
elphmat(:,:,:)**2 0.2494871
elphmat(:,:,:)**2 0.3575287
el_ph_mat(:,:,215,:)**2 2.471708
q( 201 ) = ( -0.8333333 -0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.4116227
elphmat(:,:,:)**2 0.6094050
elphmat(:,:,:)**2 0.5742922
elphmat(:,:,:)**2 0.5013291
elphmat(:,:,:)**2 0.2929288
elphmat(:,:,:)**2 0.2610447
el_ph_mat(:,:,215,:)**2 2.650622
q( 202 ) = ( 0.8333333 -0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4383621
elphmat(:,:,:)**2 0.4901368
elphmat(:,:,:)**2 0.4904096
elphmat(:,:,:)**2 0.5773060
elphmat(:,:,:)**2 0.2529461
elphmat(:,:,:)**2 0.3909780
el_ph_mat(:,:,215,:)**2 2.640138
q( 203 ) = ( -0.8333333 0.1666667 0.5000000 )
elphmat(:,:,:)**2 0.4383622
elphmat(:,:,:)**2 0.4901368
elphmat(:,:,:)**2 0.4904098
elphmat(:,:,:)**2 0.5773058
elphmat(:,:,:)**2 0.2529461
elphmat(:,:,:)**2 0.3909779
el_ph_mat(:,:,215,:)**2 2.640139
q( 204 ) = ( 0.8333333 0.1666667 -0.5000000 )
elphmat(:,:,:)**2 0.3443072
elphmat(:,:,:)**2 0.5443401
elphmat(:,:,:)**2 0.2926294
elphmat(:,:,:)**2 0.5673153
elphmat(:,:,:)**2 0.2616753
elphmat(:,:,:)**2 0.3703530
el_ph_mat(:,:,215,:)**2 2.380620
===================================================================
irreducible q point # 16
===================================================================
Number of q in the star = 12
List of q in the star:
1 -0.333333300 -1.000000000 -0.000000000
2 0.333333300 1.000000000 0.000000000
3 -1.000000000 -0.333333300 0.000000000
4 1.000000000 0.333333300 0.000000000
5 -0.000000000 1.000000000 -0.333333300
6 0.000000000 1.000000000 0.333333300
7 0.333333300 0.000000000 -1.000000000
8 -0.333333300 0.000000000 1.000000000
9 -1.000000000 0.000000000 -0.333333300
10 1.000000000 0.000000000 0.333333300
11 0.000000000 -0.333333300 -1.000000000
12 0.000000000 0.333333300 1.000000000
q( 205 ) = ( -0.3333333 -1.0000000 -0.0000000 )
elphmat(:,:,:)**2 1.126748
elphmat(:,:,:)**2 0.8564123
elphmat(:,:,:)**2 0.7720916
el_ph_mat(:,:,215,:)**2 2.755252
q( 206 ) = ( 0.3333333 1.0000000 0.0000000 )
elphmat(:,:,:)**2 0.9148844
elphmat(:,:,:)**2 1.062861
elphmat(:,:,:)**2 0.4083579
el_ph_mat(:,:,215,:)**2 2.386103
q( 207 ) = ( -1.0000000 -0.3333333 0.0000000 )
elphmat(:,:,:)**2 0.9148723
elphmat(:,:,:)**2 1.062853
elphmat(:,:,:)**2 0.4083558
el_ph_mat(:,:,215,:)**2 2.386081
q( 208 ) = ( 1.0000000 0.3333333 0.0000000 )
elphmat(:,:,:)**2 1.126748
elphmat(:,:,:)**2 0.8564123
elphmat(:,:,:)**2 0.7720916
el_ph_mat(:,:,215,:)**2 2.755252
q( 209 ) = ( -0.0000000 1.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.9700061
elphmat(:,:,:)**2 1.026532
elphmat(:,:,:)**2 0.6030399
el_ph_mat(:,:,215,:)**2 2.599577
q( 210 ) = ( 0.0000000 1.0000000 0.3333333 )
elphmat(:,:,:)**2 0.9699702
elphmat(:,:,:)**2 1.026492
elphmat(:,:,:)**2 0.6030205
el_ph_mat(:,:,215,:)**2 2.599483
q( 211 ) = ( 0.3333333 0.0000000 -1.0000000 )
elphmat(:,:,:)**2 1.056010
elphmat(:,:,:)**2 1.271538
elphmat(:,:,:)**2 0.4444280
el_ph_mat(:,:,215,:)**2 2.771976
q( 212 ) = ( -0.3333333 0.0000000 1.0000000 )
elphmat(:,:,:)**2 0.8873803
elphmat(:,:,:)**2 0.8493612
elphmat(:,:,:)**2 0.7024921
el_ph_mat(:,:,215,:)**2 2.439233
q( 213 ) = ( -1.0000000 0.0000000 -0.3333333 )
elphmat(:,:,:)**2 0.9700061
elphmat(:,:,:)**2 1.026532
elphmat(:,:,:)**2 0.6030397
el_ph_mat(:,:,215,:)**2 2.599578
q( 214 ) = ( 1.0000000 0.0000000 0.3333333 )
elphmat(:,:,:)**2 0.9700061
elphmat(:,:,:)**2 1.026532
elphmat(:,:,:)**2 0.6030399
el_ph_mat(:,:,215,:)**2 2.599577
q( 215 ) = ( 0.0000000 -0.3333333 -1.0000000 )
elphmat(:,:,:)**2 1.056010
elphmat(:,:,:)**2 1.271538
elphmat(:,:,:)**2 0.4444280
el_ph_mat(:,:,215,:)**2 2.771976
q( 216 ) = ( 0.0000000 0.3333333 1.0000000 )
elphmat(:,:,:)**2 0.8874878
elphmat(:,:,:)**2 0.8494018
elphmat(:,:,:)**2 0.7025197
el_ph_mat(:,:,215,:)**2 2.439409
Writing epmatq on .epb files
Using q-mesh file: meshes/path.dat
Size of q point mesh for interpolation: 201
Using uniform k-mesh: 10 10 10
Size of k point mesh for interpolation: 2000
Max number of k points per pool: 2000
Writing Hamiltonian, Dynamical matrix and EP vertex in Wann rep to file
Reading Hamiltonian, Dynamical matrix and EP vertex in Wann rep from file
Loading epwdata.fmt: ###########################################
Finished reading Wann rep data from file
Fermi energy coarse grid = 12.903744 eV
Fermi energy is calculated from the fine k-mesh: Ef = 13.293183 eV
Warning: check if difference with Fermi level fine grid makes sense
===================================================================
Number of ep-matrix elements per pool : 54000 ~= 421.88 Kb (@ 8 bytes/ DP)
===================================================================
Phonon (Imaginary) Self-Energy in the Migdal Approximation (on the fly)
===================================================================
Fermi Surface thickness = 1.360570 eV
Golden Rule strictly enforced with T = 0.025852 eV
Gaussian Broadening: 0.100000 eV, ngauss= 1
DOS = 0.159563 states/spin/eV/Unit Cell at Ef= 13.293183 eV
ismear = 1 iq = 1 coord.: 0.50000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.3841 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.3841 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.7027 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.4662 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.4662 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.4265 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
===================================================================
Electron (Imaginary) Self-Energy in the Migdal Approximation (on the fly)
===================================================================
Fermi Surface thickness = 1.360570 eV
Golden Rule strictly enforced with T = 0.025852 eV
Gaussian Broadening: 0.100000 eV, ngauss= 1
DOS = 0.159563 states/spin/eV/Unit Cell at Ef= 13.293183 eV
ismear = 1 iq = 2 coord.: 0.49500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.3772 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.3773 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.6728 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.4714 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.4714 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.4411 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 3 coord.: 0.49000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.3566 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.3573 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.5833 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.4867 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.4870 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.4846 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 4 coord.: 0.48500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.3225 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.3239 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.4352 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.5119 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.5126 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.5562 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 5 coord.: 0.48000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.2749 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.2773 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.2295 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.5469 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.5479 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.6547 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 6 coord.: 0.47500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.2141 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.2175 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 132.9681 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.5911 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.5926 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.7782 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 7 coord.: 0.47000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.1401 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.1445 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 132.6527 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.6441 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.6462 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.9249 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 8 coord.: 0.46500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.0530 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.0585 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 132.2856 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.7054 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.7079 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 155.0926 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 9 coord.: 0.46000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.9528 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.9592 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 131.8688 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 147.7743 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 147.7773 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 155.2790 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 6 out of 1000
ismear = 1 iq = 10 coord.: 0.45500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.8395 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.8467 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 131.4048 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 147.8502 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 147.8536 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 155.4817 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 11 coord.: 0.45000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.7131 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.7209 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 130.8958 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 147.9323 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 147.9360 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 155.6984 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 12 coord.: 0.44500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.5735 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.5818 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 130.3439 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.0199 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.0237 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 155.9269 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 13 coord.: 0.44000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.4207 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.4291 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 129.7511 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.1120 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.1159 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 156.1651 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 14 coord.: 0.43500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.2544 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.2628 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 129.1195 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.2078 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.2117 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 156.4109 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 15 coord.: 0.43000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 68.0745 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.0828 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 128.4507 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.3065 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.3103 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 156.6627 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 16 coord.: 0.42500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 67.8807 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 67.8889 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 127.7465 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.4070 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.4108 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 156.9188 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 17 coord.: 0.42000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 67.6727 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 67.6809 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 127.0084 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.5086 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.5124 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 157.1775 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 18 coord.: 0.41500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 67.4503 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 67.4587 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 126.2377 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.6102 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.6141 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 157.4377 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 19 coord.: 0.41000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 67.2131 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 67.2222 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 125.4356 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.7110 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.7153 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 157.6981 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 20 coord.: 0.40500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 66.9608 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 66.9710 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 124.6034 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.8102 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.8149 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 157.9576 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 21 coord.: 0.40000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 66.6931 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 66.7049 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 123.7421 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.9069 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.9123 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.2153 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 22 coord.: 0.39500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 66.4100 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 66.4235 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 122.8527 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.0004 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.0066 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.4705 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 23 coord.: 0.39000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 66.1110 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 66.1264 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 121.9360 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.0900 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.0970 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.7222 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 24 coord.: 0.38500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 65.7962 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 65.8133 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 120.9928 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.1751 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.1828 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.9701 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 25 coord.: 0.38000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 65.4651 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 65.4839 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 120.0240 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.2551 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.2634 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.2134 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 26 coord.: 0.37500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 65.1177 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 65.1378 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 119.0302 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.3293 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.3381 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.4517 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 27 coord.: 0.37000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 64.7539 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 64.7747 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 118.0122 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.3972 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4063 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.6845 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 28 coord.: 0.36500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 64.3733 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 64.3943 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 116.9704 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.4584 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4675 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.9115 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 7 out of 1000
ismear = 1 iq = 29 coord.: 0.36000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 63.9760 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 63.9965 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 115.9056 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.5125 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5213 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.1322 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 13 out of 1000
ismear = 1 iq = 30 coord.: 0.35500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 63.5619 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 63.5808 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 114.8183 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.5590 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5671 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.3464 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 31 coord.: 0.35000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 63.1308 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 63.1473 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 113.7089 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.5975 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6046 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.5537 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 32 coord.: 0.34500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 62.6828 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 62.6958 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 112.5782 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6279 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6334 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.7538 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 33 coord.: 0.34000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 62.2179 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 62.2261 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 111.4264 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6498 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6532 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.9462 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 34 coord.: 0.33500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 61.7361 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 61.7384 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 110.2541 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6629 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6639 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.1307 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 35 coord.: 0.33000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 61.2325 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 61.2376 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 109.0617 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6650 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6670 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.3068 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 36 coord.: 0.32500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 60.7088 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 60.7224 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 107.8496 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6564 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6619 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.4741 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 37 coord.: 0.32000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 60.1672 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 60.1908 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 106.6183 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6379 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6474 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.6321 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 38 coord.: 0.31500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 59.6081 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 59.6429 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 105.3681 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.6093 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.6232 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.7802 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 39 coord.: 0.31000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 59.0318 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 59.0790 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 104.0993 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.5706 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5891 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.9178 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 40 coord.: 0.30500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 58.4385 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 58.4993 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 102.8123 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.5214 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5451 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.0443 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 41 coord.: 0.30000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 57.8288 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 57.9041 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 101.5074 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.4618 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4908 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.1589 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 42 coord.: 0.29500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 57.2031 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 57.2936 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 100.1850 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.3915 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4260 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.2607 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 14 out of 1000
ismear = 1 iq = 43 coord.: 0.29000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 56.5619 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 56.6683 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 98.8452 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.3105 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.3505 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.3489 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 44 coord.: 0.28500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 55.9057 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 56.0282 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 97.4883 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.2185 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.2642 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.4224 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 45 coord.: 0.28000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 55.2351 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 55.3739 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 96.1147 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.1156 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.1667 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.4802 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 23 out of 1000
ismear = 1 iq = 46 coord.: 0.27500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 54.5507 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 54.7054 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 94.7244 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.0016 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.0579 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.5212 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 23 out of 1000
ismear = 1 iq = 47 coord.: 0.27000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 53.8530 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 54.0231 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 93.3178 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.8762 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.9374 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.5441 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 23 out of 1000
ismear = 1 iq = 48 coord.: 0.26500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 53.1426 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 53.3273 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 91.8950 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.7395 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.8051 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.5476 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 23 out of 1000
