mirror of https://gitlab.com/QEF/q-e.git
3242 lines
240 KiB
Plaintext
3242 lines
240 KiB
Plaintext
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``:oss/
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`.+s+. .+ys--yh+ `./ss+.
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-sh//yy+` +yy +yy -+h+-oyy
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-yh- .oyy/.-sh. .syo-.:sy- /yh
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`.-.` `yh+ -oyyyo. `/syys: oys `.`
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`/+ssys+-` `sh+ ` oys` .:osyo`
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-yh- ./syyooyo` .sys+/oyo--yh/
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`yy+ .-:-. `-/+/:` -sh-
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/yh. oys
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``..---hho---------` .---------..` `.-----.` -hd+---.
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`./osmNMMMMMMMMMMMMMMMs. +NNMMMMMMMMNNmh+. yNMMMMMNm- oNMMMMMNmo++:`
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+sy--/sdMMMhyyyyyyyNMMh- .oyNMMmyyyyyhNMMm+` -yMMMdyyo:` .oyyNMMNhs+syy`
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-yy/ /MMM+.`-+/``mMMy- `mMMh:`````.dMMN:` `MMMy-`-dhhy```mMMy:``+hs
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-yy+` /MMMo:-mMM+`-oo/. mMMh: `dMMN/` dMMm:`dMMMMy..MMMo-.+yo`
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.sys`/MMMMNNMMMs- mMMmyooooymMMNo: oMMM/sMMMMMM++MMN//oh:
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`sh+/MMMhyyMMMs- `-` mMMMMMMMMMNmy+-` -MMMhMMMsmMMmdMMd/yy+
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`-/+++oyy-/MMM+.`/hh/.`mNm:` mMMd+/////:-.` NMMMMMd/:NMMMMMy:/yyo/:.`
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+os+//:-..-oMMMo:--:::-/MMMo. .-mMMd+---` hMMMMN+. oMMMMMo. `-+osyso:`
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syo `mNMMMMMNNNNNNNNMMMo.oNNMMMMMNNNN:` +MMMMs:` dMMMN/` ``:syo
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/yh` :syyyyyyyyyyyyyyyy+.`+syyyyyyyyo:` .oyys:` .oyys:` +yh
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-yh- ```````````````` ````````` `` `` oys
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-+h/------------------------::::::::://////++++++++++++++++++++++///////::::/yd:
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shdddddddddddddddddddddddddddddhhhhhhhhyyyyyssssssssssssssssyyyyyyyhhhhhhhddddh`
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S. Ponce, E. R. Margine, C. Verdi, and F. Giustino,
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Comput. Phys. Commun. 209, 116 (2016)
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Program EPW v.5.0.0 starts on 11Oct2018 at 14:35: 8
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This program is part of the open-source Quantum ESPRESSO suite
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for quantum simulation of materials; please cite
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"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
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"P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017);
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URL http://www.quantum-espresso.org",
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in publications or presentations arising from this work. More details at
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http://www.quantum-espresso.org/quote
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Parallel version (MPI), running on 4 processors
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MPI processes distributed on 1 nodes
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K-points division: npool = 4
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Reading data from directory:
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./diam.save/
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IMPORTANT: XC functional enforced from input :
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Exchange-correlation = PZ ( 1 1 0 0 0 0)
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Any further DFT definition will be discarded
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Please, verify this is what you really want
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file C_3.98148.UPF: wavefunction(s) 3d renormalized
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G-vector sticks info
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--------------------
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sticks: dense smooth PW G-vecs: dense smooth PW
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Sum 367 367 121 4645 4645 893
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Possibly too few bands at point 1 0.00000 0.00000 0.00000
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Possibly too few bands at point 2 -0.33333 0.33333 -0.33333
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Possibly too few bands at point 3 -0.66667 0.66667 -0.66667
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Possibly too few bands at point 4 0.33333 0.33333 0.33333
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Possibly too few bands at point 5 0.00000 0.66667 0.00000
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Possibly too few bands at point 6 -0.33333 1.00000 -0.33333
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Possibly too few bands at point 7 0.66667 0.66667 0.66667
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--
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bravais-lattice index = 2
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lattice parameter (a_0) = 6.6425 a.u.
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unit-cell volume = 73.2698 (a.u.)^3
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number of atoms/cell = 2
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number of atomic types = 1
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kinetic-energy cut-off = 60.0000 Ry
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charge density cut-off = 240.0000 Ry
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convergence threshold = 0.0E+00
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beta = 0.0000
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number of iterations used = 0
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Exchange-correlation = PZ ( 1 1 0 0 0 0)
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celldm(1)= 6.64245 celldm(2)= 0.00000 celldm(3)= 0.00000
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celldm(4)= 0.00000 celldm(5)= 0.00000 celldm(6)= 0.00000
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crystal axes: (cart. coord. in units of a_0)
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a(1) = ( -0.5000 0.0000 0.5000 )
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a(2) = ( 0.0000 0.5000 0.5000 )
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a(3) = ( -0.5000 0.5000 0.0000 )
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reciprocal axes: (cart. coord. in units 2 pi/a_0)
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b(1) = ( -1.0000 -1.0000 1.0000 )
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b(2) = ( 1.0000 1.0000 1.0000 )
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b(3) = ( -1.0000 1.0000 -1.0000 )
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Atoms inside the unit cell:
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Cartesian axes
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site n. atom mass positions (a_0 units)
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1 C 12.0118 tau( 1) = ( 0.00000 0.00000 0.00000 )
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2 C 12.0118 tau( 2) = ( 0.25000 0.25000 0.25000 )
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49 Sym.Ops. (with q -> -q+G )
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G cutoff = 268.2305 ( 4645 G-vectors) FFT grid: ( 24, 24, 24)
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number of k points= 27 gaussian broad. (Ry)= 0.0200 ngauss = 1
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cart. coord. in units 2pi/a_0
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k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0740741
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k( 2) = ( -0.3333333 0.3333333 -0.3333333), wk = 0.0740741
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k( 3) = ( -0.6666667 0.6666667 -0.6666667), wk = 0.0740741
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k( 4) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0740741
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k( 5) = ( 0.0000000 0.6666667 0.0000000), wk = 0.0740741
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k( 6) = ( -0.3333333 1.0000000 -0.3333333), wk = 0.0740741
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k( 7) = ( 0.6666667 0.6666667 0.6666667), wk = 0.0740741
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k( 8) = ( 0.3333333 1.0000000 0.3333333), wk = 0.0740741
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k( 9) = ( 0.0000000 1.3333333 0.0000000), wk = 0.0740741
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k( 10) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0740741
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k( 11) = ( -0.6666667 0.0000000 0.0000000), wk = 0.0740741
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k( 12) = ( -1.0000000 0.3333333 -0.3333333), wk = 0.0740741
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k( 13) = ( 0.0000000 0.0000000 0.6666667), wk = 0.0740741
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k( 14) = ( -0.3333333 0.3333333 0.3333333), wk = 0.0740741
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k( 15) = ( -0.6666667 0.6666667 -0.0000000), wk = 0.0740741
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k( 16) = ( 0.3333333 0.3333333 1.0000000), wk = 0.0740741
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k( 17) = ( 0.0000000 0.6666667 0.6666667), wk = 0.0740741
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k( 18) = ( -0.3333333 1.0000000 0.3333333), wk = 0.0740741
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k( 19) = ( -0.6666667 -0.6666667 0.6666667), wk = 0.0740741
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k( 20) = ( -1.0000000 -0.3333333 0.3333333), wk = 0.0740741
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k( 21) = ( -1.3333333 0.0000000 0.0000000), wk = 0.0740741
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k( 22) = ( -0.3333333 -0.3333333 1.0000000), wk = 0.0740741
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k( 23) = ( -0.6666667 -0.0000000 0.6666667), wk = 0.0740741
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k( 24) = ( -1.0000000 0.3333333 0.3333333), wk = 0.0740741
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k( 25) = ( 0.0000000 0.0000000 1.3333333), wk = 0.0740741
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k( 26) = ( -0.3333333 0.3333333 1.0000000), wk = 0.0740741
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k( 27) = ( -0.6666667 0.6666667 0.6666667), wk = 0.0740741
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PseudoPot. # 1 for C read from file:
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./C_3.98148.UPF
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MD5 check sum: 8b65adcd36341f53911399f4b6efa59f
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Pseudo is Norm-conserving, Zval = 4.0
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Generated by new atomic code, or converted to UPF format
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Using radial grid of 461 points, 2 beta functions with:
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l(1) = 0
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l(2) = 1
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EPW : 0.08s CPU 0.09s WALL
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EPW : 0.12s CPU 0.13s WALL
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No wavefunction gauge setting applied
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-------------------------------------------------------------------
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Wannierization on 3 x 3 x 3 electronic grid
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-------------------------------------------------------------------
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Spin CASE ( default = unpolarized )
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Initializing Wannier90
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Initial Wannier projections
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( 0.00000 0.00000 0.00000) : l = -3 mr = 1
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( 0.00000 0.00000 0.00000) : l = -3 mr = 2
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( 0.00000 0.00000 0.00000) : l = -3 mr = 3
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( 0.00000 0.00000 0.00000) : l = -3 mr = 4
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- Number of bands is ( 4)
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- Number of total bands is ( 4)
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- Number of excluded bands is ( 0)
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- Number of wannier functions is ( 4)
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- All guiding functions are given
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Reading data about k-point neighbours
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- All neighbours are found
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AMN
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k points = 27 in 4 pools
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1 of 7 on ionode
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2 of 7 on ionode
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3 of 7 on ionode
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4 of 7 on ionode
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5 of 7 on ionode
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6 of 7 on ionode
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7 of 7 on ionode
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AMN calculated
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MMN
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k points = 27 in 4 pools
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1 of 7 on ionode
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2 of 7 on ionode
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3 of 7 on ionode
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4 of 7 on ionode
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5 of 7 on ionode
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6 of 7 on ionode
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7 of 7 on ionode
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MMN calculated
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Running Wannier90
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Wannier Function centers (cartesian, alat) and spreads (ang):
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( 0.12500 0.12500 0.12500) : 0.57702
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( 0.12500 -0.12500 -0.12500) : 0.57702
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( -0.12500 0.12500 -0.12500) : 0.57702
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( -0.12500 -0.12500 0.12500) : 0.57702
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-------------------------------------------------------------------
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WANNIER : 0.96s CPU 0.98s WALL ( 1 calls)
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-------------------------------------------------------------------
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Dipole matrix elements calculated
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Calculating kmap and kgmap
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Progress kmap: ###########################
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Progress kgmap: ########################################
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kmaps : 0.39s CPU 0.41s WALL ( 1 calls)
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Symmetries of bravais lattice: 48
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Symmetries of crystal: 48
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===================================================================
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irreducible q point # 1
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===================================================================
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Symmetries of small group of q: 48
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in addition sym. q -> -q+G:
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Number of q in the star = 1
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List of q in the star:
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1 0.000000000 0.000000000 0.000000000
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Imposing acoustic sum rule on the dynamical matrix
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q( 1 ) = ( 0.0000000 0.0000000 0.0000000 )
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===================================================================
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irreducible q point # 2
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===================================================================
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Symmetries of small group of q: 6
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Number of q in the star = 8
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List of q in the star:
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1 -0.333333333 0.333333333 -0.333333333
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2 0.333333333 0.333333333 -0.333333333
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3 0.333333333 0.333333333 0.333333333
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4 -0.333333333 0.333333333 0.333333333
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5 0.333333333 -0.333333333 0.333333333
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6 -0.333333333 -0.333333333 -0.333333333
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7 0.333333333 -0.333333333 -0.333333333
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8 -0.333333333 -0.333333333 0.333333333
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q( 2 ) = ( -0.3333333 0.3333333 -0.3333333 )
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q( 3 ) = ( 0.3333333 0.3333333 -0.3333333 )
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q( 4 ) = ( 0.3333333 0.3333333 0.3333333 )
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q( 5 ) = ( -0.3333333 0.3333333 0.3333333 )
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q( 6 ) = ( 0.3333333 -0.3333333 0.3333333 )
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q( 7 ) = ( -0.3333333 -0.3333333 -0.3333333 )
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q( 8 ) = ( 0.3333333 -0.3333333 -0.3333333 )
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q( 9 ) = ( -0.3333333 -0.3333333 0.3333333 )
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===================================================================
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irreducible q point # 3
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===================================================================
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Symmetries of small group of q: 8
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Number of q in the star = 6
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List of q in the star:
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1 0.000000000 0.666666667 0.000000000
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2 -0.666666667 0.000000000 0.000000000
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3 0.000000000 -0.666666667 0.000000000
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4 0.000000000 0.000000000 0.666666667
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5 0.000000000 0.000000000 -0.666666667
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6 0.666666667 0.000000000 0.000000000
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q( 10 ) = ( 0.0000000 0.6666667 0.0000000 )
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q( 11 ) = ( -0.6666667 0.0000000 0.0000000 )
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q( 12 ) = ( 0.0000000 -0.6666667 0.0000000 )
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q( 13 ) = ( 0.0000000 0.0000000 0.6666667 )
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q( 14 ) = ( 0.0000000 0.0000000 -0.6666667 )
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q( 15 ) = ( 0.6666667 0.0000000 0.0000000 )
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===================================================================
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irreducible q point # 4
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===================================================================
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Symmetries of small group of q: 4
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Number of q in the star = 12
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List of q in the star:
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1 0.666666667 0.000000000 0.666666667
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2 0.666666667 0.000000000 -0.666666667
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3 -0.666666667 0.000000000 -0.666666667
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4 -0.666666667 0.000000000 0.666666667
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5 0.000000000 -0.666666667 0.666666667
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6 -0.666666667 0.666666667 0.000000000
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7 -0.666666667 -0.666666667 0.000000000
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8 0.666666667 0.666666667 0.000000000
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9 0.666666667 -0.666666667 0.000000000
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10 0.000000000 0.666666667 0.666666667
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11 0.000000000 0.666666667 -0.666666667
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12 0.000000000 -0.666666667 -0.666666667
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q( 16 ) = ( 0.6666667 0.0000000 0.6666667 )
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q( 17 ) = ( 0.6666667 0.0000000 -0.6666667 )
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q( 18 ) = ( -0.6666667 0.0000000 -0.6666667 )
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q( 19 ) = ( -0.6666667 0.0000000 0.6666667 )
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q( 20 ) = ( 0.0000000 -0.6666667 0.6666667 )
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q( 21 ) = ( -0.6666667 0.6666667 0.0000000 )
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q( 22 ) = ( -0.6666667 -0.6666667 0.0000000 )
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q( 23 ) = ( 0.6666667 0.6666667 0.0000000 )
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q( 24 ) = ( 0.6666667 -0.6666667 0.0000000 )
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q( 25 ) = ( 0.0000000 0.6666667 0.6666667 )
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q( 26 ) = ( 0.0000000 0.6666667 -0.6666667 )
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q( 27 ) = ( 0.0000000 -0.6666667 -0.6666667 )
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Writing epmatq on .epb files
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The .epb files have been correctly written
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Use zone-centred Wigner-Seitz cells
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Number of WS vectors for electrons 43
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Number of WS vectors for phonons 43
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Number of WS vectors for electron-phonon 43
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Results may improve by using use_ws == .true.