ismear = 1 iq = 49 coord.: 0.26000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 52.4200 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 52.6181 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 90.4562 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.5912 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.6607 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.5305 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 50 coord.: 0.25500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 51.6858 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 51.8958 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 89.0016 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.4312 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.5039 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.4911 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 30 out of 1000
ismear = 1 iq = 51 coord.: 0.25000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 50.9403 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 51.1604 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 87.5313 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.2593 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 148.3345 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.4282 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 30 out of 1000
ismear = 1 iq = 52 coord.: 0.24500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 50.1840 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 50.4122 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 86.0455 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.0753 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.1522 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.3403 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 30 out of 1000
ismear = 1 iq = 53 coord.: 0.24000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 49.4173 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 49.6512 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 84.5444 meV
lambda( 4 )= 0.0000 gamma= 0.0001 meV omega= 147.8792 meV
lambda( 5 )= 0.0000 gamma= 0.0001 meV omega= 147.9569 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.2257 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 30 out of 1000
ismear = 1 iq = 54 coord.: 0.23500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 48.6405 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 48.8775 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 83.0281 meV
lambda( 4 )= 0.0001 gamma= 0.0008 meV omega= 147.6706 meV
lambda( 5 )= 0.0001 gamma= 0.0007 meV omega= 147.7483 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.0831 meV
lambda( tot )= 0.0001
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 55 coord.: 0.23000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 47.8537 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 48.0911 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 81.4967 meV
lambda( 4 )= 0.0003 gamma= 0.0038 meV omega= 147.4496 meV
lambda( 5 )= 0.0003 gamma= 0.0038 meV omega= 147.5263 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.9110 meV
lambda( tot )= 0.0007
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 56 coord.: 0.22500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0001 gamma= -0.0002 meV omega= 47.0571 meV
lambda( 2 )= -0.0001 gamma= -0.0001 meV omega= 47.2920 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 79.9505 meV
lambda( 4 )= 0.0013 gamma= 0.0141 meV omega= 147.2158 meV
lambda( 5 )= 0.0013 gamma= 0.0141 meV omega= 147.2905 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 161.7077 meV
lambda( tot )= 0.0023
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 57 coord.: 0.22000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0015 gamma= -0.0016 meV omega= 46.2508 meV
lambda( 2 )= -0.0012 gamma= -0.0013 meV omega= 46.4801 meV
lambda( 3 )= -0.0001 gamma= -0.0003 meV omega= 78.3895 meV
lambda( 4 )= 0.0036 gamma= 0.0395 meV omega= 146.9691 meV
lambda( 5 )= 0.0036 gamma= 0.0394 meV omega= 147.0410 meV
lambda( 6 )= -0.0000 gamma= -0.0001 meV omega= 161.4720 meV
lambda( tot )= 0.0044
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 58 coord.: 0.21500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0091 gamma= -0.0094 meV omega= 45.4348 meV
lambda( 2 )= -0.0074 gamma= -0.0078 meV omega= 45.6555 meV
lambda( 3 )= -0.0007 gamma= -0.0020 meV omega= 76.8139 meV
lambda( 4 )= 0.0073 gamma= 0.0787 meV omega= 146.7095 meV
lambda( 5 )= 0.0073 gamma= 0.0786 meV omega= 146.7776 meV
lambda( 6 )= -0.0002 gamma= -0.0021 meV omega= 161.2024 meV
lambda( tot )= -0.0028
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 59 coord.: 0.21000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0292 gamma= -0.0291 meV omega= 44.6090 meV
lambda( 2 )= -0.0243 gamma= -0.0244 meV omega= 44.8180 meV
lambda( 3 )= -0.0030 gamma= -0.0086 meV omega= 75.2239 meV
lambda( 4 )= 0.0072 gamma= 0.0772 meV omega= 146.4368 meV
lambda( 5 )= 0.0072 gamma= 0.0774 meV omega= 146.5003 meV
lambda( 6 )= -0.0013 gamma= -0.0169 meV omega= 160.8977 meV
lambda( tot )= -0.0434
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 60 coord.: 0.20500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0347 gamma= -0.0333 meV omega= 43.7732 meV
lambda( 2 )= -0.0293 gamma= -0.0284 meV omega= 43.9675 meV
lambda( 3 )= -0.0049 gamma= -0.0133 meV omega= 73.6197 meV
lambda( 4 )= 0.0007 gamma= 0.0080 meV omega= 146.1508 meV
lambda( 5 )= 0.0008 gamma= 0.0086 meV omega= 146.2089 meV
lambda( 6 )= -0.0039 gamma= -0.0504 meV omega= 160.5566 meV
lambda( tot )= -0.0712
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 61 coord.: 0.20000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 42.9273 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 43.1040 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 72.0015 meV
lambda( 4 )= 0.0255 gamma= 0.2715 meV omega= 145.8517 meV
lambda( 5 )= 0.0254 gamma= 0.2715 meV omega= 145.9035 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.1781 meV
lambda( tot )= 0.0509
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 62 coord.: 0.19500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0267 gamma= 0.0237 meV omega= 42.0710 meV
lambda( 2 )= 0.0234 gamma= 0.0209 meV omega= 42.2273 meV
lambda( 3 )= 0.0067 gamma= 0.0167 meV omega= 70.3694 meV
lambda( 4 )= 0.1038 gamma= 1.1022 meV omega= 145.5392 meV
lambda( 5 )= 0.1036 gamma= 1.1006 meV omega= 145.5843 meV
lambda( 6 )= 0.0183 gamma= 0.2346 meV omega= 159.7613 meV
lambda( tot )= 0.2825
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 63 coord.: 0.19000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0298 gamma= 0.0254 meV omega= 41.2041 meV
lambda( 2 )= 0.0266 gamma= 0.0228 meV omega= 41.3374 meV
lambda( 3 )= 0.0099 gamma= 0.0234 meV omega= 68.7237 meV
lambda( 4 )= 0.2134 gamma= 2.2559 meV omega= 145.2134 meV
lambda( 5 )= 0.2131 gamma= 2.2532 meV omega= 145.2512 meV
lambda( 6 )= 0.0496 gamma= 0.6304 meV omega= 159.3054 meV
lambda( tot )= 0.5424
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 39 out of 1000
ismear = 1 iq = 64 coord.: 0.18500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0192 gamma= 0.0156 meV omega= 40.3261 meV
lambda( 2 )= 0.0172 gamma= 0.0141 meV omega= 40.4342 meV
lambda( 3 )= 0.0090 gamma= 0.0202 meV omega= 67.0646 meV
lambda( 4 )= 0.3057 gamma= 3.2164 meV omega= 144.8745 meV
lambda( 5 )= 0.3053 gamma= 3.2139 meV omega= 144.9046 meV
lambda( 6 )= 0.0821 gamma= 1.0377 meV omega= 158.8098 meV
lambda( tot )= 0.7385
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 39 out of 1000
ismear = 1 iq = 65 coord.: 0.18000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0043 gamma= -0.0033 meV omega= 39.4369 meV
lambda( 2 )= -0.0054 gamma= -0.0043 meV omega= 39.5176 meV
lambda( 3 )= 0.0059 gamma= 0.0127 meV omega= 65.3925 meV
lambda( 4 )= 0.3290 gamma= 3.4446 meV omega= 144.5226 meV
lambda( 5 )= 0.3288 gamma= 3.4431 meV omega= 144.5446 meV
lambda( 6 )= 0.0987 gamma= 1.2396 meV omega= 158.2742 meV
lambda( tot )= 0.7527
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 42 out of 1000
ismear = 1 iq = 66 coord.: 0.17500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0355 gamma= -0.0264 meV omega= 38.5359 meV
lambda( 2 )= -0.0364 gamma= -0.0271 meV omega= 38.5875 meV
lambda( 3 )= 0.0031 gamma= 0.0063 meV omega= 63.7075 meV
lambda( 4 )= 0.2707 gamma= 2.8198 meV omega= 144.1577 meV
lambda( 5 )= 0.2706 gamma= 2.8193 meV omega= 144.1715 meV
lambda( 6 )= 0.0913 gamma= 1.1387 meV omega= 157.6983 meV
lambda( tot )= 0.5639
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 42 out of 1000
ismear = 1 iq = 67 coord.: 0.17000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.1066 gamma= 0.0756 meV omega= 37.6230 meV
lambda( 2 )= 0.1072 gamma= 0.0762 meV omega= 37.6440 meV
lambda( 3 )= 0.0013 gamma= 0.0025 meV omega= 62.0099 meV
lambda( 4 )= 0.2468 gamma= 2.5580 meV omega= 143.7803 meV
lambda( 5 )= 0.2468 gamma= 2.5579 meV omega= 143.7858 meV
lambda( 6 )= 0.0677 gamma= 0.8368 meV omega= 157.0823 meV
lambda( tot )= 0.7764
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 42 out of 1000
ismear = 1 iq = 68 coord.: 0.16500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.4430 gamma= 0.2989 meV omega= 36.6870 meV
lambda( 2 )= 0.4444 gamma= 0.3000 meV omega= 36.6977 meV
lambda( 3 )= 0.0005 gamma= 0.0008 meV omega= 60.3002 meV
lambda( 4 )= 0.7212 gamma= 7.4325 meV omega= 143.3880 meV
lambda( 5 )= 0.7211 gamma= 7.4324 meV omega= 143.3907 meV
lambda( 6 )= 0.0416 gamma= 0.5099 meV omega= 156.4264 meV
lambda( tot )= 2.3717
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 42 out of 1000
ismear = 1 iq = 69 coord.: 0.16000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.3823 gamma= 0.2445 meV omega= 35.7167 meV
lambda( 2 )= 0.3877 gamma= 0.2485 meV omega= 35.7597 meV
lambda( 3 )= 0.0002 gamma= 0.0003 meV omega= 58.5785 meV
lambda( 4 )= 1.3403 gamma= 13.7347 meV omega= 142.9785 meV
lambda( 5 )= 1.3402 gamma= 13.7358 meV omega= 142.9893 meV
lambda( 6 )= 0.0220 gamma= 0.2670 meV omega= 155.7313 meV
lambda( tot )= 3.4726
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 48 out of 1000
ismear = 1 iq = 70 coord.: 0.15500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0873 gamma= 0.0528 meV omega= 34.7330 meV
lambda( 2 )= 0.0915 gamma= 0.0556 meV omega= 34.8088 meV
lambda( 3 )= 0.0000 gamma= 0.0001 meV omega= 56.8454 meV
lambda( 4 )= 1.4806 gamma= 15.0830 meV omega= 142.5581 meV
lambda( 5 )= 1.4806 gamma= 15.0876 meV omega= 142.5766 meV
lambda( 6 )= 0.0103 gamma= 0.1245 meV omega= 154.9980 meV
lambda( tot )= 3.1504
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 49 out of 1000
ismear = 1 iq = 71 coord.: 0.15000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.1411 gamma= 0.0805 meV omega= 33.7362 meV
lambda( 2 )= 0.1452 gamma= 0.0834 meV omega= 33.8448 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 55.1012 meV
lambda( 4 )= 1.2817 gamma= 12.9780 meV omega= 142.1275 meV
lambda( 5 )= 1.2819 gamma= 12.9857 meV omega= 142.1533 meV
lambda( 6 )= 0.0045 gamma= 0.0536 meV omega= 154.2275 meV
lambda( tot )= 2.8543
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 49 out of 1000
ismear = 1 iq = 72 coord.: 0.14500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0989 gamma= 0.0531 meV omega= 32.7264 meV
lambda( 2 )= 0.1024 gamma= 0.0554 meV omega= 32.8674 meV
lambda( 3 )= -0.0003 gamma= -0.0004 meV omega= 53.3462 meV
lambda( 4 )= 1.0431 gamma= 10.4973 meV omega= 141.6875 meV
lambda( 5 )= 1.0436 gamma= 10.5072 meV omega= 141.7202 meV
lambda( 6 )= 0.0019 gamma= 0.0219 meV omega= 153.4214 meV
lambda( tot )= 2.2895
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 49 out of 1000
ismear = 1 iq = 73 coord.: 0.14000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0323 gamma= 0.0163 meV omega= 31.7038 meV
lambda( 2 )= 0.0348 gamma= 0.0177 meV omega= 31.8765 meV
lambda( 3 )= -0.0013 gamma= -0.0017 meV omega= 51.5810 meV
lambda( 4 )= 0.8297 gamma= 8.2965 meV omega= 141.2391 meV
lambda( 5 )= 0.8303 gamma= 8.3074 meV omega= 141.2781 meV
lambda( 6 )= 0.0007 gamma= 0.0077 meV omega= 152.5815 meV
lambda( tot )= 1.7265
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 49 out of 1000
ismear = 1 iq = 74 coord.: 0.13500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0063 gamma= 0.0030 meV omega= 30.6687 meV
lambda( 2 )= 0.0097 gamma= 0.0046 meV omega= 30.8720 meV
lambda( 3 )= -0.0040 gamma= -0.0049 meV omega= 49.8060 meV
lambda( 4 )= 0.6728 gamma= 6.6844 meV omega= 140.7834 meV
lambda( 5 )= 0.6734 gamma= 6.6950 meV omega= 140.8280 meV
lambda( 6 )= -0.0003 gamma= -0.0037 meV omega= 151.7101 meV
lambda( tot )= 1.3580
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 75 coord.: 0.13000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0061 gamma= -0.0027 meV omega= 29.6215 meV
lambda( 2 )= -0.0004 gamma= -0.0002 meV omega= 29.8540 meV
lambda( 3 )= -0.0084 gamma= -0.0097 meV omega= 48.0216 meV
lambda( 4 )= 0.6194 gamma= 6.1141 meV omega= 140.3215 meV
lambda( 5 )= 0.6201 gamma= 6.1250 meV omega= 140.3709 meV
lambda( 6 )= -0.0023 gamma= -0.0262 meV omega= 150.8095 meV
lambda( tot )= 1.2223
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 76 coord.: 0.12500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0039 gamma= -0.0016 meV omega= 28.5624 meV
lambda( 2 )= 0.0029 gamma= 0.0012 meV omega= 28.8225 meV
lambda( 3 )= -0.0097 gamma= -0.0104 meV omega= 46.2284 meV
lambda( 4 )= 0.6687 gamma= 6.5565 meV omega= 139.8546 meV
lambda( 5 )= 0.6695 gamma= 6.5689 meV omega= 139.9082 meV
lambda( 6 )= -0.0048 gamma= -0.0543 meV omega= 149.8828 meV
lambda( tot )= 1.3226
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 77 coord.: 0.12000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0372 gamma= 0.0141 meV omega= 27.4920 meV
lambda( 2 )= 0.0372 gamma= 0.0144 meV omega= 27.7777 meV
lambda( 3 )= 0.0063 gamma= 0.0062 meV omega= 44.4269 meV
lambda( 4 )= 0.8417 gamma= 8.1969 meV omega= 139.3842 meV
lambda( 5 )= 0.8424 gamma= 8.2111 meV omega= 139.4411 meV
lambda( 6 )= 0.0066 gamma= 0.0729 meV omega= 148.9331 meV
lambda( tot )= 1.7713
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 78 coord.: 0.11500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.1345 gamma= 0.0470 meV omega= 26.4107 meV
lambda( 2 )= 0.1142 gamma= 0.0409 meV omega= 26.7197 meV
lambda( 3 )= 0.0536 gamma= 0.0488 meV omega= 42.6176 meV
lambda( 4 )= 1.2073 gamma= 11.6782 meV omega= 138.9118 meV
lambda( 5 )= 1.2077 gamma= 11.6924 meV omega= 138.9710 meV
lambda( 6 )= 0.0828 gamma= 0.9092 meV omega= 147.9639 meV
lambda( tot )= 2.8002
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 79 coord.: 0.11000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.2623 gamma= 0.0843 meV omega= 25.3190 meV
lambda( 2 )= 0.2199 gamma= 0.0725 meV omega= 25.6487 meV
lambda( 3 )= 0.1151 gamma= 0.0960 meV omega= 40.8010 meV
lambda( 4 )= 1.7662 gamma= 16.9686 meV omega= 138.4388 meV
lambda( 5 )= 1.7656 gamma= 16.9777 meV omega= 138.4997 meV
lambda( 6 )= 0.2759 gamma= 2.9879 meV omega= 146.9792 meV
lambda( tot )= 4.4051
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 80 coord.: 0.10500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.4003 gamma= 0.1177 meV omega= 24.2174 meV
lambda( 2 )= 0.3614 gamma= 0.1093 meV omega= 24.5653 meV
lambda( 3 )= 0.1491 gamma= 0.1135 meV omega= 38.9776 meV
lambda( 4 )= 2.2416 gamma= 21.3892 meV omega= 137.9670 meV
lambda( 5 )= 2.2394 gamma= 21.3872 meV omega= 138.0286 meV
lambda( 6 )= 0.5461 gamma= 5.8339 meV omega= 145.9830 meV
lambda( tot )= 5.9379
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 81 coord.: 0.10000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.5379 gamma= 0.1440 meV omega= 23.1066 meV
lambda( 2 )= 0.5369 gamma= 0.1482 meV omega= 23.4696 meV
lambda( 3 )= 0.1386 gamma= 0.0959 meV omega= 37.1482 meV
lambda( 4 )= 2.1612 gamma= 20.4816 meV omega= 137.4981 meV
lambda( 5 )= 2.1576 gamma= 20.4660 meV omega= 137.5598 meV
lambda( 6 )= 0.8191 gamma= 8.6304 meV omega= 144.9800 meV
lambda( tot )= 6.3512
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 52 out of 1000
ismear = 1 iq = 82 coord.: 0.09500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.2616 gamma= 0.0634 meV omega= 21.9872 meV
lambda( 2 )= 0.2384 gamma= 0.0598 meV omega= 22.3622 meV
lambda( 3 )= 0.1003 gamma= 0.0627 meV omega= 35.3131 meV
lambda( 4 )= 1.5430 gamma= 14.5249 meV omega= 137.0340 meV
lambda( 5 )= 1.5393 gamma= 14.5030 meV omega= 137.0949 meV
lambda( 6 )= 1.0407 gamma= 10.8134 meV omega= 143.9749 meV
lambda( tot )= 4.7233
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 83 coord.: 0.09000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.3120 gamma= -0.0681 meV omega= 20.8598 meV
lambda( 2 )= -0.4344 gamma= -0.0983 meV omega= 21.2436 meV
lambda( 3 )= 0.0684 gamma= 0.0384 meV omega= 33.4729 meV
lambda( 4 )= 1.3503 gamma= 12.6264 meV omega= 136.5767 meV
lambda( 5 )= 1.3470 gamma= 12.6062 meV omega= 136.6359 meV
lambda( 6 )= 1.1887 gamma= 12.1799 meV omega= 142.9729 meV
lambda( tot )= 3.2080
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 64 out of 1000
ismear = 1 iq = 84 coord.: 0.08500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.2334 gamma= -0.0455 meV omega= 19.7251 meV
lambda( 2 )= -0.3461 gamma= -0.0702 meV omega= 20.1144 meV
lambda( 3 )= 0.0662 gamma= 0.0332 meV omega= 31.6283 meV
lambda( 4 )= 1.4161 gamma= 13.1539 meV omega= 136.1280 meV
lambda( 5 )= 1.4129 gamma= 13.1354 meV omega= 136.1850 meV
lambda( 6 )= 1.2760 gamma= 12.8942 meV omega= 141.9791 meV
lambda( tot )= 3.5917
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 64 out of 1000
ismear = 1 iq = 85 coord.: 0.08000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0177 gamma= -0.0031 meV omega= 18.5839 meV
lambda( 2 )= -0.1003 gamma= -0.0181 meV omega= 18.9751 meV
lambda( 3 )= 0.0873 gamma= 0.0388 meV omega= 29.7796 meV
lambda( 4 )= 1.4557 gamma= 13.4356 meV omega= 135.6900 meV
lambda( 5 )= 1.4527 gamma= 13.4182 meV omega= 135.7442 meV
lambda( 6 )= 1.3269 gamma= 13.2234 meV omega= 140.9992 meV
lambda( tot )= 4.2045
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 67 out of 1000
ismear = 1 iq = 86 coord.: 0.07500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0885 gamma= -0.0135 meV omega= 17.4368 meV
lambda( 2 )= -0.2341 gamma= -0.0373 meV omega= 17.8265 meV
lambda( 3 )= 0.1132 gamma= 0.0442 meV omega= 27.9276 meV
lambda( 4 )= 1.4844 gamma= 13.6147 meV omega= 135.2648 meV
lambda( 5 )= 1.4815 gamma= 13.5981 meV omega= 135.3156 meV
lambda( 6 )= 1.3593 gamma= 13.3625 meV omega= 140.0389 meV
lambda( tot )= 4.1158
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 67 out of 1000
ismear = 1 iq = 87 coord.: 0.07000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.4792 gamma= -0.0637 meV omega= 16.2847 meV
lambda( 2 )= -0.8153 gamma= -0.1136 meV omega= 16.6692 meV
lambda( 3 )= 0.1350 gamma= 0.0460 meV omega= 26.0726 meV
lambda( 4 )= 1.5070 gamma= 13.7381 meV omega= 134.8544 meV
lambda( 5 )= 1.5042 gamma= 13.7223 meV omega= 134.9014 meV
lambda( 6 )= 1.3642 gamma= 13.2322 meV omega= 139.1038 meV
lambda( tot )= 3.2159
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 67 out of 1000
ismear = 1 iq = 88 coord.: 0.06500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0508 gamma= -0.0058 meV omega= 15.1283 meV
lambda( 2 )= -0.2465 gamma= -0.0297 meV omega= 15.5039 meV
lambda( 3 )= 0.1686 gamma= 0.0496 meV omega= 24.2152 meV
lambda( 4 )= 1.5657 gamma= 14.1900 meV omega= 134.4610 meV
lambda( 5 )= 1.5631 gamma= 14.1751 meV omega= 134.5038 meV
lambda( 6 )= 1.3821 gamma= 13.2319 meV omega= 138.2000 meV
lambda( tot )= 4.3821
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 73 out of 1000
ismear = 1 iq = 89 coord.: 0.06000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.6242 gamma= 0.0610 meV omega= 13.9682 meV
lambda( 2 )= 0.6964 gamma= 0.0717 meV omega= 14.3315 meV
lambda( 3 )= 0.2052 gamma= 0.0514 meV omega= 22.3558 meV
lambda( 4 )= 1.7427 gamma= 15.7059 meV omega= 134.0866 meV
lambda( 5 )= 1.7401 gamma= 15.6917 meV omega= 134.1249 meV
lambda( 6 )= 1.5775 gamma= 14.9140 meV omega= 137.3334 meV
lambda( tot )= 6.5860
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 90 coord.: 0.05500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.8805 gamma= 0.0724 meV omega= 12.8053 meV
lambda( 2 )= 1.0242 gamma= 0.0888 meV omega= 13.1528 meV
lambda( 3 )= 0.2392 gamma= 0.0504 meV omega= 20.4949 meV
lambda( 4 )= 1.9275 gamma= 17.2802 meV omega= 133.7332 meV
lambda( 5 )= 1.9249 gamma= 17.2662 meV omega= 133.7668 meV
lambda( 6 )= 1.8960 gamma= 17.7112 meV omega= 136.5097 meV
lambda( tot )= 7.8924
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 80 out of 1000
ismear = 1 iq = 91 coord.: 0.05000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.9001 gamma= 0.0611 meV omega= 11.6402 meV
lambda( 2 )= 1.0061 gamma= 0.0722 meV omega= 11.9684 meV
lambda( 3 )= 0.2815 gamma= 0.0490 meV omega= 18.6327 meV
lambda( 4 )= 2.0303 gamma= 18.1126 meV omega= 133.4028 meV
lambda( 5 )= 2.0279 gamma= 18.0988 meV omega= 133.4318 meV
lambda( 6 )= 2.2033 gamma= 20.3487 meV omega= 135.7347 meV
lambda( tot )= 8.4492
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 80 out of 1000
ismear = 1 iq = 92 coord.: 0.04500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.1846 gamma= 0.0102 meV omega= 10.4736 meV
lambda( 2 )= 0.1189 gamma= 0.0069 meV omega= 10.7793 meV
lambda( 3 )= 0.3415 gamma= 0.0481 meV omega= 16.7698 meV
lambda( 4 )= 2.1367 gamma= 18.9745 meV omega= 133.0974 meV
lambda( 5 )= 2.1346 gamma= 18.9623 meV omega= 133.1217 meV
lambda( 6 )= 2.4174 gamma= 22.0894 meV omega= 135.0141 meV
lambda( tot )= 7.3337
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 80 out of 1000
ismear = 1 iq = 93 coord.: 0.04000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.7095 gamma= 0.0308 meV omega= 9.3063 meV
lambda( 2 )= 0.6239 gamma= 0.0287 meV omega= 9.5864 meV
lambda( 3 )= 0.4253 gamma= 0.0474 meV omega= 14.9062 meV
lambda( 4 )= 2.2273 gamma= 19.6959 meV omega= 132.8186 meV
lambda( 5 )= 2.2255 gamma= 19.6855 meV omega= 132.8384 meV
lambda( 6 )= 2.5316 gamma= 22.9069 meV omega= 134.3532 meV
lambda( tot )= 8.7431
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 80 out of 1000
ismear = 1 iq = 94 coord.: 0.03500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.8523 gamma= 0.0283 meV omega= 8.1387 meV
lambda( 2 )= 0.6329 gamma= 0.0223 meV omega= 8.3903 meV
lambda( 3 )= 0.5154 gamma= 0.0439 meV omega= 13.0424 meV
lambda( 4 )= 2.2755 gamma= 20.0464 meV omega= 132.5682 meV
lambda( 5 )= 2.2740 gamma= 20.0379 meV omega= 132.5838 meV
lambda( 6 )= 2.5705 gamma= 23.0529 meV omega= 133.7569 meV
lambda( tot )= 9.1206
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 95 coord.: 0.03000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.7910 gamma= 0.0193 meV omega= 6.9715 meV
lambda( 2 )= 0.3223 gamma= 0.0084 meV omega= 7.1920 meV
lambda( 3 )= 0.5467 gamma= 0.0342 meV omega= 11.1785 meV
lambda( 4 )= 2.2774 gamma= 19.9960 meV omega= 132.3477 meV
lambda( 5 )= 2.2762 gamma= 19.9896 meV omega= 132.3594 meV
lambda( 6 )= 2.5401 gamma= 22.6013 meV omega= 133.2299 meV
lambda( tot )= 8.7537
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 96 coord.: 0.02500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.5148 gamma= 0.0087 meV omega= 5.8051 meV
lambda( 2 )= -0.2972 gamma= -0.0054 meV omega= 5.9922 meV
lambda( 3 )= 0.3959 gamma= 0.0172 meV omega= 9.3147 meV
lambda( 4 )= 2.1862 gamma= 19.1408 meV omega= 132.1586 meV
lambda( 5 )= 2.1854 gamma= 19.1366 meV omega= 132.1669 meV
lambda( 6 )= 2.4021 gamma= 21.2285 meV omega= 132.7765 meV
lambda( tot )= 7.3872
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 97 coord.: 0.02000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0902 gamma= -0.0010 meV omega= 4.6400 meV
lambda( 2 )= -1.1808 gamma= -0.0136 meV omega= 4.7919 meV
lambda( 3 )= -0.0783 gamma= -0.0022 meV omega= 7.4511 meV
lambda( 4 )= 1.9274 gamma= 16.8352 meV omega= 132.0021 meV
lambda( 5 )= 1.9270 gamma= 16.8330 meV omega= 132.0074 meV
lambda( 6 )= 2.1029 gamma= 18.4785 meV omega= 132.4003 meV
lambda( tot )= 4.6080
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 98 coord.: 0.01500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -1.8943 gamma= -0.0115 meV omega= 3.4765 meV
lambda( 2 )= -2.9131 gamma= -0.0188 meV omega= 3.5916 meV
lambda( 3 )= -1.0850 gamma= -0.0170 meV omega= 5.5876 meV
lambda( 4 )= 1.4554 gamma= 12.6889 meV omega= 131.8791 meV
lambda( 5 )= 1.4553 gamma= 12.6882 meV omega= 131.8822 meV
lambda( 6 )= 1.6117 gamma= 14.0992 meV omega= 132.1043 meV
lambda( tot )= -1.3700
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 99 coord.: 0.01000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -8.6134 gamma= -0.0231 meV omega= 2.3148 meV
lambda( 2 )= -9.8631 gamma= -0.0283 meV omega= 2.3920 meV
lambda( 3 )= -2.9709 gamma= -0.0207 meV omega= 3.7244 meV
lambda( 4 )= 0.8351 gamma= 7.2711 meV omega= 131.7907 meV
lambda( 5 )= 0.8351 gamma= 7.2712 meV omega= 131.7920 meV
lambda( 6 )= 0.9695 gamma= 8.4537 meV omega= 131.8911 meV
lambda( tot )= -18.8077
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 100 coord.: 0.00500 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -14.5349 gamma= -0.0097 meV omega= 1.1548 meV
lambda( 2 )= -16.6758 gamma= -0.0119 meV omega= 1.1934 meV
lambda( 3 )= -3.6050 gamma= -0.0063 meV omega= 1.8611 meV
lambda( 4 )= 0.2458 gamma= 2.1382 meV omega= 131.7373 meV
lambda( 5 )= 0.2458 gamma= 2.1383 meV omega= 131.7376 meV
lambda( 6 )= 0.3006 gamma= 2.6162 meV omega= 131.7625 meV
lambda( tot )= -34.0236
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 101 coord.: 0.00000 0.00000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= -0.0684 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= -0.0684 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= -0.0659 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 131.7195 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 131.7195 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 131.7195 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 102 coord.: 0.00500 0.00500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -3.3944 gamma= -0.0027 meV omega= 1.2597 meV