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Writing Hamiltonian, Dynamical matrix and EP vertex in Wann rep to file
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Reading Hamiltonian, Dynamical matrix and EP vertex in Wann rep from file
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Finished reading Wann rep data from file
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===================================================================
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Memory usage: VmHWM = 38Mb
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VmPeak = 451Mb
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===================================================================
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Using uniform q-mesh: 6 6 6
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Size of q point mesh for interpolation: 216
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Using uniform k-mesh: 6 6 6
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Size of k point mesh for interpolation: 432
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Max number of k points per pool: 108
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Fermi energy coarse grid = 14.009584 eV
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Fermi energy is calculated from the fine k-mesh: Ef = 13.576273 eV
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Warning: check if difference with Fermi level fine grid makes sense
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===================================================================
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ibndmin = 1 ebndmin = -0.074
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ibndmax = 4 ebndmax = 1.021
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Number of ep-matrix elements per pool : 5184 ~= 40.50 Kb (@ 8 bytes/ DP)
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===================================================================
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Electron (Imaginary) Self-Energy in the Migdal Approximation
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===================================================================
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Fermi Surface thickness = 15.000000 eV
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Golden Rule strictly enforced with T = 0.025852 eV
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Gaussian Broadening: 1.000000 eV, ngauss= 1
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Progression iq (fine) = 50/ 216
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Progression iq (fine) = 100/ 216
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Progression iq (fine) = 150/ 216
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Progression iq (fine) = 200/ 216
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Average over degenerate eigenstates is performed
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WARNING: only the eigenstates within the Fermi window are meaningful
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ik = 1 coord.: 0.0000000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -21.5330 eV Re[Sigma]= -64.672181 meV Im[Sigma]= 6.811921 meV Z= 0.993360 lam= 0.006685
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E( 2 )= 0.3145 eV Re[Sigma]= 144.078167 meV Im[Sigma]= 42.023889 meV Z= 0.982766 lam= 0.017536
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E( 3 )= 0.3145 eV Re[Sigma]= 144.078167 meV Im[Sigma]= 42.023889 meV Z= 0.982766 lam= 0.017536
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E( 4 )= 0.3145 eV Re[Sigma]= 144.078167 meV Im[Sigma]= 42.023889 meV Z= 0.982766 lam= 0.017536
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-------------------------------------------------------------------
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ik = 2 coord.: 0.0000000 0.0000000 0.1666667
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-------------------------------------------------------------------
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E( 1 )= -20.7958 eV Re[Sigma]= -65.522219 meV Im[Sigma]= 15.299012 meV Z= 0.997611 lam= 0.002394
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E( 2 )= -2.5926 eV Re[Sigma]= 91.316758 meV Im[Sigma]= 184.013949 meV Z= 1.046153 lam= -0.044117
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E( 3 )= -0.4527 eV Re[Sigma]= 133.604880 meV Im[Sigma]= 76.853837 meV Z= 1.002107 lam= -0.002102
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E( 4 )= -0.4527 eV Re[Sigma]= 133.604880 meV Im[Sigma]= 76.853837 meV Z= 1.002107 lam= -0.002102
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-------------------------------------------------------------------
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ik = 3 coord.: 0.0000000 0.0000000 0.3333333
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-------------------------------------------------------------------
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E( 1 )= -18.3978 eV Re[Sigma]= -56.337429 meV Im[Sigma]= 40.533100 meV Z= 1.002330 lam= -0.002325
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E( 2 )= -9.2191 eV Re[Sigma]= -13.642927 meV Im[Sigma]= 49.627188 meV Z= 0.997292 lam= 0.002716
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E( 3 )= -2.0907 eV Re[Sigma]= 96.622517 meV Im[Sigma]= 145.974910 meV Z= 1.021934 lam= -0.021464
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E( 4 )= -2.0907 eV Re[Sigma]= 96.622517 meV Im[Sigma]= 145.974910 meV Z= 1.021934 lam= -0.021464
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-------------------------------------------------------------------
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ik = 4 coord.: 0.0000000 0.0000000 0.5000000
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-------------------------------------------------------------------
|
|
E( 1 )= -15.6077 eV Re[Sigma]= -40.964614 meV Im[Sigma]= 59.572078 meV Z= 1.004764 lam= -0.004741
|
|
E( 2 )= -14.0678 eV Re[Sigma]= -10.055497 meV Im[Sigma]= 62.457342 meV Z= 1.003648 lam= -0.003634
|
|
E( 3 )= -2.9614 eV Re[Sigma]= 54.147029 meV Im[Sigma]= 173.016113 meV Z= 1.045793 lam= -0.043788
|
|
E( 4 )= -2.9614 eV Re[Sigma]= 54.147029 meV Im[Sigma]= 173.016113 meV Z= 1.045793 lam= -0.043788
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 5 coord.: 0.0000000 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.337334 meV Im[Sigma]= 40.533136 meV Z= 1.002330 lam= -0.002325
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -13.642991 meV Im[Sigma]= 49.627200 meV Z= 0.997292 lam= 0.002716
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 96.622511 meV Im[Sigma]= 145.974774 meV Z= 1.021934 lam= -0.021464
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 96.622511 meV Im[Sigma]= 145.974774 meV Z= 1.021934 lam= -0.021464
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 6 coord.: 0.0000000 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.522206 meV Im[Sigma]= 15.299061 meV Z= 0.997612 lam= 0.002394
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 91.316780 meV Im[Sigma]= 184.014378 meV Z= 1.046154 lam= -0.044117
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 133.604812 meV Im[Sigma]= 76.853777 meV Z= 1.002107 lam= -0.002102
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 133.604812 meV Im[Sigma]= 76.853777 meV Z= 1.002107 lam= -0.002102
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 7 coord.: 0.0000000 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.484219 meV Im[Sigma]= 15.406991 meV Z= 0.997690 lam= 0.002315
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 90.770418 meV Im[Sigma]= 187.312256 meV Z= 1.047553 lam= -0.045394
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 131.285423 meV Im[Sigma]= 74.631506 meV Z= 1.001742 lam= -0.001739
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 131.285423 meV Im[Sigma]= 74.631506 meV Z= 1.001742 lam= -0.001739
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 8 coord.: 0.0000000 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353204 meV Im[Sigma]= 17.271972 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918115 meV Im[Sigma]= 132.880519 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245284 meV Im[Sigma]= 113.308689 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245284 meV Im[Sigma]= 113.308689 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 9 coord.: 0.0000000 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004796 meV Im[Sigma]= 43.008232 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492842 meV Im[Sigma]= 103.623518 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956563 meV Im[Sigma]= 163.844998 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524083 meV Im[Sigma]= 170.822177 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 10 coord.: 0.0000000 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222520 meV Im[Sigma]= 63.284684 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337014 meV Im[Sigma]= 65.620286 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103866 meV Im[Sigma]= 135.507081 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246819 meV Im[Sigma]= 140.526096 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 11 coord.: 0.0000000 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564688 meV Im[Sigma]= 68.247669 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255491 meV Im[Sigma]= 57.760019 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487970 meV Im[Sigma]= 121.319237 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740672 meV Im[Sigma]= 161.646428 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 12 coord.: 0.0000000 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083444 meV Im[Sigma]= 34.876218 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.540992 meV Im[Sigma]= 135.931640 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611719 meV Im[Sigma]= 170.381707 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502369 meV Im[Sigma]= 85.833213 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 13 coord.: 0.0000000 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.579357 meV Im[Sigma]= 40.552634 meV Z= 1.002291 lam= -0.002286
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -14.127011 meV Im[Sigma]= 49.377195 meV Z= 0.997140 lam= 0.002868
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 95.271563 meV Im[Sigma]= 142.848232 meV Z= 1.021382 lam= -0.020935
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 95.271563 meV Im[Sigma]= 142.848232 meV Z= 1.021382 lam= -0.020935
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 14 coord.: 0.0000000 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103080 meV Im[Sigma]= 43.282672 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692276 meV Im[Sigma]= 102.511830 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487786 meV Im[Sigma]= 163.651663 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229140 meV Im[Sigma]= 166.718482 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 15 coord.: 0.0000000 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928414 meV Im[Sigma]= 42.126554 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655528 meV Im[Sigma]= 108.547025 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859942 meV Im[Sigma]= 106.352004 meV Z= 1.019113 lam= -0.018754
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859942 meV Im[Sigma]= 106.352004 meV Z= 1.019113 lam= -0.018754
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 16 coord.: 0.0000000 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506764 meV Im[Sigma]= 56.052398 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769396 meV Im[Sigma]= 57.167488 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406313 meV Im[Sigma]= 84.735500 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762814 meV Im[Sigma]= 78.308796 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 17 coord.: 0.0000000 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524822 meV Im[Sigma]= 60.327782 meV Z= 1.003539 lam= -0.003527