lambda( 2 )= -1.7596 gamma= -0.0018 meV omega= 1.4453 meV
lambda( 3 )= -24.6205 gamma= -0.0451 meV omega= 1.9122 meV
lambda( 4 )= 0.2724 gamma= 2.3700 meV omega= 131.7480 meV
lambda( 5 )= 0.2722 gamma= 2.3684 meV omega= 131.7499 meV
lambda( 6 )= 0.4186 gamma= 3.6432 meV omega= 131.7695 meV
lambda( tot )= -28.8113
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 103 coord.: 0.01000 0.01000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -2.3362 gamma= -0.0075 meV omega= 2.5254 meV
lambda( 2 )= -0.3646 gamma= -0.0015 meV omega= 2.8923 meV
lambda( 3 )= -7.1266 gamma= -0.0523 meV omega= 3.8257 meV
lambda( 4 )= 0.7647 gamma= 6.6622 meV omega= 131.8333 meV
lambda( 5 )= 0.7641 gamma= 6.6576 meV omega= 131.8411 meV
lambda( 6 )= 0.9450 gamma= 8.2438 meV omega= 131.9193 meV
lambda( tot )= -7.3537
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 104 coord.: 0.01500 0.01500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -3.9474 gamma= -0.0285 meV omega= 3.7948 meV
lambda( 2 )= -0.0505 gamma= -0.0005 meV omega= 4.3381 meV
lambda( 3 )= -2.2980 gamma= -0.0379 meV omega= 5.7383 meV
lambda( 4 )= 1.1188 gamma= 9.7684 meV omega= 131.9747 meV
lambda( 5 )= 1.1177 gamma= 9.7610 meV omega= 131.9920 meV
lambda( 6 )= 0.9791 gamma= 8.5733 meV omega= 132.1673 meV
lambda( tot )= -3.0804
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 105 coord.: 0.02000 0.02000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -5.8176 gamma= -0.0750 meV omega= 5.0697 meV
lambda( 2 )= -0.1532 gamma= -0.0026 meV omega= 5.7831 meV
lambda( 3 )= -2.2287 gamma= -0.0654 meV omega= 7.6501 meV
lambda( 4 )= 1.2923 gamma= 11.3168 meV omega= 132.1713 meV
lambda( 5 )= 1.2906 gamma= 11.3066 meV omega= 132.2016 meV
lambda( 6 )= 0.7100 gamma= 6.2497 meV omega= 132.5113 meV
lambda( tot )= -4.9066
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 106 coord.: 0.02500 0.02500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -5.8564 gamma= -0.1184 meV omega= 6.3513 meV
lambda( 2 )= -0.1822 gamma= -0.0048 meV omega= 7.2275 meV
lambda( 3 )= -1.8857 gamma= -0.0864 meV omega= 9.5610 meV
lambda( 4 )= 1.3393 gamma= 11.7725 meV omega= 132.4215 meV
lambda( 5 )= 1.3368 gamma= 11.7587 meV omega= 132.4679 meV
lambda( 6 )= 0.4262 gamma= 3.7761 meV omega= 132.9482 meV
lambda( tot )= -4.8220
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 83 out of 1000
ismear = 1 iq = 107 coord.: 0.03000 0.03000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -4.0945 gamma= -0.1198 meV omega= 7.6407 meV
lambda( 2 )= -0.1192 gamma= -0.0045 meV omega= 8.6715 meV
lambda( 3 )= -1.2436 gamma= -0.0820 meV omega= 11.4709 meV
lambda( 4 )= 1.2735 gamma= 11.2457 meV omega= 132.7233 meV
lambda( 5 )= 1.2703 gamma= 11.2283 meV omega= 132.7888 meV
lambda( 6 )= 0.2431 gamma= 2.1714 meV omega= 133.4739 meV
lambda( tot )= -2.6702
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 108 coord.: 0.03500 0.03500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -1.7640 gamma= -0.0707 meV omega= 8.9390 meV
lambda( 2 )= -0.0255 gamma= -0.0013 meV omega= 10.1149 meV
lambda( 3 )= -0.6108 gamma= -0.0548 meV omega= 13.3800 meV
lambda( 4 )= 1.0662 gamma= 9.4645 meV omega= 133.0746 meV
lambda( 5 )= 1.0626 gamma= 9.4454 meV omega= 133.1615 meV
lambda( 6 )= 0.1457 gamma= 1.3133 meV omega= 134.0838 meV
lambda( tot )= -0.1258
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 109 coord.: 0.04000 0.04000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.2026 gamma= -0.0107 meV omega= 10.2472 meV
lambda( 2 )= 0.0313 gamma= 0.0021 meV omega= 11.5579 meV
lambda( 3 )= -0.2026 gamma= -0.0237 meV omega= 15.2882 meV
lambda( 4 )= 0.7084 gamma= 6.3261 meV omega= 133.4727 meV
lambda( 5 )= 0.7053 gamma= 6.3092 meV omega= 133.5831 meV
lambda( 6 )= 0.0961 gamma= 0.8753 meV omega= 134.7724 meV
lambda( tot )= 1.1359
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 110 coord.: 0.04500 0.04500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.2340 gamma= 0.0157 meV omega= 11.5664 meV
lambda( 2 )= 0.0328 gamma= 0.0028 meV omega= 13.0006 meV
lambda( 3 )= -0.0395 gamma= -0.0059 meV omega= 17.1956 meV
lambda( 4 )= 0.3386 gamma= 3.0443 meV omega= 133.9146 meV
lambda( 5 )= 0.3369 gamma= 3.0344 meV omega= 134.0502 meV
lambda( 6 )= 0.0729 gamma= 0.6714 meV omega= 135.5340 meV
lambda( tot )= 0.9758
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 111 coord.: 0.05000 0.05000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0884 gamma= 0.0074 meV omega= 12.8973 meV
lambda( 2 )= 0.0095 gamma= 0.0010 meV omega= 14.4429 meV
lambda( 3 )= -0.0104 gamma= -0.0019 meV omega= 19.1023 meV
lambda( 4 )= 0.0956 gamma= 0.8656 meV omega= 134.3972 meV
lambda( 5 )= 0.0952 gamma= 0.8638 meV omega= 134.5589 meV
lambda( 6 )= 0.0667 gamma= 0.6220 meV omega= 136.3619 meV
lambda( tot )= 0.3450
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 79 out of 1000
ismear = 1 iq = 112 coord.: 0.05500 0.05500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0957 gamma= -0.0097 meV omega= 14.2410 meV
lambda( 2 )= -0.0081 gamma= -0.0010 meV omega= 15.8849 meV
lambda( 3 )= -0.0267 gamma= -0.0059 meV omega= 21.0086 meV
lambda( 4 )= 0.0162 gamma= 0.1475 meV omega= 134.9168 meV
lambda( 5 )= 0.0164 gamma= 0.1500 meV omega= 135.1054 meV
lambda( 6 )= 0.0752 gamma= 0.7098 meV omega= 137.2495 meV
lambda( tot )= -0.0228
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 70 out of 1000
ismear = 1 iq = 113 coord.: 0.06000 0.06000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.1524 gamma= -0.0186 meV omega= 15.5979 meV
lambda( 2 )= -0.0137 gamma= -0.0021 meV omega= 17.3265 meV
lambda( 3 )= -0.0704 gamma= -0.0185 meV omega= 22.9147 meV
lambda( 4 )= 0.0237 gamma= 0.2183 meV omega= 135.4699 meV
lambda( 5 )= 0.0240 gamma= 0.2215 meV omega= 135.6853 meV
lambda( 6 )= 0.1027 gamma= 0.9828 meV omega= 138.1897 meV
lambda( tot )= -0.0862
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 70 out of 1000
ismear = 1 iq = 114 coord.: 0.06500 0.06500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.1495 gamma= -0.0216 meV omega= 16.9690 meV
lambda( 2 )= -0.0165 gamma= -0.0029 meV omega= 18.7678 meV
lambda( 3 )= -0.1772 gamma= -0.0547 meV omega= 24.8209 meV
lambda( 4 )= 0.0528 gamma= 0.4900 meV omega= 136.0524 meV
lambda( 5 )= 0.0530 gamma= 0.4931 meV omega= 136.2943 meV
lambda( 6 )= 0.1631 gamma= 1.5832 meV omega= 139.1751 meV
lambda( tot )= -0.0743
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 70 out of 1000
ismear = 1 iq = 115 coord.: 0.07000 0.07000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.1555 gamma= -0.0263 meV omega= 18.3546 meV
lambda( 2 )= -0.0221 gamma= -0.0045 meV omega= 20.2086 meV
lambda( 3 )= -0.3780 gamma= -0.1354 meV omega= 26.7275 meV
lambda( 4 )= 0.0934 gamma= 0.8744 meV omega= 136.6603 meV
lambda( 5 )= 0.0935 gamma= 0.8785 meV omega= 136.9277 meV
lambda( 6 )= 0.2822 gamma= 2.7800 meV omega= 140.1983 meV
lambda( tot )= -0.0866
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 70 out of 1000
ismear = 1 iq = 116 coord.: 0.07500 0.07500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.1601 gamma= -0.0313 meV omega= 19.7552 meV
lambda( 2 )= -0.0257 gamma= -0.0060 meV omega= 21.6490 meV
lambda( 3 )= -0.5805 gamma= -0.2386 meV omega= 28.6349 meV
lambda( 4 )= 0.1564 gamma= 1.4782 meV omega= 137.2896 meV
lambda( 5 )= 0.1564 gamma= 1.4840 meV omega= 137.5810 meV
lambda( 6 )= 0.4881 gamma= 4.8815 meV omega= 141.2520 meV
lambda( tot )= 0.0346
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 66 out of 1000
ismear = 1 iq = 117 coord.: 0.08000 0.08000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.1253 gamma= -0.0281 meV omega= 21.1712 meV
lambda( 2 )= -0.0203 gamma= -0.0054 meV omega= 23.0887 meV
lambda( 3 )= -0.5725 gamma= -0.2677 meV omega= 30.5433 meV
lambda( 4 )= 0.2444 gamma= 2.3307 meV omega= 137.9360 meV
lambda( 5 )= 0.2438 gamma= 2.3356 meV omega= 138.2493 meV
lambda( 6 )= 0.7597 gamma= 7.7147 meV omega= 142.3287 meV
lambda( tot )= 0.5298
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 62 out of 1000
ismear = 1 iq = 118 coord.: 0.08500 0.08500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0636 gamma= -0.0163 meV omega= 22.6027 meV
lambda( 2 )= -0.0091 gamma= -0.0027 meV omega= 24.5276 meV
lambda( 3 )= -0.3048 gamma= -0.1609 meV omega= 32.4532 meV
lambda( 4 )= 0.3169 gamma= 3.0512 meV omega= 138.5953 meV
lambda( 5 )= 0.3151 gamma= 3.0487 meV omega= 138.9280 meV
lambda( 6 )= 0.9383 gamma= 9.6750 meV omega= 143.4212 meV
lambda( tot )= 1.1929
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 62 out of 1000
ismear = 1 iq = 119 coord.: 0.09000 0.09000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0093 gamma= -0.0027 meV omega= 24.0496 meV
lambda( 2 )= 0.0009 gamma= 0.0003 meV omega= 25.9655 meV
lambda( 3 )= 0.0683 gamma= 0.0404 meV omega= 34.3648 meV
lambda( 4 )= 0.2880 gamma= 2.8000 meV omega= 139.2633 meV
lambda( 5 )= 0.2854 gamma= 2.7882 meV omega= 139.6124 meV
lambda( 6 )= 0.7894 gamma= 8.2654 meV omega= 144.5226 meV
lambda( tot )= 1.4227
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 62 out of 1000
ismear = 1 iq = 120 coord.: 0.09500 0.09500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0193 gamma= 0.0063 meV omega= 25.5119 meV
lambda( 2 )= 0.0055 gamma= 0.0021 meV omega= 27.4023 meV
lambda( 3 )= 0.3089 gamma= 0.2038 meV omega= 36.2785 meV
lambda( 4 )= 0.1472 gamma= 1.4450 meV omega= 139.9358 meV
lambda( 5 )= 0.1454 gamma= 1.4349 meV omega= 140.2979 meV
lambda( 6 )= 0.3537 gamma= 3.7598 meV omega= 145.6260 meV
lambda( tot )= 0.9800
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 62 out of 1000
ismear = 1 iq = 121 coord.: 0.10000 0.10000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 26.9892 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 28.8375 meV
lambda( 3 )= 0.0002 gamma= 0.0001 meV omega= 38.1945 meV
lambda( 4 )= 0.0157 gamma= 0.1560 meV omega= 140.6087 meV
lambda( 5 )= 0.0158 gamma= 0.1578 meV omega= 140.9799 meV
lambda( 6 )= 0.0000 gamma= 0.0001 meV omega= 146.7249 meV
lambda( tot )= 0.0318
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 122 coord.: 0.10500 0.10500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0350 gamma= -0.0142 meV omega= 28.4809 meV
lambda( 2 )= -0.0079 gamma= -0.0037 meV omega= 30.2710 meV
lambda( 3 )= -0.5061 gamma= -0.4082 meV omega= 40.1130 meV
lambda( 4 )= -0.0032 gamma= -0.0316 meV omega= 141.2782 meV
lambda( 5 )= -0.0027 gamma= -0.0271 meV omega= 141.6540 meV
lambda( 6 )= -0.0405 gamma= -0.4435 meV omega= 147.8134 meV
lambda( tot )= -0.5954
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 123 coord.: 0.11000 0.11000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0105 gamma= -0.0048 meV omega= 29.9865 meV
lambda( 2 )= -0.0021 gamma= -0.0011 meV omega= 31.7022 meV
lambda( 3 )= -0.1508 gamma= -0.1335 meV omega= 42.0341 meV
lambda( 4 )= 0.0051 gamma= 0.0517 meV omega= 141.9403 meV
lambda( 5 )= 0.0052 gamma= 0.0531 meV omega= 142.3163 meV
lambda( 6 )= -0.0032 gamma= -0.0359 meV omega= 148.8856 meV
lambda( tot )= -0.1563
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 124 coord.: 0.11500 0.11500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0074 gamma= -0.0037 meV omega= 31.5050 meV
lambda( 2 )= -0.0006 gamma= -0.0003 meV omega= 33.1308 meV
lambda( 3 )= -0.0980 gamma= -0.0949 meV omega= 43.9578 meV
lambda( 4 )= -0.0079 gamma= -0.0810 meV omega= 142.5914 meV
lambda( 5 )= -0.0077 gamma= -0.0787 meV omega= 142.9626 meV
lambda( 6 )= -0.0025 gamma= -0.0276 meV omega= 149.9364 meV
lambda( tot )= -0.1241
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 125 coord.: 0.12000 0.12000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0141 gamma= -0.0077 meV omega= 33.0352 meV
lambda( 2 )= -0.0010 gamma= -0.0006 meV omega= 34.5563 meV
lambda( 3 )= -0.1993 gamma= -0.2103 meV omega= 45.8840 meV
lambda( 4 )= -0.0194 gamma= -0.1993 meV omega= 143.2281 meV
lambda( 5 )= -0.0189 gamma= -0.1956 meV omega= 143.5892 meV
lambda( 6 )= -0.0039 gamma= -0.0447 meV omega= 150.9610 meV
lambda( tot )= -0.2565
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 126 coord.: 0.12500 0.12500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0195 gamma= -0.0117 meV omega= 34.5761 meV
lambda( 2 )= -0.0015 gamma= -0.0010 meV omega= 35.9781 meV
lambda( 3 )= -0.2971 gamma= -0.3405 meV omega= 47.8126 meV
lambda( 4 )= -0.0214 gamma= -0.2220 meV omega= 143.8471 meV
lambda( 5 )= -0.0209 gamma= -0.2180 meV omega= 144.1927 meV
lambda( 6 )= -0.0039 gamma= -0.0446 meV omega= 151.9549 meV
lambda( tot )= -0.3642
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 58 out of 1000
ismear = 1 iq = 127 coord.: 0.13000 0.13000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0181 gamma= -0.0119 meV omega= 36.1260 meV
lambda( 2 )= -0.0017 gamma= -0.0012 meV omega= 37.3956 meV
lambda( 3 )= -0.3053 gamma= -0.3787 meV omega= 49.7433 meV
lambda( 4 )= -0.0137 gamma= -0.1435 meV omega= 144.4453 meV
lambda( 5 )= -0.0134 gamma= -0.1410 meV omega= 144.7699 meV
lambda( 6 )= -0.0023 gamma= -0.0266 meV omega= 152.9144 meV
lambda( tot )= -0.3546
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 54 out of 1000
ismear = 1 iq = 128 coord.: 0.13500 0.13500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0104 gamma= -0.0074 meV omega= 37.6833 meV
lambda( 2 )= -0.0014 gamma= -0.0011 meV omega= 38.8082 meV
lambda( 3 )= -0.2228 gamma= -0.2983 meV omega= 51.6756 meV
lambda( 4 )= -0.0049 gamma= -0.0522 meV omega= 145.0201 meV
lambda( 5 )= -0.0048 gamma= -0.0512 meV omega= 145.3179 meV
lambda( 6 )= -0.0007 gamma= -0.0087 meV omega= 153.8362 meV
lambda( tot )= -0.2452
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 54 out of 1000
ismear = 1 iq = 129 coord.: 0.14000 0.14000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0036 gamma= -0.0028 meV omega= 39.2464 meV
lambda( 2 )= -0.0007 gamma= -0.0006 meV omega= 40.2152 meV
lambda( 3 )= -0.1464 gamma= -0.2109 meV omega= 53.6090 meV
lambda( 4 )= -0.0012 gamma= -0.0123 meV omega= 145.5689 meV
lambda( 5 )= -0.0011 gamma= -0.0121 meV omega= 145.8342 meV
lambda( 6 )= -0.0001 gamma= -0.0016 meV omega= 154.7174 meV
lambda( tot )= -0.1532
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 54 out of 1000
ismear = 1 iq = 130 coord.: 0.14500 0.14500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0008 gamma= -0.0006 meV omega= 40.8131 meV
lambda( 2 )= -0.0002 gamma= -0.0002 meV omega= 41.6158 meV
lambda( 3 )= -0.0660 gamma= -0.1020 meV omega= 55.5429 meV
lambda( 4 )= -0.0003 gamma= -0.0029 meV omega= 146.0894 meV
lambda( 5 )= -0.0003 gamma= -0.0029 meV omega= 146.3166 meV
lambda( 6 )= -0.0000 gamma= -0.0002 meV omega= 155.5558 meV
lambda( tot )= -0.0675
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 54 out of 1000
ismear = 1 iq = 131 coord.: 0.15000 0.15000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 42.3814 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 43.0092 meV
lambda( 3 )= 0.1165 gamma= 0.1929 meV omega= 57.4766 meV
lambda( 4 )= 0.0004 gamma= 0.0048 meV omega= 146.5796 meV
lambda( 5 )= 0.0004 gamma= 0.0048 meV omega= 146.7630 meV
lambda( 6 )= 0.0000 gamma= 0.0001 meV omega= 156.3493 meV
lambda( tot )= 0.1174
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 54 out of 1000
ismear = 1 iq = 132 coord.: 0.15500 0.15500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0002 meV omega= 43.9491 meV
lambda( 2 )= 0.0002 gamma= 0.0002 meV omega= 44.3946 meV
lambda( 3 )= 0.3993 gamma= 0.7065 meV omega= 59.4090 meV
lambda( 4 )= 0.0018 gamma= 0.0190 meV omega= 147.0378 meV
lambda( 5 )= 0.0018 gamma= 0.0191 meV omega= 147.1721 meV
lambda( 6 )= 0.0000 gamma= 0.0004 meV omega= 157.0969 meV
lambda( tot )= 0.4033
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 45 out of 1000
ismear = 1 iq = 133 coord.: 0.16000 0.16000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0003 meV omega= 45.5138 meV
lambda( 2 )= 0.0003 gamma= 0.0003 meV omega= 45.7712 meV
lambda( 3 )= 0.6657 gamma= 1.2556 meV omega= 61.3393 meV
lambda( 4 )= 0.0076 gamma= 0.0829 meV omega= 147.4625 meV
lambda( 5 )= 0.0076 gamma= 0.0832 meV omega= 147.5425 meV
lambda( 6 )= 0.0001 gamma= 0.0008 meV omega= 157.7975 meV
lambda( tot )= 0.6816
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 45 out of 1000
ismear = 1 iq = 134 coord.: 0.16500 0.16500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0004 meV omega= 47.0731 meV
lambda( 2 )= 0.0003 gamma= 0.0003 meV omega= 47.1379 meV
lambda( 3 )= 0.8340 gamma= 1.6734 meV omega= 63.2662 meV
lambda( 4 )= 0.0201 gamma= 0.2200 meV omega= 147.8526 meV
lambda( 5 )= 0.0201 gamma= 0.2201 meV omega= 147.8733 meV
lambda( 6 )= 0.0001 gamma= 0.0010 meV omega= 158.4507 meV
lambda( tot )= 0.8749
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 45 out of 1000
ismear = 1 iq = 135 coord.: 0.17000 0.17000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0004 meV omega= 48.4940 meV
lambda( 2 )= 0.0003 gamma= 0.0003 meV omega= 48.6244 meV
lambda( 3 )= 0.9032 gamma= 1.9240 meV omega= 65.1887 meV
lambda( 4 )= 0.0076 gamma= 0.0839 meV omega= 148.1641 meV
lambda( 5 )= 0.0076 gamma= 0.0839 meV omega= 148.2071 meV
lambda( 6 )= 0.0001 gamma= 0.0009 meV omega= 159.0566 meV
lambda( tot )= 0.9191
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 45 out of 1000
ismear = 1 iq = 136 coord.: 0.17500 0.17500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0004 meV omega= 49.8385 meV
lambda( 2 )= 0.0003 gamma= 0.0003 meV omega= 50.1653 meV
lambda( 3 )= 0.8955 gamma= 2.0214 meV omega= 67.1054 meV
lambda( 4 )= 0.0018 gamma= 0.0200 meV omega= 148.4146 meV
lambda( 5 )= 0.0018 gamma= 0.0200 meV omega= 148.5253 meV
lambda( 6 )= 0.0001 gamma= 0.0007 meV omega= 159.6156 meV
lambda( tot )= 0.8997
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 41 out of 1000
ismear = 1 iq = 137 coord.: 0.18000 0.18000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0003 gamma= 0.0003 meV omega= 51.1705 meV
lambda( 2 )= 0.0003 gamma= 0.0003 meV omega= 51.6932 meV
lambda( 3 )= 0.8173 gamma= 1.9514 meV omega= 69.0151 meV
lambda( 4 )= 0.0008 gamma= 0.0084 meV omega= 148.6249 meV
lambda( 5 )= 0.0008 gamma= 0.0085 meV omega= 148.8069 meV
lambda( 6 )= 0.0000 gamma= 0.0005 meV omega= 160.1284 meV
lambda( tot )= 0.8194
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 37 out of 1000
ismear = 1 iq = 138 coord.: 0.18500 0.18500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0002 gamma= 0.0003 meV omega= 52.4890 meV
lambda( 2 )= 0.0002 gamma= 0.0003 meV omega= 53.2054 meV
lambda( 3 )= 0.6574 gamma= 1.6572 meV omega= 70.9161 meV
lambda( 4 )= 0.0003 gamma= 0.0030 meV omega= 148.7954 meV
lambda( 5 )= 0.0003 gamma= 0.0030 meV omega= 149.0516 meV
lambda( 6 )= 0.0000 gamma= 0.0002 meV omega= 160.5962 meV
lambda( tot )= 0.6584
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 37 out of 1000
ismear = 1 iq = 139 coord.: 0.19000 0.19000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0002 gamma= 0.0002 meV omega= 53.7932 meV
lambda( 2 )= 0.0002 gamma= 0.0003 meV omega= 54.6993 meV
lambda( 3 )= 0.4179 gamma= 1.1104 meV omega= 72.8072 meV
lambda( 4 )= 0.0001 gamma= 0.0006 meV omega= 148.9267 meV
lambda( 5 )= 0.0001 gamma= 0.0006 meV omega= 149.2594 meV
lambda( 6 )= 0.0000 gamma= 0.0001 meV omega= 161.0204 meV
lambda( tot )= 0.4183
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 37 out of 1000
ismear = 1 iq = 140 coord.: 0.19500 0.19500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0001 gamma= 0.0001 meV omega= 55.0823 meV
lambda( 2 )= 0.0001 gamma= 0.0001 meV omega= 56.1724 meV
lambda( 3 )= 0.1629 gamma= 0.4556 meV omega= 74.6868 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.0200 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4305 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.4027 meV
lambda( tot )= 0.1631
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 37 out of 1000
ismear = 1 iq = 141 coord.: 0.20000 0.20000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 56.3553 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 57.6222 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 76.5533 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 149.0764 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5655 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.7451 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 142 coord.: 0.20500 0.20500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 57.6116 meV
lambda( 2 )= -0.0000 gamma= -0.0001 meV omega= 59.0463 meV
lambda( 3 )= -0.0410 gamma= -0.1262 meV omega= 78.4053 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 149.0974 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.6648 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.0496 meV
lambda( tot )= -0.0410
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 143 coord.: 0.21000 0.21000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 58.8504 meV
lambda( 2 )= -0.0000 gamma= -0.0001 meV omega= 60.4423 meV
lambda( 3 )= -0.0251 gamma= -0.0809 meV omega= 80.2413 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 149.0846 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.7292 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.3186 meV
lambda( tot )= -0.0251
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 144 coord.: 0.21500 0.21500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 60.0710 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 61.8079 meV
lambda( 3 )= -0.0080 gamma= -0.0268 meV omega= 82.0598 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 149.0401 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.7596 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.5544 meV
lambda( tot )= -0.0080
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 145 coord.: 0.22000 0.22000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 61.2729 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 63.1412 meV
lambda( 3 )= -0.0014 gamma= -0.0051 meV omega= 83.8594 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.9657 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.7570 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.7595 meV
lambda( tot )= -0.0014
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 146 coord.: 0.22500 0.22500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 62.4556 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 64.4401 meV
lambda( 3 )= -0.0001 gamma= -0.0005 meV omega= 85.6387 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.8637 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.7226 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.9364 meV
lambda( tot )= -0.0001
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 33 out of 1000
ismear = 1 iq = 147 coord.: 0.23000 0.23000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 63.6187 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 65.7030 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 87.3965 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 148.7365 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 149.6575 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.0876 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 148 coord.: 0.23500 0.23500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 64.7618 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 66.9282 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 89.1315 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.5862 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.5630 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.2155 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 149 coord.: 0.24000 0.24000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 65.8848 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 68.1144 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 90.8427 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.4153 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.4404 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.3224 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 150 coord.: 0.24500 0.24500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 66.9875 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 69.2606 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 92.5292 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.2263 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.2912 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.4106 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 151 coord.: 0.25000 0.25000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 68.0698 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 70.3659 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 94.1901 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 148.0214 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.1166 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.4823 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 29 out of 1000
ismear = 1 iq = 152 coord.: 0.25500 0.25500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 69.1319 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 71.4298 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 95.8248 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.8030 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.9182 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.5394 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 153 coord.: 0.26000 0.26000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 70.1739 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 72.4521 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 97.4328 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.5732 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.6972 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.5836 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 154 coord.: 0.26500 0.26500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 71.1961 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 73.4328 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 99.0136 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.3341 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.4553 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6165 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 155 coord.: 0.27000 0.27000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 72.1988 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 74.3724 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 100.5671 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 147.0876 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.1936 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6395 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 156 coord.: 0.27500 0.27500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 73.1825 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 75.2716 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 102.0933 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 146.8353 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.9138 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6538 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 20 out of 1000
ismear = 1 iq = 157 coord.: 0.28000 0.28000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 74.1476 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 76.1316 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 103.5922 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 146.5787 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.6170 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6601 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 16 out of 1000
ismear = 1 iq = 158 coord.: 0.28500 0.28500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 75.0947 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 76.9539 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 105.0641 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 146.3189 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.3047 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6592 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 16 out of 1000
ismear = 1 iq = 159 coord.: 0.29000 0.29000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 76.0244 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 77.7402 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 106.5093 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 146.0571 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 146.9782 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6515 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 16 out of 1000
ismear = 1 iq = 160 coord.: 0.29500 0.29500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 76.9374 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 78.4928 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 107.9284 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 145.7938 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 146.6387 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6373 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 16 out of 1000
ismear = 1 iq = 161 coord.: 0.30000 0.30000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 77.8342 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 79.2142 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 109.3221 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 145.5296 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 146.2877 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 163.6166 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 162 coord.: 0.30500 0.30500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 78.7155 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 79.9070 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 110.6909 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 145.2647 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 145.9262 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.5892 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 163 coord.: 0.31000 0.31000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 79.5820 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 80.5742 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 112.0358 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 144.9991 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 145.5556 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.5548 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 164 coord.: 0.31500 0.31500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 80.4342 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 81.2191 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 113.3575 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 144.7325 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 145.1770 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.5128 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 165 coord.: 0.32000 0.32000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 81.2728 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 81.8449 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 114.6570 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 144.4648 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 144.7918 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.4625 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 166 coord.: 0.32500 0.32500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 82.0983 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 82.4549 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 115.9352 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 144.1953 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 144.4011 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.4033 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 12 out of 1000
ismear = 1 iq = 167 coord.: 0.33000 0.33000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 82.9110 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 83.0526 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 117.1928 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 143.9236 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 144.0060 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.3342 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 8 out of 1000
ismear = 1 iq = 168 coord.: 0.33500 0.33500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 83.6413 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 83.7113 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 118.4309 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 143.6079 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 143.6489 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.2542 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 8 out of 1000
ismear = 1 iq = 169 coord.: 0.34000 0.34000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 84.2240 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 84.4994 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 119.6503 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 143.2078 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 143.3708 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.1624 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 8 out of 1000
ismear = 1 iq = 170 coord.: 0.34500 0.34500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 84.8036 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 85.2755 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 120.8517 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 142.8070 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 143.0886 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 163.0578 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 8 out of 1000
ismear = 1 iq = 171 coord.: 0.35000 0.35000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= -0.0000 gamma= -0.0000 meV omega= 85.3830 meV
lambda( 2 )= -0.0000 gamma= -0.0000 meV omega= 86.0396 meV
lambda( 3 )= -0.0000 gamma= -0.0000 meV omega= 122.0358 meV
lambda( 4 )= -0.0000 gamma= -0.0000 meV omega= 142.4067 meV
lambda( 5 )= -0.0000 gamma= -0.0000 meV omega= 142.8017 meV
lambda( 6 )= -0.0000 gamma= -0.0000 meV omega= 162.9392 meV
lambda( tot )= -0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 8 out of 1000
ismear = 1 iq = 172 coord.: 0.35500 0.35500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 85.9642 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 86.7916 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 123.2034 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 142.0080 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 142.5098 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.8058 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 173 coord.: 0.36000 0.36000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 86.5494 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 87.5312 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 124.3549 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 141.6122 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 142.2125 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.6565 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 174 coord.: 0.36500 0.36500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 87.1398 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 88.2580 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 125.4909 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 141.2204 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 141.9097 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.4903 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 175 coord.: 0.37000 0.37000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 87.7367 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 88.9716 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 126.6118 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 140.8337 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 141.6014 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.3066 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 176 coord.: 0.37500 0.37500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 88.3403 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 89.6713 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 127.7178 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 140.4535 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 141.2878 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 162.1044 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 177 coord.: 0.38000 0.38000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 88.9508 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 90.3565 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 128.8090 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 140.0807 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 140.9693 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.8833 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 178 coord.: 0.38500 0.38500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 89.5676 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 91.0262 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 129.8857 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 139.7165 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 140.6464 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.6425 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 179 coord.: 0.39000 0.39000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 90.1898 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 91.6797 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 130.9476 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 139.3620 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 140.3201 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.3816 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 180 coord.: 0.39500 0.39500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 90.8159 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 92.3157 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 131.9943 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 139.0185 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.9914 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 161.1004 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 181 coord.: 0.40000 0.40000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 91.4439 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 92.9333 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 133.0253 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 138.6873 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.6617 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.7985 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 182 coord.: 0.40500 0.40500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 92.0716 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 93.5314 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 134.0389 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 138.3700 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.3328 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.4758 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 183 coord.: 0.41000 0.41000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 92.6963 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 94.1086 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.0313 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 138.0698 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.0077 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 160.1323 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 184 coord.: 0.41500 0.41500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 93.3149 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 94.6639 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.9902 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.7952 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 138.6921 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.7679 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 185 coord.: 0.42000 0.42000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 93.9242 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 95.1960 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.8401 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.6019 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 138.4082 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 159.3829 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 186 coord.: 0.42500 0.42500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 94.5209 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 95.7036 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 137.0807 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.7669 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 138.3811 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.9772 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 187 coord.: 0.43000 0.43000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 95.1012 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 96.1856 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.8948 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.6263 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.0944 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.5511 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 188 coord.: 0.43500 0.43500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 95.6615 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 96.6406 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.6773 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.3555 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 139.9797 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 158.1047 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 189 coord.: 0.44000 0.44000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 96.1980 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 97.0676 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.4662 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 137.0776 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 140.8782 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 157.6384 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 190 coord.: 0.44500 0.44500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 96.7072 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 97.4654 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.2681 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 136.8080 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 141.7699 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 157.1524 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 191 coord.: 0.45000 0.45000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 97.1854 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 97.8329 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 136.0851 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 136.5521 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 142.6493 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 156.6468 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 192 coord.: 0.45500 0.45500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 97.6291 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 98.1690 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.9182 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 136.3129 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 143.5144 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 156.1219 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 193 coord.: 0.46000 0.46000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 98.0351 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 98.4728 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.7679 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 136.0929 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 144.3640 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 155.5778 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 194 coord.: 0.46500 0.46500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 98.4003 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 98.7435 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.6346 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.8942 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 145.1974 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 155.0148 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 195 coord.: 0.47000 0.47000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 98.7222 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 98.9800 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.5186 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.7185 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 146.0142 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 154.4329 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 196 coord.: 0.47500 0.47500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 98.9982 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.1818 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.4200 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.5674 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 146.8139 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 153.8323 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 197 coord.: 0.48000 0.48000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 99.2265 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.3480 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.3392 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.4420 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 147.5964 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 153.2130 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 198 coord.: 0.48500 0.48500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 99.4054 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.4780 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.2764 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.3432 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 148.3614 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 152.5751 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 199 coord.: 0.49000 0.49000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 99.5340 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.5713 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.2323 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.2713 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.1088 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 151.9186 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 200 coord.: 0.49500 0.49500 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 99.6121 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.6266 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.2080 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.2258 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 149.8384 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 151.2436 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
ismear = 1 iq = 201 coord.: 0.50000 0.50000 0.00000 wt: 0.00498
-------------------------------------------------------------------
lambda( 1 )= 0.0000 gamma= 0.0000 meV omega= 99.6416 meV
lambda( 2 )= 0.0000 gamma= 0.0000 meV omega= 99.6416 meV
lambda( 3 )= 0.0000 gamma= 0.0000 meV omega= 135.2052 meV
lambda( 4 )= 0.0000 gamma= 0.0000 meV omega= 135.2052 meV
lambda( 5 )= 0.0000 gamma= 0.0000 meV omega= 150.5501 meV
lambda( 6 )= 0.0000 gamma= 0.0000 meV omega= 150.5501 meV
lambda( tot )= 0.0000
-------------------------------------------------------------------
Number of (k,k+q) pairs on the Fermi surface: 0 out of 1000
WARNING: only the eigenstates within the Fermi window are meaningful
ik = 1 coord.: 0.0000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= 0.5022 eV Re[Sigma]= 115.6284 meV Im[Sigma]= 958.5853 meV Z= -0.5549
E( 3 )= 0.5022 eV Re[Sigma]= 114.8312 meV Im[Sigma]= 962.9592 meV Z= -0.5512
E( 4 )= 0.5022 eV Re[Sigma]= 121.5905 meV Im[Sigma]= 1013.5831 meV Z= -0.5096
-------------------------------------------------------------------
ik = 2 coord.: 0.0000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= -332.1636 meV Im[Sigma]= 574.5723 meV Z= 2.3240
E( 3 )= 0.0484 eV Re[Sigma]= 61.4936 meV Im[Sigma]= 393.7061 meV Z= 0.4112
E( 4 )= 0.0484 eV Re[Sigma]= 146.4098 meV Im[Sigma]= 306.0686 meV Z= 0.4977
-------------------------------------------------------------------
ik = 3 coord.: 0.0000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -96.4453 meV Im[Sigma]= 61.5335 meV Z= 1.0478
E( 3 )= -0.8733 eV Re[Sigma]= 126.8321 meV Im[Sigma]= 515.0163 meV Z= 1.1345
E( 4 )= -0.8733 eV Re[Sigma]= 87.1940 meV Im[Sigma]= 403.0414 meV Z= 1.4317
-------------------------------------------------------------------
ik = 4 coord.: 0.0000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 5 coord.: 0.0000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 6 coord.: 0.0000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -13.2527 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 7 coord.: 0.0000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 8 coord.: 0.0000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 9 coord.: 0.0000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= 20.5971 meV Im[Sigma]= 22.9282 meV Z= 0.9135
E( 3 )= -0.8733 eV Re[Sigma]= 306.5124 meV Im[Sigma]= 415.2530 meV Z= -1.2634
E( 4 )= -0.8733 eV Re[Sigma]= 312.1110 meV Im[Sigma]= 445.6329 meV Z= -0.9680
-------------------------------------------------------------------
ik = 10 coord.: 0.0000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= 104.8766 meV Im[Sigma]= 167.2245 meV Z= 0.8344
E( 3 )= 0.0484 eV Re[Sigma]= 134.0402 meV Im[Sigma]= 262.4509 meV Z= 0.5530
E( 4 )= 0.0484 eV Re[Sigma]= 113.9586 meV Im[Sigma]= 296.7346 meV Z= 0.5344
-------------------------------------------------------------------
ik = 11 coord.: 0.0000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= -157.3659 meV Im[Sigma]= 448.3870 meV Z= 1.5583
E( 3 )= 0.0484 eV Re[Sigma]= 169.2591 meV Im[Sigma]= 252.0615 meV Z= 0.5471
E( 4 )= 0.0484 eV Re[Sigma]= 216.1312 meV Im[Sigma]= 250.1309 meV Z= 0.5567
-------------------------------------------------------------------
ik = 12 coord.: 0.0000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= -78.9447 meV Im[Sigma]= 479.9703 meV Z= 0.9539
E( 3 )= -0.7001 eV Re[Sigma]= 123.9356 meV Im[Sigma]= 368.6591 meV Z= 0.8639
E( 4 )= -0.3525 eV Re[Sigma]= 150.4031 meV Im[Sigma]= 562.5120 meV Z= 2.4723
-------------------------------------------------------------------
ik = 13 coord.: 0.0000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -162.6276 meV Im[Sigma]= 174.3382 meV Z= 1.1434
E( 3 )= -1.7571 eV Re[Sigma]= 87.0548 meV Im[Sigma]= 325.2536 meV Z= -7.1285
E( 4 )= -0.8310 eV Re[Sigma]= 323.6144 meV Im[Sigma]= 481.4112 meV Z= 2.4200
-------------------------------------------------------------------
ik = 14 coord.: 0.0000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 15 coord.: 0.0000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 16 coord.: 0.0000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 17 coord.: 0.0000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 18 coord.: 0.0000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 19 coord.: 0.0000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 5.4215 meV Im[Sigma]= 14.5701 meV Z= 0.9325
E( 3 )= -2.9409 eV Re[Sigma]= -9.5908 meV Im[Sigma]= 55.5729 meV Z= 1.0431
E( 4 )= -0.7940 eV Re[Sigma]= 160.7387 meV Im[Sigma]= 63.8108 meV Z= 0.7773
-------------------------------------------------------------------
ik = 20 coord.: 0.0000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 61.2576 meV Im[Sigma]= 94.6416 meV Z= 0.7869
E( 3 )= -1.8137 eV Re[Sigma]= -57.7942 meV Im[Sigma]= 102.2894 meV Z= 1.2341
E( 4 )= -0.0473 eV Re[Sigma]= 287.3146 meV Im[Sigma]= 100.6058 meV Z= 0.6701
-------------------------------------------------------------------
ik = 21 coord.: 0.0000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -43.2238 meV Im[Sigma]= 33.2675 meV Z= 1.0035