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928087 meV Im[Sigma]= 64.846736 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042149 meV Im[Sigma]= 40.766335 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675065 meV Im[Sigma]= 121.274833 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 18 coord.: 0.0000000 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635471 meV Im[Sigma]= 68.663098 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173976 meV Im[Sigma]= 57.645905 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807813 meV Im[Sigma]= 119.639455 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839675 meV Im[Sigma]= 161.382378 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 19 coord.: 0.0000000 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.6077 eV Re[Sigma]= -40.453632 meV Im[Sigma]= 58.936199 meV Z= 1.004205 lam= -0.004187
|
|
E( 2 )= -14.0678 eV Re[Sigma]= -10.779308 meV Im[Sigma]= 63.222151 meV Z= 1.004142 lam= -0.004125
|
|
E( 3 )= -2.9614 eV Re[Sigma]= 53.175773 meV Im[Sigma]= 169.693235 meV Z= 1.045157 lam= -0.043206
|
|
E( 4 )= -2.9614 eV Re[Sigma]= 53.175773 meV Im[Sigma]= 169.693235 meV Z= 1.045157 lam= -0.043206
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 20 coord.: 0.0000000 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865284 meV Im[Sigma]= 63.143317 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.545028 meV Im[Sigma]= 65.716374 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.060035 meV Im[Sigma]= 133.531526 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408013 meV Im[Sigma]= 139.502456 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 21 coord.: 0.0000000 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220237 meV Im[Sigma]= 56.066485 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333058 meV Im[Sigma]= 57.066956 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004682 meV Im[Sigma]= 83.963406 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796200 meV Im[Sigma]= 78.111275 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 22 coord.: 0.0000000 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.8708 eV Re[Sigma]= -28.996945 meV Im[Sigma]= 63.140608 meV Z= 1.000478 lam= -0.000478
|
|
E( 2 )= -11.9934 eV Re[Sigma]= -20.805063 meV Im[Sigma]= 78.313968 meV Z= 1.012449 lam= -0.012296
|
|
E( 3 )= -6.9896 eV Re[Sigma]= -4.186830 meV Im[Sigma]= 69.999880 meV Z= 1.014672 lam= -0.014460
|
|
E( 4 )= -6.9896 eV Re[Sigma]= -4.186830 meV Im[Sigma]= 69.999880 meV Z= 1.014672 lam= -0.014460
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 23 coord.: 0.0000000 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220251 meV Im[Sigma]= 56.066644 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333085 meV Im[Sigma]= 57.066907 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004662 meV Im[Sigma]= 83.963543 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796225 meV Im[Sigma]= 78.111366 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 24 coord.: 0.0000000 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865310 meV Im[Sigma]= 63.143249 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.544964 meV Im[Sigma]= 65.716421 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.059972 meV Im[Sigma]= 133.531541 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408088 meV Im[Sigma]= 139.502349 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 25 coord.: 0.0000000 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.579323 meV Im[Sigma]= 40.552596 meV Z= 1.002291 lam= -0.002286
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -14.126999 meV Im[Sigma]= 49.377204 meV Z= 0.997140 lam= 0.002868
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 95.271561 meV Im[Sigma]= 142.848032 meV Z= 1.021382 lam= -0.020934
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 95.271561 meV Im[Sigma]= 142.848032 meV Z= 1.021382 lam= -0.020934
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 26 coord.: 0.0000000 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635476 meV Im[Sigma]= 68.663003 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173926 meV Im[Sigma]= 57.645829 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807863 meV Im[Sigma]= 119.639321 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839740 meV Im[Sigma]= 161.382303 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 27 coord.: 0.0000000 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524812 meV Im[Sigma]= 60.327731 meV Z= 1.003539 lam= -0.003526
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928136 meV Im[Sigma]= 64.846728 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042139 meV Im[Sigma]= 40.766301 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675098 meV Im[Sigma]= 121.274828 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 28 coord.: 0.0000000 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506743 meV Im[Sigma]= 56.052338 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769444 meV Im[Sigma]= 57.167548 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406336 meV Im[Sigma]= 84.735358 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762867 meV Im[Sigma]= 78.308868 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 29 coord.: 0.0000000 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928425 meV Im[Sigma]= 42.126573 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655637 meV Im[Sigma]= 108.546975 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859896 meV Im[Sigma]= 106.352004 meV Z= 1.019113 lam= -0.018754
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859896 meV Im[Sigma]= 106.352004 meV Z= 1.019113 lam= -0.018754
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 30 coord.: 0.0000000 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103104 meV Im[Sigma]= 43.282603 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692319 meV Im[Sigma]= 102.511960 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487708 meV Im[Sigma]= 163.651555 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229252 meV Im[Sigma]= 166.718362 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 31 coord.: 0.0000000 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.484231 meV Im[Sigma]= 15.406909 meV Z= 0.997690 lam= 0.002315
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 90.770442 meV Im[Sigma]= 187.312085 meV Z= 1.047553 lam= -0.045394
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 131.285344 meV Im[Sigma]= 74.631471 meV Z= 1.001742 lam= -0.001739
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 131.285344 meV Im[Sigma]= 74.631471 meV Z= 1.001742 lam= -0.001739
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 32 coord.: 0.0000000 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083498 meV Im[Sigma]= 34.876229 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.540893 meV Im[Sigma]= 135.931459 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611738 meV Im[Sigma]= 170.381636 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502335 meV Im[Sigma]= 85.833224 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 33 coord.: 0.0000000 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564679 meV Im[Sigma]= 68.247716 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255460 meV Im[Sigma]= 57.759972 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487948 meV Im[Sigma]= 121.319282 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740640 meV Im[Sigma]= 161.646334 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 34 coord.: 0.0000000 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222448 meV Im[Sigma]= 63.284601 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337010 meV Im[Sigma]= 65.620228 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103845 meV Im[Sigma]= 135.507267 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246873 meV Im[Sigma]= 140.526013 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 35 coord.: 0.0000000 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004725 meV Im[Sigma]= 43.008402 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492989 meV Im[Sigma]= 103.623472 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956533 meV Im[Sigma]= 163.844930 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524238 meV Im[Sigma]= 170.822133 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 36 coord.: 0.0000000 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353233 meV Im[Sigma]= 17.271914 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918090 meV Im[Sigma]= 132.880470 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245294 meV Im[Sigma]= 113.308701 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245294 meV Im[Sigma]= 113.308701 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 37 coord.: 0.1666667 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.522216 meV Im[Sigma]= 15.299011 meV Z= 0.997611 lam= 0.002394
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 91.316764 meV Im[Sigma]= 184.013955 meV Z= 1.046153 lam= -0.044117
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 133.604877 meV Im[Sigma]= 76.853835 meV Z= 1.002107 lam= -0.002102
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 133.604877 meV Im[Sigma]= 76.853835 meV Z= 1.002107 lam= -0.002102
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 38 coord.: 0.1666667 0.0000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353240 meV Im[Sigma]= 17.271922 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918068 meV Im[Sigma]= 132.880455 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245272 meV Im[Sigma]= 113.308669 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245272 meV Im[Sigma]= 113.308669 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 39 coord.: 0.1666667 0.0000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013562 meV Im[Sigma]= 43.222881 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958107 meV Im[Sigma]= 102.187972 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271350 meV Im[Sigma]= 167.529239 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473064 meV Im[Sigma]= 167.234109 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 40 coord.: 0.1666667 0.0000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205362 meV Im[Sigma]= 62.539264 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484181 meV Im[Sigma]= 65.234020 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755229 meV Im[Sigma]= 134.097692 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528270 meV Im[Sigma]= 142.414232 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 41 coord.: 0.1666667 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621488 meV Im[Sigma]= 68.209699 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103253 meV Im[Sigma]= 57.852394 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340376 meV Im[Sigma]= 120.235688 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263278 meV Im[Sigma]= 163.894398 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 42 coord.: 0.1666667 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034048 meV Im[Sigma]= 34.911996 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131571 meV Im[Sigma]= 135.235414 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453898 meV Im[Sigma]= 173.776004 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886519 meV Im[Sigma]= 86.616317 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 43 coord.: 0.1666667 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353204 meV Im[Sigma]= 17.271971 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918095 meV Im[Sigma]= 132.880505 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245289 meV Im[Sigma]= 113.308689 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245289 meV Im[Sigma]= 113.308689 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 44 coord.: 0.1666667 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.522209 meV Im[Sigma]= 15.299061 meV Z= 0.997612 lam= 0.002394
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 91.316797 meV Im[Sigma]= 184.014469 meV Z= 1.046154 lam= -0.044117
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 133.604792 meV Im[Sigma]= 76.853764 meV Z= 1.002107 lam= -0.002102
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 133.604792 meV Im[Sigma]= 76.853764 meV Z= 1.002107 lam= -0.002102