E( 3 )= -0.8733 eV Re[Sigma]= 162.5182 meV Im[Sigma]= 332.6274 meV Z= 1.2578
E( 4 )= -0.8733 eV Re[Sigma]= 176.4401 meV Im[Sigma]= 301.8351 meV Z= 1.1264
-------------------------------------------------------------------
ik = 22 coord.: 0.0000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -86.8276 meV Im[Sigma]= 128.3707 meV Z= 1.0510
E( 3 )= -1.7571 eV Re[Sigma]= 112.5924 meV Im[Sigma]= 317.3338 meV Z= -4.9008
E( 4 )= -0.8310 eV Re[Sigma]= 219.2442 meV Im[Sigma]= 558.2044 meV Z= -0.8666
-------------------------------------------------------------------
ik = 23 coord.: 0.0000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 24 coord.: 0.0000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 25 coord.: 0.0000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 26 coord.: 0.0000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 27 coord.: 0.0000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 28 coord.: 0.0000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 29 coord.: 0.0000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 30 coord.: 0.0000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -37.8486 meV Im[Sigma]= 30.6942 meV Z= 0.9932
E( 3 )= -2.9409 eV Re[Sigma]= 48.3393 meV Im[Sigma]= 21.9859 meV Z= 0.9036
E( 4 )= -0.7940 eV Re[Sigma]= 211.8355 meV Im[Sigma]= 111.7515 meV Z= 0.7639
-------------------------------------------------------------------
ik = 31 coord.: 0.0000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 32 coord.: 0.0000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 33 coord.: 0.0000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 34 coord.: 0.0000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 35 coord.: 0.0000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 36 coord.: 0.0000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 37 coord.: 0.0000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 38 coord.: 0.0000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 39 coord.: 0.0000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 40 coord.: 0.0000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 41 coord.: 0.0000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 42 coord.: 0.0000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 43 coord.: 0.0000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 44 coord.: 0.0000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 45 coord.: 0.0000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 46 coord.: 0.0000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 47 coord.: 0.0000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 48 coord.: 0.0000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 49 coord.: 0.0000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 50 coord.: 0.0000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 51 coord.: 0.0000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -13.2527 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 52 coord.: 0.0000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 53 coord.: 0.0000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 54 coord.: 0.0000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 55 coord.: 0.0000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 56 coord.: 0.0000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.2894 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 57 coord.: 0.0000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 58 coord.: 0.0000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 59 coord.: 0.0000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 60 coord.: 0.0000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 61 coord.: 0.0000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 62 coord.: 0.0000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 63 coord.: 0.0000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 64 coord.: 0.0000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 65 coord.: 0.0000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 66 coord.: 0.0000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 67 coord.: 0.0000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 68 coord.: 0.0000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 69 coord.: 0.0000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 70 coord.: 0.0000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 71 coord.: 0.0000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 72 coord.: 0.0000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 73 coord.: 0.0000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 74 coord.: 0.0000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 75 coord.: 0.0000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 76 coord.: 0.0000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 77 coord.: 0.0000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 78 coord.: 0.0000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 79 coord.: 0.0000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 80 coord.: 0.0000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 81 coord.: 0.0000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -33.5017 meV Im[Sigma]= 51.7163 meV Z= 0.9468
E( 3 )= -0.8733 eV Re[Sigma]= 220.9548 meV Im[Sigma]= 533.6383 meV Z= -1.0798
E( 4 )= -0.8733 eV Re[Sigma]= 264.3083 meV Im[Sigma]= 601.6252 meV Z= -1.0444
-------------------------------------------------------------------
ik = 82 coord.: 0.0000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -60.0205 meV Im[Sigma]= 46.2595 meV Z= 0.9613
E( 3 )= -2.9409 eV Re[Sigma]= -110.9133 meV Im[Sigma]= 136.8587 meV Z= 1.1425
E( 4 )= -0.7940 eV Re[Sigma]= 462.7277 meV Im[Sigma]= 407.4459 meV Z= 121.7052
-------------------------------------------------------------------
ik = 83 coord.: 0.0000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 84 coord.: 0.0000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 85 coord.: 0.0000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 86 coord.: 0.0000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 87 coord.: 0.0000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 88 coord.: 0.0000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 89 coord.: 0.0000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 90 coord.: 0.0000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -36.8889 meV Im[Sigma]= 92.6394 meV Z= 0.9603
E( 3 )= -1.7571 eV Re[Sigma]= -33.6867 meV Im[Sigma]= 68.9667 meV Z= 0.7219
E( 4 )= -0.8310 eV Re[Sigma]= 386.8143 meV Im[Sigma]= 273.5483 meV Z= 1.1187
-------------------------------------------------------------------
ik = 91 coord.: 0.0000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= -71.4606 meV Im[Sigma]= 296.3527 meV Z= 1.0085
E( 3 )= 0.0484 eV Re[Sigma]= 45.2655 meV Im[Sigma]= 350.0907 meV Z= 0.4779
E( 4 )= 0.0484 eV Re[Sigma]= 24.5816 meV Im[Sigma]= 407.6748 meV Z= 0.4249
-------------------------------------------------------------------
ik = 92 coord.: 0.0000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= -89.5870 meV Im[Sigma]= 147.5797 meV Z= 0.8334
E( 3 )= -1.8137 eV Re[Sigma]= -129.6869 meV Im[Sigma]= 191.1565 meV Z= 1.2606
E( 4 )= -0.0473 eV Re[Sigma]= 404.0160 meV Im[Sigma]= 228.3294 meV Z= 0.6315
-------------------------------------------------------------------
ik = 93 coord.: 0.0000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -102.3970 meV Im[Sigma]= 60.6087 meV Z= 1.0341
E( 3 )= -2.9409 eV Re[Sigma]= -54.9387 meV Im[Sigma]= 106.3769 meV Z= 0.9667
E( 4 )= -0.7940 eV Re[Sigma]= 513.8068 meV Im[Sigma]= 469.0876 meV Z= -42.6637
-------------------------------------------------------------------
ik = 94 coord.: 0.0000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 95 coord.: 0.0000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 96 coord.: 0.0000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 97 coord.: 0.0000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 98 coord.: 0.0000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 99 coord.: 0.0000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 39.0309 meV Im[Sigma]= 46.4428 meV Z= 0.8953
E( 3 )= -1.7571 eV Re[Sigma]= -4.5665 meV Im[Sigma]= 63.3006 meV Z= 0.7605
E( 4 )= -0.8310 eV Re[Sigma]= 278.4989 meV Im[Sigma]= 365.7440 meV Z= -1.2316
-------------------------------------------------------------------
ik = 100 coord.: 0.0000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= 100.9054 meV Im[Sigma]= 340.1368 meV Z= 1.0907
E( 3 )= -0.7001 eV Re[Sigma]= 80.9982 meV Im[Sigma]= 386.5183 meV Z= 1.4928
E( 4 )= -0.3525 eV Re[Sigma]= 226.9523 meV Im[Sigma]= 163.8683 meV Z= 0.9090
-------------------------------------------------------------------
ik = 101 coord.: 0.1000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= 32.9313 meV Im[Sigma]= 155.7649 meV Z= 0.9513
E( 3 )= 0.0484 eV Re[Sigma]= 255.6098 meV Im[Sigma]= 178.6924 meV Z= 0.6568
E( 4 )= 0.0484 eV Re[Sigma]= 264.7455 meV Im[Sigma]= 174.4713 meV Z= 0.6738
-------------------------------------------------------------------
ik = 102 coord.: 0.1000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= 83.3103 meV Im[Sigma]= 385.2338 meV Z= 1.4848
E( 3 )= -0.7001 eV Re[Sigma]= 99.0612 meV Im[Sigma]= 341.7839 meV Z= 1.0985
E( 4 )= -0.3525 eV Re[Sigma]= 227.8076 meV Im[Sigma]= 163.5466 meV Z= 0.9081
-------------------------------------------------------------------
ik = 103 coord.: 0.1000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -85.8040 meV Im[Sigma]= 114.9670 meV Z= 1.2774
E( 3 )= -1.7571 eV Re[Sigma]= -13.4442 meV Im[Sigma]= 65.6480 meV Z= 0.7610
E( 4 )= -0.8310 eV Re[Sigma]= 331.7370 meV Im[Sigma]= 269.3794 meV Z= 1.4671
-------------------------------------------------------------------
ik = 104 coord.: 0.1000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 105 coord.: 0.1000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 106 coord.: 0.1000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 107 coord.: 0.1000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 108 coord.: 0.1000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 109 coord.: 0.1000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 12.4948 meV Im[Sigma]= 24.9613 meV Z= 0.9118
E( 3 )= -2.9409 eV Re[Sigma]= 31.8545 meV Im[Sigma]= 15.4800 meV Z= 0.9203
E( 4 )= -0.7940 eV Re[Sigma]= 165.3054 meV Im[Sigma]= 60.8491 meV Z= 0.7564
-------------------------------------------------------------------
ik = 110 coord.: 0.1000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 91.8556 meV Im[Sigma]= 99.2892 meV Z= 0.9268
E( 3 )= -1.8137 eV Re[Sigma]= -64.8280 meV Im[Sigma]= 29.2829 meV Z= 0.8298
E( 4 )= -0.0473 eV Re[Sigma]= 254.3553 meV Im[Sigma]= 80.4409 meV Z= 0.6877
-------------------------------------------------------------------
ik = 111 coord.: 0.1000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= 136.8745 meV Im[Sigma]= 345.3614 meV Z= 2.9868
E( 3 )= -0.7001 eV Re[Sigma]= 148.3940 meV Im[Sigma]= 300.9896 meV Z= 1.7367
E( 4 )= -0.3525 eV Re[Sigma]= 198.3739 meV Im[Sigma]= 35.8909 meV Z= 0.7997
-------------------------------------------------------------------
ik = 112 coord.: 0.1000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= 105.2197 meV Im[Sigma]= 167.1582 meV Z= 0.8342
E( 3 )= 0.0484 eV Re[Sigma]= 118.7073 meV Im[Sigma]= 289.4709 meV Z= 0.5350
E( 4 )= 0.0484 eV Re[Sigma]= 129.6392 meV Im[Sigma]= 271.1813 meV Z= 0.5553
-------------------------------------------------------------------
ik = 113 coord.: 0.1000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 27.0171 meV Im[Sigma]= 80.0082 meV Z= 0.7381
E( 3 )= -1.8137 eV Re[Sigma]= -89.0921 meV Im[Sigma]= 152.6742 meV Z= 1.3840
E( 4 )= -0.0473 eV Re[Sigma]= 386.8483 meV Im[Sigma]= 144.0036 meV Z= 0.6297
-------------------------------------------------------------------
ik = 114 coord.: 0.1000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -73.1200 meV Im[Sigma]= 50.2723 meV Z= 1.0555
E( 3 )= -2.9409 eV Re[Sigma]= 33.1900 meV Im[Sigma]= 23.0312 meV Z= 0.9057
E( 4 )= -0.7940 eV Re[Sigma]= 340.1305 meV Im[Sigma]= 456.6938 meV Z= -1.0822
-------------------------------------------------------------------
ik = 115 coord.: 0.1000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 116 coord.: 0.1000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 117 coord.: 0.1000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 118 coord.: 0.1000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 119 coord.: 0.1000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 120 coord.: 0.1000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 37.4262 meV Im[Sigma]= 32.4919 meV Z= 0.8989
E( 3 )= -1.7571 eV Re[Sigma]= -3.6113 meV Im[Sigma]= 38.0769 meV Z= 0.8081
E( 4 )= -0.8310 eV Re[Sigma]= 150.4499 meV Im[Sigma]= 46.1768 meV Z= 0.7781
-------------------------------------------------------------------
ik = 121 coord.: 0.1000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -12.4255 meV Im[Sigma]= 56.4395 meV Z= 1.1642
E( 3 )= -1.7571 eV Re[Sigma]= 9.3702 meV Im[Sigma]= 29.6955 meV Z= 0.8467
E( 4 )= -0.8310 eV Re[Sigma]= 97.9899 meV Im[Sigma]= 31.5740 meV Z= 0.8455
-------------------------------------------------------------------
ik = 122 coord.: 0.1000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 61.4988 meV Im[Sigma]= 94.3317 meV Z= 0.7870
E( 3 )= -1.8137 eV Re[Sigma]= -57.5213 meV Im[Sigma]= 102.2554 meV Z= 1.2328
E( 4 )= -0.0473 eV Re[Sigma]= 287.6552 meV Im[Sigma]= 100.8682 meV Z= 0.6703
-------------------------------------------------------------------
ik = 123 coord.: 0.1000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 29.3021 meV Im[Sigma]= 44.4351 meV Z= 0.8792
E( 3 )= -1.7571 eV Re[Sigma]= -133.8792 meV Im[Sigma]= 138.8025 meV Z= 0.8356
E( 4 )= -0.8310 eV Re[Sigma]= 430.3165 meV Im[Sigma]= 899.5943 meV Z= -0.3389
-------------------------------------------------------------------
ik = 124 coord.: 0.1000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 125 coord.: 0.1000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 126 coord.: 0.1000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 127 coord.: 0.1000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 128 coord.: 0.1000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 129 coord.: 0.1000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 130 coord.: 0.1000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 131 coord.: 0.1000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 132 coord.: 0.1000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -38.1406 meV Im[Sigma]= 30.6019 meV Z= 0.9935
E( 3 )= -2.9409 eV Re[Sigma]= 48.4277 meV Im[Sigma]= 21.9712 meV Z= 0.9034
E( 4 )= -0.7940 eV Re[Sigma]= 212.0678 meV Im[Sigma]= 111.9042 meV Z= 0.7640
-------------------------------------------------------------------
ik = 133 coord.: 0.1000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 134 coord.: 0.1000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 135 coord.: 0.1000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 136 coord.: 0.1000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 137 coord.: 0.1000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 138 coord.: 0.1000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 139 coord.: 0.1000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 140 coord.: 0.1000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 141 coord.: 0.1000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 142 coord.: 0.1000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 143 coord.: 0.1000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 144 coord.: 0.1000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 145 coord.: 0.1000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 146 coord.: 0.1000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 147 coord.: 0.1000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 148 coord.: 0.1000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 149 coord.: 0.1000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 150 coord.: 0.1000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 151 coord.: 0.1000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 152 coord.: 0.1000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 153 coord.: 0.1000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 154 coord.: 0.1000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 155 coord.: 0.1000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 156 coord.: 0.1000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 157 coord.: 0.1000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 158 coord.: 0.1000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 159 coord.: 0.1000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 160 coord.: 0.1000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 161 coord.: 0.1000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 162 coord.: 0.1000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 163 coord.: 0.1000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 164 coord.: 0.1000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 165 coord.: 0.1000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 166 coord.: 0.1000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 167 coord.: 0.1000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 168 coord.: 0.1000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 169 coord.: 0.1000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 170 coord.: 0.1000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 171 coord.: 0.1000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 172 coord.: 0.1000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 173 coord.: 0.1000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 174 coord.: 0.1000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 175 coord.: 0.1000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 176 coord.: 0.1000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 177 coord.: 0.1000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 178 coord.: 0.1000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 179 coord.: 0.1000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 180 coord.: 0.1000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 181 coord.: 0.1000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -22.5919 meV Im[Sigma]= 46.0447 meV Z= 0.9592
E( 3 )= -2.9409 eV Re[Sigma]= 12.5492 meV Im[Sigma]= 15.0328 meV Z= 0.9291
E( 4 )= -0.7940 eV Re[Sigma]= 302.1514 meV Im[Sigma]= 390.5480 meV Z= -1.1558
-------------------------------------------------------------------
ik = 182 coord.: 0.1000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 183 coord.: 0.1000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 184 coord.: 0.1000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 185 coord.: 0.1000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 186 coord.: 0.1000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 187 coord.: 0.1000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 188 coord.: 0.1000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 189 coord.: 0.1000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 190 coord.: 0.1000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 191 coord.: 0.1000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 57.5510 meV Im[Sigma]= 85.2432 meV Z= 0.8628
E( 3 )= -1.8137 eV Re[Sigma]= -99.1527 meV Im[Sigma]= 82.5394 meV Z= 0.9100
E( 4 )= -0.0473 eV Re[Sigma]= 352.6157 meV Im[Sigma]= 120.3307 meV Z= 0.6341
-------------------------------------------------------------------
ik = 192 coord.: 0.1000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -37.2736 meV Im[Sigma]= 92.7639 meV Z= 0.9598
E( 3 )= -1.7571 eV Re[Sigma]= -33.5057 meV Im[Sigma]= 68.9768 meV Z= 0.7218
E( 4 )= -0.8310 eV Re[Sigma]= 386.9812 meV Im[Sigma]= 273.8172 meV Z= 1.1217
-------------------------------------------------------------------
ik = 193 coord.: 0.1000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 194 coord.: 0.1000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 195 coord.: 0.1000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 196 coord.: 0.1000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 197 coord.: 0.1000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 198 coord.: 0.1000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 199 coord.: 0.1000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 200 coord.: 0.1000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 11.4680 meV Im[Sigma]= 27.5260 meV Z= 0.9208
E( 3 )= -1.7571 eV Re[Sigma]= 21.9785 meV Im[Sigma]= 66.3010 meV Z= 0.7711
E( 4 )= -0.8310 eV Re[Sigma]= 262.1694 meV Im[Sigma]= 359.6206 meV Z= -1.1860
-------------------------------------------------------------------
ik = 201 coord.: 0.2000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -0.7528 meV Im[Sigma]= 9.2662 meV Z= 0.9456
E( 3 )= -0.8733 eV Re[Sigma]= 248.6402 meV Im[Sigma]= 113.4106 meV Z= 0.6746
E( 4 )= -0.8733 eV Re[Sigma]= 251.2655 meV Im[Sigma]= 113.6465 meV Z= 0.6799
-------------------------------------------------------------------
ik = 202 coord.: 0.2000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 11.3035 meV Im[Sigma]= 27.4751 meV Z= 0.9211
E( 3 )= -1.7571 eV Re[Sigma]= 22.7595 meV Im[Sigma]= 66.7844 meV Z= 0.7725
E( 4 )= -0.8310 eV Re[Sigma]= 262.4403 meV Im[Sigma]= 358.8049 meV Z= -1.1890
-------------------------------------------------------------------
ik = 203 coord.: 0.2000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 204 coord.: 0.2000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 205 coord.: 0.2000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 206 coord.: 0.2000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 207 coord.: 0.2000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 208 coord.: 0.2000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 209 coord.: 0.2000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 210 coord.: 0.2000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -7.2716 meV Im[Sigma]= 10.7551 meV Z= 0.9400
E( 3 )= -2.9409 eV Re[Sigma]= 62.7664 meV Im[Sigma]= 34.6564 meV Z= 0.8975
E( 4 )= -0.7940 eV Re[Sigma]= 144.2386 meV Im[Sigma]= 49.4997 meV Z= 0.7926
-------------------------------------------------------------------
ik = 211 coord.: 0.2000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 12.9255 meV Im[Sigma]= 14.2720 meV Z= 0.9222
E( 3 )= -1.7571 eV Re[Sigma]= 19.0187 meV Im[Sigma]= 39.9192 meV Z= 0.8156
E( 4 )= -0.8310 eV Re[Sigma]= 133.6814 meV Im[Sigma]= 43.1693 meV Z= 0.8076
-------------------------------------------------------------------
ik = 212 coord.: 0.2000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 92.4106 meV Im[Sigma]= 99.2678 meV Z= 0.9267
E( 3 )= -1.8137 eV Re[Sigma]= -64.6864 meV Im[Sigma]= 29.3376 meV Z= 0.8296
E( 4 )= -0.0473 eV Re[Sigma]= 254.1958 meV Im[Sigma]= 80.3215 meV Z= 0.6875
-------------------------------------------------------------------
ik = 213 coord.: 0.2000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 39.4189 meV Im[Sigma]= 46.5726 meV Z= 0.8951
E( 3 )= -1.7571 eV Re[Sigma]= -4.3444 meV Im[Sigma]= 63.5390 meV Z= 0.7612
E( 4 )= -0.8310 eV Re[Sigma]= 279.6481 meV Im[Sigma]= 364.8137 meV Z= -1.2379
-------------------------------------------------------------------
ik = 214 coord.: 0.2000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 215 coord.: 0.2000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 216 coord.: 0.2000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 217 coord.: 0.2000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 218 coord.: 0.2000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 219 coord.: 0.2000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 220 coord.: 0.2000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 221 coord.: 0.2000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 222 coord.: 0.2000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 37.6810 meV Im[Sigma]= 32.5889 meV Z= 0.8986
E( 3 )= -1.7571 eV Re[Sigma]= -3.8591 meV Im[Sigma]= 37.9686 meV Z= 0.8082
E( 4 )= -0.8310 eV Re[Sigma]= 150.5549 meV Im[Sigma]= 46.2272 meV Z= 0.7779
-------------------------------------------------------------------
ik = 223 coord.: 0.2000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= 20.8021 meV Im[Sigma]= 22.9929 meV Z= 0.9133
E( 3 )= -0.8733 eV Re[Sigma]= 306.7660 meV Im[Sigma]= 423.0274 meV Z= -1.1841
E( 4 )= -0.8733 eV Re[Sigma]= 311.7672 meV Im[Sigma]= 439.6107 meV Z= -1.0069
-------------------------------------------------------------------
ik = 224 coord.: 0.2000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 5.0816 meV Im[Sigma]= 12.8855 meV Z= 0.9386
E( 3 )= -2.9409 eV Re[Sigma]= -61.0362 meV Im[Sigma]= 66.5337 meV Z= 1.1259
E( 4 )= -0.7940 eV Re[Sigma]= 198.9574 meV Im[Sigma]= 78.8616 meV Z= 0.7538
-------------------------------------------------------------------
ik = 225 coord.: 0.2000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 226 coord.: 0.2000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 227 coord.: 0.2000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 228 coord.: 0.2000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 229 coord.: 0.2000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 230 coord.: 0.2000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 231 coord.: 0.2000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 232 coord.: 0.2000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 233 coord.: 0.2000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 5.4836 meV Im[Sigma]= 14.6144 meV Z= 0.9323
E( 3 )= -2.9409 eV Re[Sigma]= -10.0774 meV Im[Sigma]= 55.3670 meV Z= 1.0438
E( 4 )= -0.7940 eV Re[Sigma]= 161.3242 meV Im[Sigma]= 64.2527 meV Z= 0.7777
-------------------------------------------------------------------
ik = 234 coord.: 0.2000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 235 coord.: 0.2000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 236 coord.: 0.2000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 237 coord.: 0.2000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 238 coord.: 0.2000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 239 coord.: 0.2000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 240 coord.: 0.2000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 241 coord.: 0.2000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 242 coord.: 0.2000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 243 coord.: 0.2000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 244 coord.: 0.2000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 245 coord.: 0.2000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 246 coord.: 0.2000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 247 coord.: 0.2000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 248 coord.: 0.2000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 249 coord.: 0.2000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 250 coord.: 0.2000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 251 coord.: 0.2000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 252 coord.: 0.2000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 253 coord.: 0.2000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 254 coord.: 0.2000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 255 coord.: 0.2000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 256 coord.: 0.2000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 257 coord.: 0.2000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 258 coord.: 0.2000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 259 coord.: 0.2000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 260 coord.: 0.2000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 261 coord.: 0.2000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 262 coord.: 0.2000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 263 coord.: 0.2000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 264 coord.: 0.2000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 265 coord.: 0.2000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 266 coord.: 0.2000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 267 coord.: 0.2000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 268 coord.: 0.2000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 269 coord.: 0.2000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 270 coord.: 0.2000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 271 coord.: 0.2000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 272 coord.: 0.2000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 273 coord.: 0.2000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 274 coord.: 0.2000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 275 coord.: 0.2000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 276 coord.: 0.2000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 277 coord.: 0.2000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 278 coord.: 0.2000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 279 coord.: 0.2000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 280 coord.: 0.2000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 281 coord.: 0.2000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 282 coord.: 0.2000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 283 coord.: 0.2000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 284 coord.: 0.2000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 285 coord.: 0.2000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 286 coord.: 0.2000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 287 coord.: 0.2000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 288 coord.: 0.2000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 289 coord.: 0.2000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 290 coord.: 0.2000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 291 coord.: 0.2000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -9.0676 meV Im[Sigma]= 8.4789 meV Z= 0.9486
E( 3 )= -2.9409 eV Re[Sigma]= 14.9665 meV Im[Sigma]= 47.5776 meV Z= 0.9575
E( 4 )= -0.7940 eV Re[Sigma]= 184.2163 meV Im[Sigma]= 65.1284 meV Z= 0.7663
-------------------------------------------------------------------
ik = 292 coord.: 0.2000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 293 coord.: 0.2000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 294 coord.: 0.2000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 295 coord.: 0.2000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 296 coord.: 0.2000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 297 coord.: 0.2000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 298 coord.: 0.2000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 299 coord.: 0.2000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 300 coord.: 0.2000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 301 coord.: 0.3000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 302 coord.: 0.3000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 303 coord.: 0.3000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 304 coord.: 0.3000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 305 coord.: 0.3000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 306 coord.: 0.3000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 307 coord.: 0.3000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 308 coord.: 0.3000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 309 coord.: 0.3000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 310 coord.: 0.3000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 311 coord.: 0.3000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 312 coord.: 0.3000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -7.4325 meV Im[Sigma]= 10.7028 meV Z= 0.9401
E( 3 )= -2.9409 eV Re[Sigma]= 63.2457 meV Im[Sigma]= 34.9076 meV Z= 0.8974
E( 4 )= -0.7940 eV Re[Sigma]= 144.1225 meV Im[Sigma]= 49.3895 meV Z= 0.7924
-------------------------------------------------------------------
ik = 313 coord.: 0.3000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 314 coord.: 0.3000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 315 coord.: 0.3000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 316 coord.: 0.3000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 317 coord.: 0.3000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 318 coord.: 0.3000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 319 coord.: 0.3000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 320 coord.: 0.3000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 321 coord.: 0.3000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 322 coord.: 0.3000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 323 coord.: 0.3000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 12.6620 meV Im[Sigma]= 25.0832 meV Z= 0.9115
E( 3 )= -2.9409 eV Re[Sigma]= 31.5136 meV Im[Sigma]= 15.3370 meV Z= 0.9206
E( 4 )= -0.7940 eV Re[Sigma]= 165.3304 meV Im[Sigma]= 60.7615 meV Z= 0.7563
-------------------------------------------------------------------
ik = 324 coord.: 0.3000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 325 coord.: 0.3000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 326 coord.: 0.3000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 327 coord.: 0.3000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 328 coord.: 0.3000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 329 coord.: 0.3000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 330 coord.: 0.3000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 331 coord.: 0.3000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 332 coord.: 0.3000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 333 coord.: 0.3000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 334 coord.: 0.3000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 335 coord.: 0.3000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 336 coord.: 0.3000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 337 coord.: 0.3000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 338 coord.: 0.3000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 339 coord.: 0.3000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 340 coord.: 0.3000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 341 coord.: 0.3000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 342 coord.: 0.3000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 343 coord.: 0.3000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 344 coord.: 0.3000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 345 coord.: 0.3000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 346 coord.: 0.3000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 347 coord.: 0.3000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 348 coord.: 0.3000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 349 coord.: 0.3000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 350 coord.: 0.3000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 351 coord.: 0.3000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 352 coord.: 0.3000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 353 coord.: 0.3000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 354 coord.: 0.3000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 355 coord.: 0.3000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 356 coord.: 0.3000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 357 coord.: 0.3000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 358 coord.: 0.3000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 359 coord.: 0.3000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 360 coord.: 0.3000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 361 coord.: 0.3000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 362 coord.: 0.3000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 363 coord.: 0.3000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 364 coord.: 0.3000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 365 coord.: 0.3000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 366 coord.: 0.3000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 367 coord.: 0.3000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 368 coord.: 0.3000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 369 coord.: 0.3000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 370 coord.: 0.3000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 371 coord.: 0.3000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 372 coord.: 0.3000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 373 coord.: 0.3000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 374 coord.: 0.3000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 375 coord.: 0.3000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 376 coord.: 0.3000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 377 coord.: 0.3000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 378 coord.: 0.3000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 379 coord.: 0.3000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 380 coord.: 0.3000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 381 coord.: 0.3000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 382 coord.: 0.3000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 383 coord.: 0.3000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 384 coord.: 0.3000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 385 coord.: 0.3000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 386 coord.: 0.3000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 387 coord.: 0.3000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 388 coord.: 0.3000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 389 coord.: 0.3000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 390 coord.: 0.3000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 391 coord.: 0.3000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 392 coord.: 0.3000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 393 coord.: 0.3000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 394 coord.: 0.3000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 395 coord.: 0.3000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 396 coord.: 0.3000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 397 coord.: 0.3000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 398 coord.: 0.3000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 399 coord.: 0.3000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 400 coord.: 0.3000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 401 coord.: 0.4000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 402 coord.: 0.4000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 403 coord.: 0.4000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 404 coord.: 0.4000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 405 coord.: 0.4000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 406 coord.: 0.4000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 407 coord.: 0.4000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 408 coord.: 0.4000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 409 coord.: 0.4000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 410 coord.: 0.4000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 411 coord.: 0.4000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 412 coord.: 0.4000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 413 coord.: 0.4000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 414 coord.: 0.4000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 415 coord.: 0.4000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 416 coord.: 0.4000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 417 coord.: 0.4000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 418 coord.: 0.4000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 419 coord.: 0.4000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 420 coord.: 0.4000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 421 coord.: 0.4000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 422 coord.: 0.4000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 423 coord.: 0.4000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 424 coord.: 0.4000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 425 coord.: 0.4000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 426 coord.: 0.4000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 427 coord.: 0.4000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 428 coord.: 0.4000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 429 coord.: 0.4000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 430 coord.: 0.4000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 431 coord.: 0.4000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 432 coord.: 0.4000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 433 coord.: 0.4000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 434 coord.: 0.4000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 435 coord.: 0.4000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 436 coord.: 0.4000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 437 coord.: 0.4000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 438 coord.: 0.4000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 439 coord.: 0.4000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 440 coord.: 0.4000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 441 coord.: 0.4000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 442 coord.: 0.4000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 443 coord.: 0.4000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 444 coord.: 0.4000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 445 coord.: 0.4000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 446 coord.: 0.4000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 447 coord.: 0.4000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 448 coord.: 0.4000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 449 coord.: 0.4000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 450 coord.: 0.4000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 451 coord.: 0.4000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 452 coord.: 0.4000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 453 coord.: 0.4000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 454 coord.: 0.4000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 455 coord.: 0.4000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 456 coord.: 0.4000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 457 coord.: 0.4000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 458 coord.: 0.4000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 459 coord.: 0.4000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 460 coord.: 0.4000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 461 coord.: 0.4000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 462 coord.: 0.4000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 463 coord.: 0.4000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 464 coord.: 0.4000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 465 coord.: 0.4000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 466 coord.: 0.4000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 467 coord.: 0.4000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 468 coord.: 0.4000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 469 coord.: 0.4000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 470 coord.: 0.4000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 471 coord.: 0.4000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 472 coord.: 0.4000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 473 coord.: 0.4000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 474 coord.: 0.4000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 475 coord.: 0.4000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 476 coord.: 0.4000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 477 coord.: 0.4000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 478 coord.: 0.4000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 479 coord.: 0.4000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 480 coord.: 0.4000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 481 coord.: 0.4000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 482 coord.: 0.4000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 483 coord.: 0.4000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 484 coord.: 0.4000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 485 coord.: 0.4000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 486 coord.: 0.4000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 487 coord.: 0.4000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 488 coord.: 0.4000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 489 coord.: 0.4000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 490 coord.: 0.4000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 491 coord.: 0.4000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 492 coord.: 0.4000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 493 coord.: 0.4000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 494 coord.: 0.4000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 495 coord.: 0.4000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 496 coord.: 0.4000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 497 coord.: 0.4000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 498 coord.: 0.4000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 499 coord.: 0.4000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 500 coord.: 0.4000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 501 coord.: 0.5000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -13.2527 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 502 coord.: 0.5000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 503 coord.: 0.5000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 504 coord.: 0.5000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 505 coord.: 0.5000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 506 coord.: 0.5000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.2894 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 507 coord.: 0.5000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 508 coord.: 0.5000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 509 coord.: 0.5000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 510 coord.: 0.5000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 511 coord.: 0.5000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 512 coord.: 0.5000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 513 coord.: 0.5000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 514 coord.: 0.5000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 515 coord.: 0.5000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 516 coord.: 0.5000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 517 coord.: 0.5000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 518 coord.: 0.5000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 519 coord.: 0.5000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 520 coord.: 0.5000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 521 coord.: 0.5000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 522 coord.: 0.5000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 523 coord.: 0.5000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 524 coord.: 0.5000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 525 coord.: 0.5000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 526 coord.: 0.5000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 527 coord.: 0.5000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 528 coord.: 0.5000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 529 coord.: 0.5000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 530 coord.: 0.5000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 531 coord.: 0.5000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 532 coord.: 0.5000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 533 coord.: 0.5000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 534 coord.: 0.5000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 535 coord.: 0.5000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 536 coord.: 0.5000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 537 coord.: 0.5000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 538 coord.: 0.5000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 539 coord.: 0.5000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 540 coord.: 0.5000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 541 coord.: 0.5000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 542 coord.: 0.5000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 543 coord.: 0.5000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 544 coord.: 0.5000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 545 coord.: 0.5000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 546 coord.: 0.5000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 547 coord.: 0.5000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 548 coord.: 0.5000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 549 coord.: 0.5000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 550 coord.: 0.5000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 551 coord.: 0.5000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -12.2894 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 552 coord.: 0.5000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 553 coord.: 0.5000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 554 coord.: 0.5000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 555 coord.: 0.5000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 556 coord.: 0.5000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -13.2527 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3883 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 557 coord.: 0.5000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 558 coord.: 0.5000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 559 coord.: 0.5000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 560 coord.: 0.5000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 561 coord.: 0.5000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 562 coord.: 0.5000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 563 coord.: 0.5000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 564 coord.: 0.5000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 565 coord.: 0.5000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 566 coord.: 0.5000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 567 coord.: 0.5000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 568 coord.: 0.5000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 569 coord.: 0.5000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 570 coord.: 0.5000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 571 coord.: 0.5000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 572 coord.: 0.5000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 573 coord.: 0.5000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 574 coord.: 0.5000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 575 coord.: 0.5000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 576 coord.: 0.5000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 577 coord.: 0.5000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 578 coord.: 0.5000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 579 coord.: 0.5000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 580 coord.: 0.5000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 581 coord.: 0.5000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 582 coord.: 0.5000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 583 coord.: 0.5000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 584 coord.: 0.5000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 585 coord.: 0.5000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 586 coord.: 0.5000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 587 coord.: 0.5000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 588 coord.: 0.5000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 