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 45 coord.: 0.1666667 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034052 meV Im[Sigma]= 34.911996 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131576 meV Im[Sigma]= 135.235388 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453894 meV Im[Sigma]= 173.775987 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886515 meV Im[Sigma]= 86.616309 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 46 coord.: 0.1666667 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621543 meV Im[Sigma]= 68.209776 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103270 meV Im[Sigma]= 57.852417 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340352 meV Im[Sigma]= 120.235608 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263250 meV Im[Sigma]= 163.894448 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 47 coord.: 0.1666667 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205351 meV Im[Sigma]= 62.539144 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484165 meV Im[Sigma]= 65.234134 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755224 meV Im[Sigma]= 134.097670 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528257 meV Im[Sigma]= 142.414158 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 48 coord.: 0.1666667 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013530 meV Im[Sigma]= 43.222803 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958206 meV Im[Sigma]= 102.188079 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271318 meV Im[Sigma]= 167.529116 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473136 meV Im[Sigma]= 167.234036 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 49 coord.: 0.1666667 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103080 meV Im[Sigma]= 43.282673 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692275 meV Im[Sigma]= 102.511827 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487782 meV Im[Sigma]= 163.651659 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229127 meV Im[Sigma]= 166.718455 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 50 coord.: 0.1666667 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083450 meV Im[Sigma]= 34.876219 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.540991 meV Im[Sigma]= 135.931632 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611730 meV Im[Sigma]= 170.381689 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502369 meV Im[Sigma]= 85.833213 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 51 coord.: 0.1666667 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013534 meV Im[Sigma]= 43.222804 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958206 meV Im[Sigma]= 102.188093 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271325 meV Im[Sigma]= 167.529121 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473154 meV Im[Sigma]= 167.234039 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 52 coord.: 0.1666667 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835604 meV Im[Sigma]= 72.504462 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613289 meV Im[Sigma]= 50.529544 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879556 meV Im[Sigma]= 87.562234 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625829 meV Im[Sigma]= 143.145682 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 53 coord.: 0.1666667 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865175 meV Im[Sigma]= 61.528369 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501742 meV Im[Sigma]= 67.451647 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378182 meV Im[Sigma]= 76.056407 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810834 meV Im[Sigma]= 109.181716 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 54 coord.: 0.1666667 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720851 meV Im[Sigma]= 72.549570 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814062 meV Im[Sigma]= 49.833095 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489440 meV Im[Sigma]= 87.637184 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724983 meV Im[Sigma]= 142.112625 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 55 coord.: 0.1666667 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865282 meV Im[Sigma]= 63.143321 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.545024 meV Im[Sigma]= 65.716379 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.060035 meV Im[Sigma]= 133.531507 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408010 meV Im[Sigma]= 139.502456 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 56 coord.: 0.1666667 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635473 meV Im[Sigma]= 68.663099 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173976 meV Im[Sigma]= 57.645905 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807817 meV Im[Sigma]= 119.639425 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839679 meV Im[Sigma]= 161.382393 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 57 coord.: 0.1666667 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720857 meV Im[Sigma]= 72.549570 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814063 meV Im[Sigma]= 49.833096 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489434 meV Im[Sigma]= 87.637190 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724992 meV Im[Sigma]= 142.112660 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 58 coord.: 0.1666667 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305308 meV Im[Sigma]= 56.075391 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714394 meV Im[Sigma]= 56.832486 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546316 meV Im[Sigma]= 82.755396 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241860 meV Im[Sigma]= 80.024449 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 59 coord.: 0.1666667 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870812 meV Im[Sigma]= 79.954195 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492363 meV Im[Sigma]= 75.573745 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339368 meV Im[Sigma]= 41.486199 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462594 meV Im[Sigma]= 78.066730 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 60 coord.: 0.1666667 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540787 meV Im[Sigma]= 61.499512 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454817 meV Im[Sigma]= 66.905000 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849520 meV Im[Sigma]= 76.188412 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263379 meV Im[Sigma]= 108.408229 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 61 coord.: 0.1666667 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635481 meV Im[Sigma]= 68.663007 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173931 meV Im[Sigma]= 57.645842 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807862 meV Im[Sigma]= 119.639350 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839739 meV Im[Sigma]= 161.382288 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 62 coord.: 0.1666667 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865308 meV Im[Sigma]= 63.143248 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.544954 meV Im[Sigma]= 65.716421 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.059981 meV Im[Sigma]= 133.531509 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408084 meV Im[Sigma]= 139.502324 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 63 coord.: 0.1666667 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540783 meV Im[Sigma]= 61.499513 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454820 meV Im[Sigma]= 66.904996 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849507 meV Im[Sigma]= 76.188408 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263379 meV Im[Sigma]= 108.408229 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 64 coord.: 0.1666667 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870851 meV Im[Sigma]= 79.954236 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492399 meV Im[Sigma]= 75.573765 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339350 meV Im[Sigma]= 41.486215 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462610 meV Im[Sigma]= 78.066613 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 65 coord.: 0.1666667 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305307 meV Im[Sigma]= 56.075424 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714417 meV Im[Sigma]= 56.832447 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546366 meV Im[Sigma]= 82.755341 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241884 meV Im[Sigma]= 80.024503 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 66 coord.: 0.1666667 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720863 meV Im[Sigma]= 72.549622 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814069 meV Im[Sigma]= 49.833047 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489437 meV Im[Sigma]= 87.637201 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725033 meV Im[Sigma]= 142.112630 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 67 coord.: 0.1666667 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083499 meV Im[Sigma]= 34.876222 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.540921 meV Im[Sigma]= 135.931495 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611746 meV Im[Sigma]= 170.381609 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502339 meV Im[Sigma]= 85.833228 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 68 coord.: 0.1666667 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103106 meV Im[Sigma]= 43.282617 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692274 meV Im[Sigma]= 102.511950 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487702 meV Im[Sigma]= 163.651432 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229254 meV Im[Sigma]= 166.718332 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 69 coord.: 0.1666667 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720857 meV Im[Sigma]= 72.549628 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814026 meV Im[Sigma]= 49.833027 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489419 meV Im[Sigma]= 87.637215 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725051 meV Im[Sigma]= 142.112578 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 70 coord.: 0.1666667 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865160 meV Im[Sigma]= 61.528415 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501743 meV Im[Sigma]= 67.451538 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378254 meV Im[Sigma]= 76.056355 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810857 meV Im[Sigma]= 109.181778 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 71 coord.: 0.1666667 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835588 meV Im[Sigma]= 72.504504 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613315 meV Im[Sigma]= 50.529535 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879580 meV Im[Sigma]= 87.562188 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625792 meV Im[Sigma]= 143.145796 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 72 coord.: 0.1666667 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013559 meV Im[Sigma]= 43.222869 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958150 meV Im[Sigma]= 102.187983 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271334 meV Im[Sigma]= 167.529320 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473079 meV Im[Sigma]= 167.234200 meV Z= 1.042446 lam= -0.040718
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 73 coord.: 0.3333333 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.337428 meV Im[Sigma]= 40.533100 meV Z= 1.002330 lam= -0.002325
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -13.642924 meV Im[Sigma]= 49.627188 meV Z= 0.997292 lam= 0.002716
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 96.622512 meV Im[Sigma]= 145.974906 meV Z= 1.021934 lam= -0.021464
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 96.622512 meV Im[Sigma]= 145.974906 meV Z= 1.021934 lam= -0.021464
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 74 coord.: 0.3333333 0.0000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013563 meV Im[Sigma]= 43.222880 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958104 meV Im[Sigma]= 102.187987 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271346 meV Im[Sigma]= 167.529224 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473069 meV Im[Sigma]= 167.234109 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 75 coord.: 0.3333333 0.0000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928420 meV Im[Sigma]= 42.126583 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655550 meV Im[Sigma]= 108.546949 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859971 meV Im[Sigma]= 106.351947 meV Z= 1.019113 lam= -0.018754
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859971 meV Im[Sigma]= 106.351947 meV Z= 1.019113 lam= -0.018754