589 coord.: 0.5000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 590 coord.: 0.5000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 591 coord.: 0.5000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 592 coord.: 0.5000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 593 coord.: 0.5000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 594 coord.: 0.5000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 595 coord.: 0.5000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 596 coord.: 0.5000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 597 coord.: 0.5000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 598 coord.: 0.5000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 599 coord.: 0.5000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 600 coord.: 0.5000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 601 coord.: 0.6000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 602 coord.: 0.6000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 603 coord.: 0.6000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 604 coord.: 0.6000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 605 coord.: 0.6000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 606 coord.: 0.6000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 607 coord.: 0.6000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 608 coord.: 0.6000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 609 coord.: 0.6000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 610 coord.: 0.6000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 611 coord.: 0.6000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 612 coord.: 0.6000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 613 coord.: 0.6000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 614 coord.: 0.6000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 615 coord.: 0.6000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 616 coord.: 0.6000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 617 coord.: 0.6000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 618 coord.: 0.6000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 619 coord.: 0.6000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 620 coord.: 0.6000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 621 coord.: 0.6000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 622 coord.: 0.6000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 623 coord.: 0.6000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 624 coord.: 0.6000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 625 coord.: 0.6000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 626 coord.: 0.6000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 627 coord.: 0.6000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 628 coord.: 0.6000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 629 coord.: 0.6000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 630 coord.: 0.6000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 631 coord.: 0.6000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 632 coord.: 0.6000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 633 coord.: 0.6000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 634 coord.: 0.6000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 635 coord.: 0.6000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 636 coord.: 0.6000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 637 coord.: 0.6000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 638 coord.: 0.6000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 639 coord.: 0.6000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 640 coord.: 0.6000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 641 coord.: 0.6000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 642 coord.: 0.6000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 643 coord.: 0.6000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 644 coord.: 0.6000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 645 coord.: 0.6000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 646 coord.: 0.6000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 647 coord.: 0.6000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 648 coord.: 0.6000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 649 coord.: 0.6000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 650 coord.: 0.6000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 651 coord.: 0.6000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 652 coord.: 0.6000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 653 coord.: 0.6000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 654 coord.: 0.6000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 655 coord.: 0.6000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 656 coord.: 0.6000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 657 coord.: 0.6000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 658 coord.: 0.6000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 659 coord.: 0.6000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 660 coord.: 0.6000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 661 coord.: 0.6000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.9092 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.6406 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 662 coord.: 0.6000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 663 coord.: 0.6000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 664 coord.: 0.6000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 665 coord.: 0.6000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 666 coord.: 0.6000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 667 coord.: 0.6000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -11.1125 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.2084 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 668 coord.: 0.6000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 669 coord.: 0.6000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 670 coord.: 0.6000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 671 coord.: 0.6000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 672 coord.: 0.6000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 673 coord.: 0.6000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 674 coord.: 0.6000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 675 coord.: 0.6000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 676 coord.: 0.6000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 677 coord.: 0.6000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 678 coord.: 0.6000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 679 coord.: 0.6000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 680 coord.: 0.6000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 681 coord.: 0.6000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 682 coord.: 0.6000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 683 coord.: 0.6000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 684 coord.: 0.6000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 685 coord.: 0.6000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 686 coord.: 0.6000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 687 coord.: 0.6000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 688 coord.: 0.6000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 689 coord.: 0.6000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 690 coord.: 0.6000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 691 coord.: 0.6000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 692 coord.: 0.6000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 693 coord.: 0.6000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 694 coord.: 0.6000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 695 coord.: 0.6000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 696 coord.: 0.6000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 697 coord.: 0.6000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 698 coord.: 0.6000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 699 coord.: 0.6000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 700 coord.: 0.6000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 701 coord.: 0.7000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 702 coord.: 0.7000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 703 coord.: 0.7000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 704 coord.: 0.7000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 705 coord.: 0.7000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 706 coord.: 0.7000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 707 coord.: 0.7000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 708 coord.: 0.7000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 709 coord.: 0.7000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 710 coord.: 0.7000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 711 coord.: 0.7000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 712 coord.: 0.7000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 713 coord.: 0.7000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 714 coord.: 0.7000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 715 coord.: 0.7000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 716 coord.: 0.7000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 717 coord.: 0.7000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 718 coord.: 0.7000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 719 coord.: 0.7000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 720 coord.: 0.7000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 721 coord.: 0.7000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 722 coord.: 0.7000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 723 coord.: 0.7000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 724 coord.: 0.7000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 725 coord.: 0.7000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 726 coord.: 0.7000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 727 coord.: 0.7000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 728 coord.: 0.7000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 729 coord.: 0.7000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 730 coord.: 0.7000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 731 coord.: 0.7000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 732 coord.: 0.7000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 733 coord.: 0.7000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 734 coord.: 0.7000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 735 coord.: 0.7000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 736 coord.: 0.7000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 737 coord.: 0.7000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 738 coord.: 0.7000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 739 coord.: 0.7000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 740 coord.: 0.7000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 741 coord.: 0.7000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 742 coord.: 0.7000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 743 coord.: 0.7000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 744 coord.: 0.7000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 745 coord.: 0.7000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 746 coord.: 0.7000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 747 coord.: 0.7000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 748 coord.: 0.7000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 749 coord.: 0.7000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 750 coord.: 0.7000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 751 coord.: 0.7000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 752 coord.: 0.7000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 753 coord.: 0.7000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 754 coord.: 0.7000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 755 coord.: 0.7000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 756 coord.: 0.7000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 757 coord.: 0.7000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 758 coord.: 0.7000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 759 coord.: 0.7000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 760 coord.: 0.7000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 761 coord.: 0.7000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 762 coord.: 0.7000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 763 coord.: 0.7000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 764 coord.: 0.7000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 765 coord.: 0.7000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 766 coord.: 0.7000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 767 coord.: 0.7000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 768 coord.: 0.7000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 769 coord.: 0.7000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 770 coord.: 0.7000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 771 coord.: 0.7000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.4148 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5794 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 772 coord.: 0.7000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 773 coord.: 0.7000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 774 coord.: 0.7000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3361 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.3949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.5744 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 775 coord.: 0.7000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.6388 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6612 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 776 coord.: 0.7000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 777 coord.: 0.7000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 778 coord.: 0.7000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.8985 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.6849 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 779 coord.: 0.7000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 780 coord.: 0.7000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 781 coord.: 0.7000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 782 coord.: 0.7000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 783 coord.: 0.7000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 784 coord.: 0.7000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 785 coord.: 0.7000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 786 coord.: 0.7000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 787 coord.: 0.7000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 788 coord.: 0.7000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 789 coord.: 0.7000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -130.1916 meV Im[Sigma]= 72.2476 meV Z= 1.0512
E( 3 )= -2.9409 eV Re[Sigma]= -136.1779 meV Im[Sigma]= 117.0755 meV Z= 0.9864
E( 4 )= -0.7940 eV Re[Sigma]= 672.9761 meV Im[Sigma]= 835.4303 meV Z= -0.6349
-------------------------------------------------------------------
ik = 790 coord.: 0.7000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 791 coord.: 0.7000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 792 coord.: 0.7000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 793 coord.: 0.7000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 794 coord.: 0.7000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 795 coord.: 0.7000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 796 coord.: 0.7000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 797 coord.: 0.7000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 798 coord.: 0.7000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 799 coord.: 0.7000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 800 coord.: 0.7000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -160.0144 meV Im[Sigma]= 60.2921 meV Z= 1.0013
E( 3 )= -2.9409 eV Re[Sigma]= -248.0161 meV Im[Sigma]= 175.2389 meV Z= 1.0992
E( 4 )= -0.7940 eV Re[Sigma]= 296.3348 meV Im[Sigma]= 943.5066 meV Z= -0.9317
-------------------------------------------------------------------
ik = 801 coord.: 0.8000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -122.8513 meV Im[Sigma]= 71.2349 meV Z= 1.0475
E( 3 )= -0.8733 eV Re[Sigma]= -196.4883 meV Im[Sigma]= 653.4203 meV Z= 1.6475
E( 4 )= -0.8733 eV Re[Sigma]= -162.8225 meV Im[Sigma]= 705.7767 meV Z= 1.3696
-------------------------------------------------------------------
ik = 802 coord.: 0.8000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -160.0690 meV Im[Sigma]= 60.3427 meV Z= 1.0011
E( 3 )= -2.9409 eV Re[Sigma]= -247.3671 meV Im[Sigma]= 174.9679 meV Z= 1.0995
E( 4 )= -0.7940 eV Re[Sigma]= 295.9680 meV Im[Sigma]= 944.2256 meV Z= -0.9290
-------------------------------------------------------------------
ik = 803 coord.: 0.8000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 804 coord.: 0.8000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 805 coord.: 0.8000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 806 coord.: 0.8000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 807 coord.: 0.8000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 808 coord.: 0.8000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 809 coord.: 0.8000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 810 coord.: 0.8000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -162.2804 meV Im[Sigma]= 133.5217 meV Z= 1.0347
E( 3 )= -1.7571 eV Re[Sigma]= -247.0102 meV Im[Sigma]= 212.3400 meV Z= 0.7811
E( 4 )= -0.8310 eV Re[Sigma]= 274.9257 meV Im[Sigma]= 912.0918 meV Z= -0.8189
-------------------------------------------------------------------
ik = 811 coord.: 0.8000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -129.7075 meV Im[Sigma]= 49.6200 meV Z= 1.0235
E( 3 )= -2.9409 eV Re[Sigma]= -163.3926 meV Im[Sigma]= 93.3332 meV Z= 1.0198
E( 4 )= -0.7940 eV Re[Sigma]= 123.6631 meV Im[Sigma]= 927.8526 meV Z= -0.5097
-------------------------------------------------------------------
ik = 812 coord.: 0.8000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 813 coord.: 0.8000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 814 coord.: 0.8000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 815 coord.: 0.8000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 816 coord.: 0.8000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 817 coord.: 0.8000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 818 coord.: 0.8000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 819 coord.: 0.8000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 820 coord.: 0.8000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 821 coord.: 0.8000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 822 coord.: 0.8000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 823 coord.: 0.8000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 824 coord.: 0.8000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 825 coord.: 0.8000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 826 coord.: 0.8000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 827 coord.: 0.8000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 828 coord.: 0.8000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 829 coord.: 0.8000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 830 coord.: 0.8000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 831 coord.: 0.8000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 832 coord.: 0.8000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 833 coord.: 0.8000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 834 coord.: 0.8000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2421 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 835 coord.: 0.8000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 836 coord.: 0.8000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 837 coord.: 0.8000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 838 coord.: 0.8000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 839 coord.: 0.8000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 840 coord.: 0.8000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 841 coord.: 0.8000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 842 coord.: 0.8000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 843 coord.: 0.8000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 844 coord.: 0.8000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 845 coord.: 0.8000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.6283 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.6447 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.3807 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 846 coord.: 0.8000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 847 coord.: 0.8000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 848 coord.: 0.8000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 849 coord.: 0.8000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 850 coord.: 0.8000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 851 coord.: 0.8000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9965 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 852 coord.: 0.8000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 853 coord.: 0.8000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 854 coord.: 0.8000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.9978 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -7.9689 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 855 coord.: 0.8000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 856 coord.: 0.8000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.7430 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2422 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0578 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 857 coord.: 0.8000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 858 coord.: 0.8000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 859 coord.: 0.8000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 860 coord.: 0.8000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 861 coord.: 0.8000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 862 coord.: 0.8000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 863 coord.: 0.8000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 864 coord.: 0.8000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.9391 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.4123 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7687 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 865 coord.: 0.8000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -9.5832 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1157 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1490 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 866 coord.: 0.8000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 867 coord.: 0.8000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 868 coord.: 0.8000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 869 coord.: 0.8000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 870 coord.: 0.8000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 871 coord.: 0.8000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 872 coord.: 0.8000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 873 coord.: 0.8000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 874 coord.: 0.8000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 875 coord.: 0.8000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 876 coord.: 0.8000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 877 coord.: 0.8000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 878 coord.: 0.8000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 879 coord.: 0.8000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -102.7232 meV Im[Sigma]= 60.6587 meV Z= 1.0338
E( 3 )= -2.9409 eV Re[Sigma]= -54.3670 meV Im[Sigma]= 106.0938 meV Z= 0.9675
E( 4 )= -0.7940 eV Re[Sigma]= 513.6706 meV Im[Sigma]= 470.0478 meV Z= -36.2124
-------------------------------------------------------------------
ik = 880 coord.: 0.8000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 881 coord.: 0.8000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.8784 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4309 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 882 coord.: 0.8000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 883 coord.: 0.8000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.3917 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.2631 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.0636 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 884 coord.: 0.8000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -11.2257 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.2826 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9964 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 885 coord.: 0.8000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.9420 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.9563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.4780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 886 coord.: 0.8000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -9.2949 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.2324 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.5881 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 887 coord.: 0.8000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -6.4864 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6999 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.5259 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 888 coord.: 0.8000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -73.3864 meV Im[Sigma]= 50.3113 meV Z= 1.0553