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 76 coord.: 0.3333333 0.0000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305311 meV Im[Sigma]= 56.075420 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714380 meV Im[Sigma]= 56.832434 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546333 meV Im[Sigma]= 82.755340 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241844 meV Im[Sigma]= 80.024467 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 77 coord.: 0.3333333 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579935 meV Im[Sigma]= 60.620619 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301195 meV Im[Sigma]= 65.093404 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604277 meV Im[Sigma]= 39.545138 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354885 meV Im[Sigma]= 124.562010 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 78 coord.: 0.3333333 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621545 meV Im[Sigma]= 68.209787 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103270 meV Im[Sigma]= 57.852422 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340357 meV Im[Sigma]= 120.235627 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263242 meV Im[Sigma]= 163.894446 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 79 coord.: 0.3333333 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004796 meV Im[Sigma]= 43.008230 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492841 meV Im[Sigma]= 103.623522 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956561 meV Im[Sigma]= 163.844989 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524077 meV Im[Sigma]= 170.822166 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 80 coord.: 0.3333333 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034052 meV Im[Sigma]= 34.911995 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131576 meV Im[Sigma]= 135.235367 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453898 meV Im[Sigma]= 173.776006 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886507 meV Im[Sigma]= 86.616305 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 81 coord.: 0.3333333 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004731 meV Im[Sigma]= 43.008407 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492967 meV Im[Sigma]= 103.623455 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956529 meV Im[Sigma]= 163.844842 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524239 meV Im[Sigma]= 170.822033 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 82 coord.: 0.3333333 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835586 meV Im[Sigma]= 72.504511 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613284 meV Im[Sigma]= 50.529520 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879537 meV Im[Sigma]= 87.562182 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625834 meV Im[Sigma]= 143.145750 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 83 coord.: 0.3333333 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808843 meV Im[Sigma]= 61.803174 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747641 meV Im[Sigma]= 66.398418 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527603 meV Im[Sigma]= 76.766865 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744317 meV Im[Sigma]= 111.080423 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 84 coord.: 0.3333333 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835602 meV Im[Sigma]= 72.504466 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613291 meV Im[Sigma]= 50.529544 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879552 meV Im[Sigma]= 87.562229 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625824 meV Im[Sigma]= 143.145673 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 85 coord.: 0.3333333 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928415 meV Im[Sigma]= 42.126552 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655528 meV Im[Sigma]= 108.547024 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859944 meV Im[Sigma]= 106.351995 meV Z= 1.019113 lam= -0.018754
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859944 meV Im[Sigma]= 106.351995 meV Z= 1.019113 lam= -0.018754
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 86 coord.: 0.3333333 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013538 meV Im[Sigma]= 43.222800 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958206 meV Im[Sigma]= 102.188082 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271324 meV Im[Sigma]= 167.529115 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473151 meV Im[Sigma]= 167.234026 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 87 coord.: 0.3333333 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.337340 meV Im[Sigma]= 40.533136 meV Z= 1.002330 lam= -0.002325
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -13.642990 meV Im[Sigma]= 49.627200 meV Z= 0.997292 lam= 0.002716
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 96.622515 meV Im[Sigma]= 145.974769 meV Z= 1.021934 lam= -0.021464
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 96.622515 meV Im[Sigma]= 145.974769 meV Z= 1.021934 lam= -0.021464
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 88 coord.: 0.3333333 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621492 meV Im[Sigma]= 68.209699 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103247 meV Im[Sigma]= 57.852401 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340382 meV Im[Sigma]= 120.235674 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263288 meV Im[Sigma]= 163.894397 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 89 coord.: 0.3333333 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579935 meV Im[Sigma]= 60.620617 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301194 meV Im[Sigma]= 65.093405 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604287 meV Im[Sigma]= 39.545140 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354888 meV Im[Sigma]= 124.562010 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 90 coord.: 0.3333333 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305295 meV Im[Sigma]= 56.075393 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714392 meV Im[Sigma]= 56.832482 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546311 meV Im[Sigma]= 82.755404 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241860 meV Im[Sigma]= 80.024428 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 91 coord.: 0.3333333 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220231 meV Im[Sigma]= 56.066484 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333056 meV Im[Sigma]= 57.066957 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004668 meV Im[Sigma]= 83.963375 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796205 meV Im[Sigma]= 78.111272 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 92 coord.: 0.3333333 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720859 meV Im[Sigma]= 72.549570 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814062 meV Im[Sigma]= 49.833096 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489438 meV Im[Sigma]= 87.637175 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724986 meV Im[Sigma]= 142.112640 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 93 coord.: 0.3333333 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564697 meV Im[Sigma]= 68.247667 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255491 meV Im[Sigma]= 57.760025 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487985 meV Im[Sigma]= 121.319237 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740685 meV Im[Sigma]= 161.646438 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 94 coord.: 0.3333333 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205359 meV Im[Sigma]= 62.539152 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484171 meV Im[Sigma]= 65.234144 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755228 meV Im[Sigma]= 134.097703 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528266 meV Im[Sigma]= 142.414146 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 95 coord.: 0.3333333 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808845 meV Im[Sigma]= 61.803174 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747648 meV Im[Sigma]= 66.398426 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527608 meV Im[Sigma]= 76.766862 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744318 meV Im[Sigma]= 111.080414 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 96 coord.: 0.3333333 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870846 meV Im[Sigma]= 79.954225 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492396 meV Im[Sigma]= 75.573765 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339334 meV Im[Sigma]= 41.486214 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462600 meV Im[Sigma]= 78.066606 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 97 coord.: 0.3333333 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524817 meV Im[Sigma]= 60.327728 meV Z= 1.003539 lam= -0.003526
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928135 meV Im[Sigma]= 64.846731 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042150 meV Im[Sigma]= 40.766309 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675103 meV Im[Sigma]= 121.274827 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 98 coord.: 0.3333333 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540785 meV Im[Sigma]= 61.499509 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454810 meV Im[Sigma]= 66.904999 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849506 meV Im[Sigma]= 76.188408 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263380 meV Im[Sigma]= 108.408226 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 99 coord.: 0.3333333 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524823 meV Im[Sigma]= 60.327781 meV Z= 1.003539 lam= -0.003527
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928087 meV Im[Sigma]= 64.846738 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042159 meV Im[Sigma]= 40.766336 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675066 meV Im[Sigma]= 121.274845 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 100 coord.: 0.3333333 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865184 meV Im[Sigma]= 61.528375 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501745 meV Im[Sigma]= 67.451651 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378182 meV Im[Sigma]= 76.056410 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810834 meV Im[Sigma]= 109.181733 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 101 coord.: 0.3333333 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579935 meV Im[Sigma]= 60.620619 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301196 meV Im[Sigma]= 65.093406 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604272 meV Im[Sigma]= 39.545137 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354883 meV Im[Sigma]= 124.562004 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 102 coord.: 0.3333333 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865168 meV Im[Sigma]= 61.528416 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501738 meV Im[Sigma]= 67.451532 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378247 meV Im[Sigma]= 76.056353 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810859 meV Im[Sigma]= 109.181788 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 103 coord.: 0.3333333 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564688 meV Im[Sigma]= 68.247707 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255470 meV Im[Sigma]= 57.759977 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487950 meV Im[Sigma]= 121.319289 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740643 meV Im[Sigma]= 161.646331 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 104 coord.: 0.3333333 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720862 meV Im[Sigma]= 72.549627 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814032 meV Im[Sigma]= 49.833033 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489410 meV Im[Sigma]= 87.637223 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725057 meV Im[Sigma]= 142.112572 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 105 coord.: 0.3333333 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220256 meV Im[Sigma]= 56.066637 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333041 meV Im[Sigma]= 57.066884 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004627 meV Im[Sigma]= 83.963542 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796197 meV Im[Sigma]= 78.111342 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 106 coord.: 0.3333333 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870813 meV Im[Sigma]= 79.954186 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492357 meV Im[Sigma]= 75.573745 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339367 meV Im[Sigma]= 41.486204 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462589 meV Im[Sigma]= 78.066718 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 107 coord.: 0.3333333 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808850 meV Im[Sigma]= 61.803176 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747640 meV Im[Sigma]= 66.398424 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527631 meV Im[Sigma]= 76.766876 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744306 meV Im[Sigma]= 111.080435 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 108 coord.: 0.3333333 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205364 meV Im[Sigma]= 62.539266 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484186 meV Im[Sigma]= 65.234021 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755217 meV Im[Sigma]= 134.097691 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528270 meV Im[Sigma]= 142.414275 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 109 coord.: 0.5000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.6077 eV Re[Sigma]= -40.964616 meV Im[Sigma]= 59.572071 meV Z= 1.004764 lam= -0.004741
|
|
E( 2 )= -14.0678 eV Re[Sigma]= -10.055501 meV Im[Sigma]= 62.457335 meV Z= 1.003648 lam= -0.003634
|
|
E( 3 )= -2.9614 eV Re[Sigma]= 54.147026 meV Im[Sigma]= 173.016101 meV Z= 1.045793 lam= -0.043788
|
|
E( 4 )= -2.9614 eV Re[Sigma]= 54.147026 meV Im[Sigma]= 173.016101 meV Z= 1.045793 lam= -0.043788
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 110 coord.: 0.5000000 0.0000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205369 meV Im[Sigma]= 62.539266 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484181 meV Im[Sigma]= 65.234023 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755230 meV Im[Sigma]= 134.097674 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528267 meV Im[Sigma]= 142.414219 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 111 coord.: 0.5000000 0.0000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305314 meV Im[Sigma]= 56.075419 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714378 meV Im[Sigma]= 56.832430 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546338 meV Im[Sigma]= 82.755352 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241843 meV Im[Sigma]= 80.024460 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 112 coord.: 0.5000000 0.0000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.8708 eV Re[Sigma]= -28.996932 meV Im[Sigma]= 63.140607 meV Z= 1.000478 lam= -0.000478
|
|
E( 2 )= -11.9934 eV Re[Sigma]= -20.805050 meV Im[Sigma]= 78.313968 meV Z= 1.012449 lam= -0.012296
|
|
E( 3 )= -6.9896 eV Re[Sigma]= -4.186820 meV Im[Sigma]= 69.999854 meV Z= 1.014672 lam= -0.014460
|
|
E( 4 )= -6.9896 eV Re[Sigma]= -4.186820 meV Im[Sigma]= 69.999854 meV Z= 1.014672 lam= -0.014460
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 113 coord.: 0.5000000 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305292 meV Im[Sigma]= 56.075396 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714421 meV Im[Sigma]= 56.832503 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546348 meV Im[Sigma]= 82.755411 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241865 meV Im[Sigma]= 80.024430 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 114 coord.: 0.5000000 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205356 meV Im[Sigma]= 62.539150 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484182 meV Im[Sigma]= 65.234142 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755224 meV Im[Sigma]= 134.097704 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528255 meV Im[Sigma]= 142.414144 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 115 coord.: 0.5000000 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222521 meV Im[Sigma]= 63.284676 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337012 meV Im[Sigma]= 65.620294 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103867 meV Im[Sigma]= 135.507051 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246818 meV Im[Sigma]= 140.526081 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 116 coord.: 0.5000000 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621544 meV Im[Sigma]= 68.209780 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103267 meV Im[Sigma]= 57.852422 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340352 meV Im[Sigma]= 120.235593 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263235 meV Im[Sigma]= 163.894434 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 117 coord.: 0.5000000 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835586 meV Im[Sigma]= 72.504510 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613285 meV Im[Sigma]= 50.529522 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879540 meV Im[Sigma]= 87.562176 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625828 meV Im[Sigma]= 143.145736 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 118 coord.: 0.5000000 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506746 meV Im[Sigma]= 56.052330 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769406 meV Im[Sigma]= 57.167529 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406280 meV Im[Sigma]= 84.735355 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762840 meV Im[Sigma]= 78.308841 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 119 coord.: 0.5000000 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870845 meV Im[Sigma]= 79.954236 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492396 meV Im[Sigma]= 75.573767 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339332 meV Im[Sigma]= 41.486213 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462600 meV Im[Sigma]= 78.066609 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 120 coord.: 0.5000000 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865181 meV Im[Sigma]= 61.528376 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501746 meV Im[Sigma]= 67.451654 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378188 meV Im[Sigma]= 76.056414 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810839 meV Im[Sigma]= 109.181704 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 121 coord.: 0.5000000 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506757 meV Im[Sigma]= 56.052397 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769390 meV Im[Sigma]= 57.167487 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406310 meV Im[Sigma]= 84.735494 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762814 meV Im[Sigma]= 78.308792 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 122 coord.: 0.5000000 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835606 meV Im[Sigma]= 72.504462 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613289 meV Im[Sigma]= 50.529540 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879552 meV Im[Sigma]= 87.562222 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625828 meV Im[Sigma]= 143.145676 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 123 coord.: 0.5000000 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621492 meV Im[Sigma]= 68.209698 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103249 meV Im[Sigma]= 57.852398 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340381 meV Im[Sigma]= 120.235668 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263282 meV Im[Sigma]= 163.894389 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 124 coord.: 0.5000000 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222457 meV Im[Sigma]= 63.284591 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337007 meV Im[Sigma]= 65.620229 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103861 meV Im[Sigma]= 135.507247 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246879 meV Im[Sigma]= 140.526000 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 125 coord.: 0.5000000 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865167 meV Im[Sigma]= 61.528418 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501742 meV Im[Sigma]= 67.451541 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378231 meV Im[Sigma]= 76.056352 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810866 meV Im[Sigma]= 109.181785 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 126 coord.: 0.5000000 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870811 meV Im[Sigma]= 79.954190 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492357 meV Im[Sigma]= 75.573747 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339358 meV Im[Sigma]= 41.486204 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462585 meV Im[Sigma]= 78.066724 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 127 coord.: 0.5000000 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.8708 eV Re[Sigma]= -28.996934 meV Im[Sigma]= 63.140608 meV Z= 1.000478 lam= -0.000478
|
|
E( 2 )= -11.9934 eV Re[Sigma]= -20.805055 meV Im[Sigma]= 78.313971 meV Z= 1.012449 lam= -0.012296
|
|
E( 3 )= -6.9896 eV Re[Sigma]= -4.186823 meV Im[Sigma]= 69.999851 meV Z= 1.014672 lam= -0.014460
|
|
E( 4 )= -6.9896 eV Re[Sigma]= -4.186823 meV Im[Sigma]= 69.999851 meV Z= 1.014672 lam= -0.014460
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 128 coord.: 0.5000000 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305306 meV Im[Sigma]= 56.075393 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714395 meV Im[Sigma]= 56.832478 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546323 meV Im[Sigma]= 82.755397 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241860 meV Im[Sigma]= 80.024426 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 129 coord.: 0.5000000 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205363 meV Im[Sigma]= 62.539153 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484171 meV Im[Sigma]= 65.234132 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755225 meV Im[Sigma]= 134.097690 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528265 meV Im[Sigma]= 142.414140 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 130 coord.: 0.5000000 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.6077 eV Re[Sigma]= -40.964615 meV Im[Sigma]= 59.572073 meV Z= 1.004764 lam= -0.004741
|
|
E( 2 )= -14.0678 eV Re[Sigma]= -10.055504 meV Im[Sigma]= 62.457332 meV Z= 1.003648 lam= -0.003634
|
|
E( 3 )= -2.9614 eV Re[Sigma]= 54.147035 meV Im[Sigma]= 173.016119 meV Z= 1.045793 lam= -0.043788
|
|
E( 4 )= -2.9614 eV Re[Sigma]= 54.147035 meV Im[Sigma]= 173.016119 meV Z= 1.045793 lam= -0.043788