E( 3 )= -2.9409 eV Re[Sigma]= 33.1963 meV Im[Sigma]= 23.0831 meV Z= 0.9056
E( 4 )= -0.7940 eV Re[Sigma]= 340.8032 meV Im[Sigma]= 455.7621 meV Z= -1.0872
-------------------------------------------------------------------
ik = 889 coord.: 0.8000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.4704 eV Re[Sigma]= -96.7618 meV Im[Sigma]= 61.5956 meV Z= 1.0475
E( 3 )= -0.8733 eV Re[Sigma]= 109.9573 meV Im[Sigma]= 439.0329 meV Z= 1.2436
E( 4 )= -0.8733 eV Re[Sigma]= 105.1471 meV Im[Sigma]= 479.9741 meV Z= 1.2968
-------------------------------------------------------------------
ik = 890 coord.: 0.8000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -192.8986 meV Im[Sigma]= 160.7972 meV Z= 1.1341
E( 3 )= -1.7571 eV Re[Sigma]= -50.6575 meV Im[Sigma]= 413.3082 meV Z= -2.7613
E( 4 )= -0.8310 eV Re[Sigma]= -52.7629 meV Im[Sigma]= 535.1483 meV Z= 1.5796
-------------------------------------------------------------------
ik = 891 coord.: 0.8000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -195.7220 meV Im[Sigma]= 120.2278 meV Z= 1.0219
E( 3 )= -1.7571 eV Re[Sigma]= -381.9827 meV Im[Sigma]= 298.2199 meV Z= 0.9400
E( 4 )= -0.8310 eV Re[Sigma]= -98.0590 meV Im[Sigma]= 979.1868 meV Z= -0.8901
-------------------------------------------------------------------
ik = 892 coord.: 0.8000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 893 coord.: 0.8000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 894 coord.: 0.8000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 895 coord.: 0.8000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 896 coord.: 0.8000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 897 coord.: 0.8000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 898 coord.: 0.8000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 899 coord.: 0.8000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -163.0040 meV Im[Sigma]= 174.3734 meV Z= 1.1429
E( 3 )= -1.7571 eV Re[Sigma]= 87.0037 meV Im[Sigma]= 325.9980 meV Z= -7.0172
E( 4 )= -0.8310 eV Re[Sigma]= 323.3431 meV Im[Sigma]= 480.9673 meV Z= 2.3906
-------------------------------------------------------------------
ik = 900 coord.: 0.8000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= -280.2396 meV Im[Sigma]= 179.2354 meV Z= 0.9913
E( 3 )= -1.8137 eV Re[Sigma]= -220.1251 meV Im[Sigma]= 267.9068 meV Z= 0.9553
E( 4 )= -0.0473 eV Re[Sigma]= 371.6300 meV Im[Sigma]= 422.2938 meV Z= 0.4542
-------------------------------------------------------------------
ik = 901 coord.: 0.9000000 0.0000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= -283.2435 meV Im[Sigma]= 355.5728 meV Z= 1.5031
E( 3 )= 0.0484 eV Re[Sigma]= -257.9405 meV Im[Sigma]= 413.1817 meV Z= 0.3431
E( 4 )= 0.0484 eV Re[Sigma]= -270.3042 meV Im[Sigma]= 457.8358 meV Z= 0.3239
-------------------------------------------------------------------
ik = 902 coord.: 0.9000000 0.0000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= -279.8585 meV Im[Sigma]= 179.1986 meV Z= 0.9919
E( 3 )= -1.8137 eV Re[Sigma]= -219.7899 meV Im[Sigma]= 268.0239 meV Z= 0.9553
E( 4 )= -0.0473 eV Re[Sigma]= 371.6750 meV Im[Sigma]= 422.8139 meV Z= 0.4549
-------------------------------------------------------------------
ik = 903 coord.: 0.9000000 0.0000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -129.7420 meV Im[Sigma]= 72.1327 meV Z= 1.0515
E( 3 )= -2.9409 eV Re[Sigma]= -136.4886 meV Im[Sigma]= 117.1842 meV Z= 0.9860
E( 4 )= -0.7940 eV Re[Sigma]= 672.5191 meV Im[Sigma]= 836.4740 meV Z= -0.6324
-------------------------------------------------------------------
ik = 904 coord.: 0.9000000 0.0000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 905 coord.: 0.9000000 0.0000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 906 coord.: 0.9000000 0.0000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 907 coord.: 0.9000000 0.0000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 908 coord.: 0.9000000 0.0000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 909 coord.: 0.9000000 0.0000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= 29.0506 meV Im[Sigma]= 44.4752 meV Z= 0.8794
E( 3 )= -1.7571 eV Re[Sigma]= -133.3852 meV Im[Sigma]= 139.3890 meV Z= 0.8372
E( 4 )= -0.8310 eV Re[Sigma]= 429.6515 meV Im[Sigma]= 899.6311 meV Z= -0.3387
-------------------------------------------------------------------
ik = 910 coord.: 0.9000000 0.0000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= 117.5860 meV Im[Sigma]= 372.7742 meV Z= 0.8730
E( 3 )= -0.7001 eV Re[Sigma]= -72.0828 meV Im[Sigma]= 477.2443 meV Z= 0.9475
E( 4 )= -0.3525 eV Re[Sigma]= 149.4077 meV Im[Sigma]= 562.3972 meV Z= 2.4807
-------------------------------------------------------------------
ik = 911 coord.: 0.9000000 0.1000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= -161.1465 meV Im[Sigma]= 112.0682 meV Z= 0.8626
E( 3 )= -1.8137 eV Re[Sigma]= -180.5958 meV Im[Sigma]= 230.9651 meV Z= 1.0402
E( 4 )= -0.0473 eV Re[Sigma]= 346.7553 meV Im[Sigma]= 336.1979 meV Z= 0.4489
-------------------------------------------------------------------
ik = 912 coord.: 0.9000000 0.1000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -162.4304 meV Im[Sigma]= 133.6354 meV Z= 1.0343
E( 3 )= -1.7571 eV Re[Sigma]= -247.0807 meV Im[Sigma]= 211.8992 meV Z= 0.7800
E( 4 )= -0.8310 eV Re[Sigma]= 274.9592 meV Im[Sigma]= 912.7533 meV Z= -0.8167
-------------------------------------------------------------------
ik = 913 coord.: 0.9000000 0.1000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 914 coord.: 0.9000000 0.1000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 915 coord.: 0.9000000 0.1000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 916 coord.: 0.9000000 0.1000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 917 coord.: 0.9000000 0.1000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 918 coord.: 0.9000000 0.1000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 919 coord.: 0.9000000 0.1000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 920 coord.: 0.9000000 0.1000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -86.5827 meV Im[Sigma]= 128.5476 meV Z= 1.0505
E( 3 )= -1.7571 eV Re[Sigma]= 112.3261 meV Im[Sigma]= 317.5090 meV Z= -4.8842
E( 4 )= -0.8310 eV Re[Sigma]= 219.2818 meV Im[Sigma]= 558.3435 meV Z= -0.8659
-------------------------------------------------------------------
ik = 921 coord.: 0.9000000 0.2000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -67.1226 meV Im[Sigma]= 40.0252 meV Z= 1.0197
E( 3 )= -2.9409 eV Re[Sigma]= -80.3813 meV Im[Sigma]= 45.2257 meV Z= 0.9835
E( 4 )= -0.7940 eV Re[Sigma]= 405.0552 meV Im[Sigma]= 499.8075 meV Z= -4.0201
-------------------------------------------------------------------
ik = 922 coord.: 0.9000000 0.2000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 923 coord.: 0.9000000 0.2000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 924 coord.: 0.9000000 0.2000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 925 coord.: 0.9000000 0.2000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 926 coord.: 0.9000000 0.2000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 927 coord.: 0.9000000 0.2000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 928 coord.: 0.9000000 0.2000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 929 coord.: 0.9000000 0.2000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 930 coord.: 0.9000000 0.2000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 931 coord.: 0.9000000 0.3000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 932 coord.: 0.9000000 0.3000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 933 coord.: 0.9000000 0.3000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 934 coord.: 0.9000000 0.3000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 935 coord.: 0.9000000 0.3000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 936 coord.: 0.9000000 0.3000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 937 coord.: 0.9000000 0.3000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 938 coord.: 0.9000000 0.3000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 939 coord.: 0.9000000 0.3000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 940 coord.: 0.9000000 0.3000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 941 coord.: 0.9000000 0.4000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 942 coord.: 0.9000000 0.4000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 943 coord.: 0.9000000 0.4000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 944 coord.: 0.9000000 0.4000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 945 coord.: 0.9000000 0.4000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 946 coord.: 0.9000000 0.4000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 947 coord.: 0.9000000 0.4000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 948 coord.: 0.9000000 0.4000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 949 coord.: 0.9000000 0.4000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 950 coord.: 0.9000000 0.4000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 951 coord.: 0.9000000 0.5000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 952 coord.: 0.9000000 0.5000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 953 coord.: 0.9000000 0.5000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 954 coord.: 0.9000000 0.5000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 955 coord.: 0.9000000 0.5000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.0171 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7418 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.7250 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 956 coord.: 0.9000000 0.5000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.5450 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.7778 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.7653 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 957 coord.: 0.9000000 0.5000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 958 coord.: 0.9000000 0.5000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 959 coord.: 0.9000000 0.5000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 960 coord.: 0.9000000 0.5000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 961 coord.: 0.9000000 0.6000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 962 coord.: 0.9000000 0.6000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 963 coord.: 0.9000000 0.6000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 964 coord.: 0.9000000 0.6000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.7448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -9.2055 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 965 coord.: 0.9000000 0.6000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -10.4909 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -8.1780 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.1298 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 966 coord.: 0.9000000 0.6000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9464 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.4902 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -6.0200 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 967 coord.: 0.9000000 0.6000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4893 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.6545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0520 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 968 coord.: 0.9000000 0.6000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 969 coord.: 0.9000000 0.6000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 970 coord.: 0.9000000 0.6000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 971 coord.: 0.9000000 0.7000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 972 coord.: 0.9000000 0.7000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 973 coord.: 0.9000000 0.7000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -8.1683 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.2384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.3865 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 974 coord.: 0.9000000 0.7000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.5834 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -7.4561 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.4256 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 975 coord.: 0.9000000 0.7000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -11.3603 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.9545 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -5.0293 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 976 coord.: 0.9000000 0.7000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -8.9585 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -6.3245 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -4.8614 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 977 coord.: 0.9000000 0.7000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -6.5233 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -5.4731 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.9507 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 978 coord.: 0.9000000 0.7000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.3471 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.6836 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.1382 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 979 coord.: 0.9000000 0.7000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 980 coord.: 0.9000000 0.7000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= -59.7741 meV Im[Sigma]= 46.1616 meV Z= 0.9616
E( 3 )= -2.9409 eV Re[Sigma]= -111.0837 meV Im[Sigma]= 136.8033 meV Z= 1.1422
E( 4 )= -0.7940 eV Re[Sigma]= 462.7719 meV Im[Sigma]= 407.6892 meV Z= 140.0957
-------------------------------------------------------------------
ik = 981 coord.: 0.9000000 0.8000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -76.5361 meV Im[Sigma]= 78.0331 meV Z= 0.9317
E( 3 )= -1.7571 eV Re[Sigma]= -295.9218 meV Im[Sigma]= 231.1696 meV Z= 0.9545
E( 4 )= -0.8310 eV Re[Sigma]= 163.3670 meV Im[Sigma]= 873.9792 meV Z= -0.8643
-------------------------------------------------------------------
ik = 982 coord.: 0.9000000 0.8000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 983 coord.: 0.9000000 0.8000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 984 coord.: 0.9000000 0.8000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 985 coord.: 0.9000000 0.8000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.5386 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.8843 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.6685 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 986 coord.: 0.9000000 0.8000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -10.4930 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.9136 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -3.2644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 987 coord.: 0.9000000 0.8000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -7.4404 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -4.6952 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.3448 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 988 coord.: 0.9000000 0.8000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -4.5350 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.8458 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.4186 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 989 coord.: 0.9000000 0.8000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -85.8946 meV Im[Sigma]= 114.9753 meV Z= 1.2772
E( 3 )= -1.7571 eV Re[Sigma]= -13.8826 meV Im[Sigma]= 65.4654 meV Z= 0.7604
E( 4 )= -0.8310 eV Re[Sigma]= 331.5402 meV Im[Sigma]= 269.0503 meV Z= 1.4610
-------------------------------------------------------------------
ik = 990 coord.: 0.9000000 0.8000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= -89.7368 meV Im[Sigma]= 147.5422 meV Z= 0.8332
E( 3 )= -1.8137 eV Re[Sigma]= -129.7791 meV Im[Sigma]= 190.6016 meV Z= 1.2585
E( 4 )= -0.0473 eV Re[Sigma]= 404.0647 meV Im[Sigma]= 228.7313 meV Z= 0.6325
-------------------------------------------------------------------
ik = 991 coord.: 0.9000000 0.9000000 0.0000000
-------------------------------------------------------------------
E( 2 )= -0.7001 eV Re[Sigma]= -58.3224 meV Im[Sigma]= 452.9933 meV Z= 1.1762
E( 3 )= -0.7001 eV Re[Sigma]= -246.5560 meV Im[Sigma]= 557.8044 meV Z= 1.3259
E( 4 )= -0.3525 eV Re[Sigma]= 6.3218 meV Im[Sigma]= 731.2221 meV Z= 22.3447
-------------------------------------------------------------------
ik = 992 coord.: 0.9000000 0.9000000 0.1000000
-------------------------------------------------------------------
E( 2 )= -3.3027 eV Re[Sigma]= -192.6578 meV Im[Sigma]= 160.6529 meV Z= 1.1345
E( 3 )= -1.7571 eV Re[Sigma]= -50.8545 meV Im[Sigma]= 413.4142 meV Z= -2.7627
E( 4 )= -0.8310 eV Re[Sigma]= -52.5515 meV Im[Sigma]= 535.0622 meV Z= 1.5813
-------------------------------------------------------------------
ik = 993 coord.: 0.9000000 0.9000000 0.2000000
-------------------------------------------------------------------
E( 2 )= -6.6317 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.5276 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7219 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 994 coord.: 0.9000000 0.9000000 0.3000000
-------------------------------------------------------------------
E( 2 )= -9.8891 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -2.9076 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.6305 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 995 coord.: 0.9000000 0.9000000 0.4000000
-------------------------------------------------------------------
E( 2 )= -12.6353 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.2588 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.8872 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 996 coord.: 0.9000000 0.9000000 0.5000000
-------------------------------------------------------------------
E( 2 )= -11.8384 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.5563 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -2.4721 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 997 coord.: 0.9000000 0.9000000 0.6000000
-------------------------------------------------------------------
E( 2 )= -8.8146 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 3 )= -3.4644 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
E( 4 )= -1.7202 eV Re[Sigma]= 0.0000 meV Im[Sigma]= 0.0000 meV Z= 1.0000
-------------------------------------------------------------------
ik = 998 coord.: 0.9000000 0.9000000 0.7000000
-------------------------------------------------------------------
E( 2 )= -5.5016 eV Re[Sigma]= 4.9683 meV Im[Sigma]= 12.8445 meV Z= 0.9388
E( 3 )= -2.9409 eV Re[Sigma]= -60.9627 meV Im[Sigma]= 66.4379 meV Z= 1.1264
E( 4 )= -0.7940 eV Re[Sigma]= 199.7581 meV Im[Sigma]= 79.6489 meV Z= 0.7548
-------------------------------------------------------------------
ik = 999 coord.: 0.9000000 0.9000000 0.8000000
-------------------------------------------------------------------
E( 2 )= -2.4322 eV Re[Sigma]= 26.8082 meV Im[Sigma]= 80.0459 meV Z= 0.7382
E( 3 )= -1.8137 eV Re[Sigma]= -89.1223 meV Im[Sigma]= 152.5684 meV Z= 1.3843
E( 4 )= -0.0473 eV Re[Sigma]= 387.0365 meV Im[Sigma]= 144.1521 meV Z= 0.6299
-------------------------------------------------------------------
ik = 1000 coord.: 0.9000000 0.9000000 0.9000000
-------------------------------------------------------------------
E( 2 )= -1.1021 eV Re[Sigma]= -332.2394 meV Im[Sigma]= 574.4801 meV Z= 2.3230
E( 3 )= 0.0484 eV Re[Sigma]= 82.4023 meV Im[Sigma]= 357.8973 meV Z= 0.4439
E( 4 )= 0.0484 eV Re[Sigma]= 126.0844 meV Im[Sigma]= 342.9643 meV Z= 0.4582
-------------------------------------------------------------------
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846 4 -6.1298 0.0000 0.0000 0.5000
847 4 -6.1490 0.0000 0.0000 0.5000
848 4 -4.4256 0.0000 0.0000 0.5000
849 4 -3.4780 0.0000 0.0000 0.5000
850 4 -3.6685 0.0000 0.0000 0.5000
851 4 -3.9965 0.0000 0.0000 0.5000
852 4 -5.0293 0.0000 0.0000 0.5000
853 4 -6.7687 0.0000 0.0000 0.5000
854 4 -7.9689 0.0000 0.0000 0.5000
855 4 -6.1298 0.0000 0.0000 0.5000
856 4 -5.0578 0.0000 0.0000 0.5000
857 4 -4.8614 0.0000 0.0000 0.5000
858 4 -3.3865 0.0000 0.0000 0.5000
859 4 -2.5881 0.0000 0.0000 0.5000
860 4 -3.2644 0.0000 0.0000 0.5000
861 4 -4.0636 0.0000 0.0000 0.5000
862 4 -4.8614 0.0000 0.0000 0.5000
863 4 -6.1490 0.0000 0.0000 0.5000
864 4 -6.7687 0.0000 0.0000 0.5000
865 4 -6.1490 0.0000 0.0000 0.5000
866 4 -4.8614 0.0000 0.0000 0.5000
867 4 -4.0636 0.0000 0.0000 0.5000
868 4 -2.3448 0.0000 0.0000 0.5000
869 4 -1.5259 0.0000 0.0000 0.5000
870 4 -2.3448 0.0000 0.0000 0.5000
871 4 -3.1382 0.0000 0.0000 0.5000
872 4 -3.9507 0.0000 0.0000 0.5000
873 4 -4.8614 0.0000 0.0000 0.5000
874 4 -5.0293 0.0000 0.0000 0.5000
875 4 -4.4256 0.0000 0.0000 0.5000
876 4 -3.3865 0.0000 0.0000 0.5000
877 4 -2.3448 0.0000 0.0000 0.5000
878 4 -1.7219 0.0000 0.0000 0.5000
879 4 -0.7940 513.6706 470.0478 -0.0284
880 4 -1.4186 0.0000 0.0000 0.5000
881 4 -2.4309 0.0000 0.0000 0.5000
882 4 -3.1382 0.0000 0.0000 0.5000
883 4 -4.0636 0.0000 0.0000 0.5000
884 4 -3.9964 0.0000 0.0000 0.5000
885 4 -3.4780 0.0000 0.0000 0.5000
886 4 -2.5881 0.0000 0.0000 0.5000
887 4 -1.5259 0.0000 0.0000 0.5000
888 4 -0.7940 340.8032 455.7621 -11.4656
889 4 -0.8733 105.1471 479.9741 0.4354
890 4 -0.8310 -52.7629 535.1483 0.3877
891 4 -0.8310 -98.0590 979.1868 9.1017
892 4 -1.4186 0.0000 0.0000 0.5000
893 4 -2.3448 0.0000 0.0000 0.5000
894 4 -3.2644 0.0000 0.0000 0.5000
895 4 -3.6685 0.0000 0.0000 0.5000
896 4 -3.2644 0.0000 0.0000 0.5000
897 4 -2.3448 0.0000 0.0000 0.5000
898 4 -1.4186 0.0000 0.0000 0.5000
899 4 -0.8310 323.3431 480.9673 0.2949
900 4 -0.0473 371.6300 422.2938 0.6877
901 4 0.0484 -270.3042 457.8358 0.7554
902 4 -0.0473 371.6750 422.8139 0.6873
903 4 -0.7940 672.5191 836.4740 2.7202
904 4 -1.7202 0.0000 0.0000 0.5000
905 4 -2.4721 0.0000 0.0000 0.5000
906 4 -2.8872 0.0000 0.0000 0.5000
907 4 -2.6305 0.0000 0.0000 0.5000
908 4 -1.7219 0.0000 0.0000 0.5000
909 4 -0.8310 429.6515 899.6311 1.5122
910 4 -0.3525 149.4077 562.3972 0.2873
911 4 -0.0473 346.7553 336.1979 0.6902
912 4 -0.8310 274.9592 912.7533 5.4551
913 4 -1.4186 0.0000 0.0000 0.5000
914 4 -2.3448 0.0000 0.0000 0.5000
915 4 -3.2644 0.0000 0.0000 0.5000
916 4 -3.6685 0.0000 0.0000 0.5000
917 4 -3.2644 0.0000 0.0000 0.5000
918 4 -2.3448 0.0000 0.0000 0.5000
919 4 -1.4186 0.0000 0.0000 0.5000
920 4 -0.8310 219.2818 558.3435 7.4593
921 4 -0.7940 405.0552 499.8075 -0.3311
922 4 -1.4186 0.0000 0.0000 0.5000
923 4 -3.1382 0.0000 0.0000 0.5000
924 4 -3.9507 0.0000 0.0000 0.5000
925 4 -4.8614 0.0000 0.0000 0.5000
926 4 -5.0293 0.0000 0.0000 0.5000
927 4 -4.4256 0.0000 0.0000 0.5000
928 4 -3.3865 0.0000 0.0000 0.5000
929 4 -2.3448 0.0000 0.0000 0.5000
930 4 -1.7219 0.0000 0.0000 0.5000
931 4 -1.7202 0.0000 0.0000 0.5000
932 4 -2.3448 0.0000 0.0000 0.5000
933 4 -3.9507 0.0000 0.0000 0.5000
934 4 -5.0520 0.0000 0.0000 0.5000
935 4 -6.0200 0.0000 0.0000 0.5000
936 4 -6.1298 0.0000 0.0000 0.5000
937 4 -5.4930 0.0000 0.0000 0.5000
938 4 -4.4256 0.0000 0.0000 0.5000
939 4 -3.2644 0.0000 0.0000 0.5000
940 4 -2.6305 0.0000 0.0000 0.5000
941 4 -2.4721 0.0000 0.0000 0.5000
942 4 -3.2644 0.0000 0.0000 0.5000
943 4 -4.8614 0.0000 0.0000 0.5000
944 4 -6.0200 0.0000 0.0000 0.5000
945 4 -5.7653 0.0000 0.0000 0.5000
946 4 -6.7250 0.0000 0.0000 0.5000
947 4 -6.1298 0.0000 0.0000 0.5000
948 4 -5.0293 0.0000 0.0000 0.5000
949 4 -3.6685 0.0000 0.0000 0.5000
950 4 -2.8872 0.0000 0.0000 0.5000
951 4 -2.8872 0.0000 0.0000 0.5000
952 4 -3.6685 0.0000 0.0000 0.5000
953 4 -5.0293 0.0000 0.0000 0.5000
954 4 -6.1298 0.0000 0.0000 0.5000
955 4 -6.7250 0.0000 0.0000 0.5000
956 4 -5.7653 0.0000 0.0000 0.5000
957 4 -6.0200 0.0000 0.0000 0.5000
958 4 -4.8614 0.0000 0.0000 0.5000
959 4 -3.2644 0.0000 0.0000 0.5000
960 4 -2.4721 0.0000 0.0000 0.5000
961 4 -2.6305 0.0000 0.0000 0.5000
962 4 -3.2644 0.0000 0.0000 0.5000
963 4 -4.4256 0.0000 0.0000 0.5000
964 4 -5.4930 0.0000 0.0000 0.5000
965 4 -6.1298 0.0000 0.0000 0.5000
966 4 -6.0200 0.0000 0.0000 0.5000
967 4 -5.0520 0.0000 0.0000 0.5000
968 4 -3.9507 0.0000 0.0000 0.5000
969 4 -2.3448 0.0000 0.0000 0.5000
970 4 -1.7202 0.0000 0.0000 0.5000
971 4 -1.7219 0.0000 0.0000 0.5000
972 4 -2.3448 0.0000 0.0000 0.5000
973 4 -3.3865 0.0000 0.0000 0.5000
974 4 -4.4256 0.0000 0.0000 0.5000
975 4 -5.0293 0.0000 0.0000 0.5000
976 4 -4.8614 0.0000 0.0000 0.5000
977 4 -3.9507 0.0000 0.0000 0.5000
978 4 -3.1382 0.0000 0.0000 0.5000
979 4 -1.4186 0.0000 0.0000 0.5000
980 4 -0.7940 462.7719 407.6892 0.0071
981 4 -0.8310 163.3670 873.9792 7.3697
982 4 -1.4186 0.0000 0.0000 0.5000
983 4 -2.3448 0.0000 0.0000 0.5000
984 4 -3.2644 0.0000 0.0000 0.5000
985 4 -3.6685 0.0000 0.0000 0.5000
986 4 -3.2644 0.0000 0.0000 0.5000
987 4 -2.3448 0.0000 0.0000 0.5000
988 4 -1.4186 0.0000 0.0000 0.5000
989 4 -0.8310 331.5402 269.0503 0.4063
990 4 -0.0473 404.0647 228.7313 0.6126
991 4 -0.3525 6.3218 731.2221 0.0428
992 4 -0.8310 -52.5515 535.0622 0.3874
993 4 -1.7219 0.0000 0.0000 0.5000
994 4 -2.6305 0.0000 0.0000 0.5000
995 4 -2.8872 0.0000 0.0000 0.5000
996 4 -2.4721 0.0000 0.0000 0.5000
997 4 -1.7202 0.0000 0.0000 0.5000
998 4 -0.7940 199.7581 79.6489 0.5699
999 4 -0.0473 387.0365 144.1521 0.6136
1000 4 0.0484 126.0844 342.9643 0.6858
INITIALIZATION:
init_vloc : 0.01s CPU 0.01s WALL ( 18 calls)
init_us_1 : 0.28s CPU 0.28s WALL ( 18 calls)
Electron-Phonon interpolation
ephwann : 100.37s CPU 126.46s WALL ( 1 calls)
ep-interp : 48.99s CPU 55.11s WALL ( 201 calls)
PH SELF-ENER : 0.23s CPU 0.24s WALL ( 201 calls)
Ham: step 1 : 0.00s CPU 0.00s WALL ( 1 calls)
Ham: step 2 : 0.01s CPU 0.01s WALL ( 1 calls)
ep: step 1 : 0.38s CPU 0.37s WALL ( 1296 calls)
ep: step 2 : 8.31s CPU 8.99s WALL ( 1296 calls)
DynW2B : 0.02s CPU 0.02s WALL ( 201 calls)
HamW2B : 13.93s CPU 14.09s WALL ( 404000 calls)
ephW2Bp : 11.92s CPU 17.71s WALL ( 201 calls)
Total program execution
EPW : 36m22.02s CPU 39m35.56s WALL
Reference in New Issue View Git Blame Copy Permalink