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 131 coord.: 0.5000000 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205363 meV Im[Sigma]= 62.539267 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484198 meV Im[Sigma]= 65.234023 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755236 meV Im[Sigma]= 134.097693 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528267 meV Im[Sigma]= 142.414242 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 132 coord.: 0.5000000 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305307 meV Im[Sigma]= 56.075423 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714406 meV Im[Sigma]= 56.832456 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546354 meV Im[Sigma]= 82.755358 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241851 meV Im[Sigma]= 80.024462 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 133 coord.: 0.5000000 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506744 meV Im[Sigma]= 56.052333 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769436 meV Im[Sigma]= 57.167539 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406285 meV Im[Sigma]= 84.735333 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762874 meV Im[Sigma]= 78.308870 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 134 coord.: 0.5000000 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870842 meV Im[Sigma]= 79.954229 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492400 meV Im[Sigma]= 75.573767 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339341 meV Im[Sigma]= 41.486213 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462605 meV Im[Sigma]= 78.066602 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 135 coord.: 0.5000000 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865185 meV Im[Sigma]= 61.528377 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501751 meV Im[Sigma]= 67.451640 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378179 meV Im[Sigma]= 76.056404 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810833 meV Im[Sigma]= 109.181717 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 136 coord.: 0.5000000 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222521 meV Im[Sigma]= 63.284669 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337030 meV Im[Sigma]= 65.620283 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103872 meV Im[Sigma]= 135.507052 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246821 meV Im[Sigma]= 140.526142 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 137 coord.: 0.5000000 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621543 meV Im[Sigma]= 68.209780 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103290 meV Im[Sigma]= 57.852416 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340340 meV Im[Sigma]= 120.235633 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263233 meV Im[Sigma]= 163.894433 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 138 coord.: 0.5000000 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835591 meV Im[Sigma]= 72.504510 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613318 meV Im[Sigma]= 50.529533 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879564 meV Im[Sigma]= 87.562188 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625811 meV Im[Sigma]= 143.145741 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 139 coord.: 0.5000000 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.222459 meV Im[Sigma]= 63.284587 meV Z= 1.004601 lam= -0.004580
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.337018 meV Im[Sigma]= 65.620228 meV Z= 1.008719 lam= -0.008644
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.103857 meV Im[Sigma]= 135.507239 meV Z= 1.018357 lam= -0.018026
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.246875 meV Im[Sigma]= 140.526015 meV Z= 1.024754 lam= -0.024156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 140 coord.: 0.5000000 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865166 meV Im[Sigma]= 61.528416 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501745 meV Im[Sigma]= 67.451529 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378227 meV Im[Sigma]= 76.056340 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810863 meV Im[Sigma]= 109.181781 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 141 coord.: 0.5000000 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870808 meV Im[Sigma]= 79.954187 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492358 meV Im[Sigma]= 75.573745 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339368 meV Im[Sigma]= 41.486206 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462592 meV Im[Sigma]= 78.066716 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 142 coord.: 0.5000000 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.506748 meV Im[Sigma]= 56.052402 meV Z= 1.000150 lam= -0.000150
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.769424 meV Im[Sigma]= 57.167496 meV Z= 1.000424 lam= -0.000424
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.406308 meV Im[Sigma]= 84.735478 meV Z= 1.018884 lam= -0.018534
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.762850 meV Im[Sigma]= 78.308825 meV Z= 1.002730 lam= -0.002723
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 143 coord.: 0.5000000 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835606 meV Im[Sigma]= 72.504458 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613325 meV Im[Sigma]= 50.529557 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879571 meV Im[Sigma]= 87.562225 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625816 meV Im[Sigma]= 143.145700 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 144 coord.: 0.5000000 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621492 meV Im[Sigma]= 68.209695 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103262 meV Im[Sigma]= 57.852398 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340372 meV Im[Sigma]= 120.235691 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263283 meV Im[Sigma]= 163.894401 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 145 coord.: 0.6666667 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.337338 meV Im[Sigma]= 40.533123 meV Z= 1.002330 lam= -0.002325
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -13.643006 meV Im[Sigma]= 49.627197 meV Z= 0.997292 lam= 0.002716
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 96.622509 meV Im[Sigma]= 145.974766 meV Z= 1.021934 lam= -0.021464
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 96.622509 meV Im[Sigma]= 145.974766 meV Z= 1.021934 lam= -0.021464
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 146 coord.: 0.6666667 0.0000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621488 meV Im[Sigma]= 68.209687 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103261 meV Im[Sigma]= 57.852397 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340382 meV Im[Sigma]= 120.235654 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263279 meV Im[Sigma]= 163.894399 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 147 coord.: 0.6666667 0.0000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579931 meV Im[Sigma]= 60.620619 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301196 meV Im[Sigma]= 65.093404 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604276 meV Im[Sigma]= 39.545130 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354884 meV Im[Sigma]= 124.562006 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 148 coord.: 0.6666667 0.0000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305292 meV Im[Sigma]= 56.075401 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714408 meV Im[Sigma]= 56.832496 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546362 meV Im[Sigma]= 82.755408 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241865 meV Im[Sigma]= 80.024428 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 149 coord.: 0.6666667 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928420 meV Im[Sigma]= 42.126547 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655573 meV Im[Sigma]= 108.547040 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859898 meV Im[Sigma]= 106.352030 meV Z= 1.019113 lam= -0.018755
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859898 meV Im[Sigma]= 106.352030 meV Z= 1.019113 lam= -0.018755
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 150 coord.: 0.6666667 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013538 meV Im[Sigma]= 43.222783 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958255 meV Im[Sigma]= 102.188089 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271315 meV Im[Sigma]= 167.529135 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473158 meV Im[Sigma]= 167.234069 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 151 coord.: 0.6666667 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564692 meV Im[Sigma]= 68.247667 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255496 meV Im[Sigma]= 57.760024 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487976 meV Im[Sigma]= 121.319235 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740662 meV Im[Sigma]= 161.646396 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 152 coord.: 0.6666667 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205353 meV Im[Sigma]= 62.539149 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484174 meV Im[Sigma]= 65.234135 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755224 meV Im[Sigma]= 134.097640 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528258 meV Im[Sigma]= 142.414154 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 153 coord.: 0.6666667 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808843 meV Im[Sigma]= 61.803173 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747643 meV Im[Sigma]= 66.398415 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527603 meV Im[Sigma]= 76.766865 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744313 meV Im[Sigma]= 111.080418 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 154 coord.: 0.6666667 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870846 meV Im[Sigma]= 79.954228 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492394 meV Im[Sigma]= 75.573764 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339340 meV Im[Sigma]= 41.486211 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462606 meV Im[Sigma]= 78.066612 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 155 coord.: 0.6666667 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220226 meV Im[Sigma]= 56.066486 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333073 meV Im[Sigma]= 57.066966 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004672 meV Im[Sigma]= 83.963365 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796247 meV Im[Sigma]= 78.111307 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 156 coord.: 0.6666667 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720857 meV Im[Sigma]= 72.549565 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814085 meV Im[Sigma]= 49.833103 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489453 meV Im[Sigma]= 87.637184 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724974 meV Im[Sigma]= 142.112654 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 157 coord.: 0.6666667 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524823 meV Im[Sigma]= 60.327782 meV Z= 1.003539 lam= -0.003527
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928084 meV Im[Sigma]= 64.846736 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042167 meV Im[Sigma]= 40.766337 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675070 meV Im[Sigma]= 121.274830 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 158 coord.: 0.6666667 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865181 meV Im[Sigma]= 61.528374 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501736 meV Im[Sigma]= 67.451652 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378177 meV Im[Sigma]= 76.056403 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810836 meV Im[Sigma]= 109.181710 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 159 coord.: 0.6666667 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579935 meV Im[Sigma]= 60.620618 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301195 meV Im[Sigma]= 65.093406 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604289 meV Im[Sigma]= 39.545139 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354885 meV Im[Sigma]= 124.562013 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 160 coord.: 0.6666667 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865167 meV Im[Sigma]= 61.528415 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501739 meV Im[Sigma]= 67.451537 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378235 meV Im[Sigma]= 76.056354 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810858 meV Im[Sigma]= 109.181789 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 161 coord.: 0.6666667 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.524815 meV Im[Sigma]= 60.327728 meV Z= 1.003539 lam= -0.003526
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -14.928135 meV Im[Sigma]= 64.846734 meV Z= 1.006733 lam= -0.006688
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.042150 meV Im[Sigma]= 40.766311 meV Z= 0.996246 lam= 0.003769
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 11.675100 meV Im[Sigma]= 121.274839 meV Z= 1.015918 lam= -0.015669
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 162 coord.: 0.6666667 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540790 meV Im[Sigma]= 61.499511 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454806 meV Im[Sigma]= 66.904998 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849510 meV Im[Sigma]= 76.188409 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263382 meV Im[Sigma]= 108.408247 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 163 coord.: 0.6666667 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.220252 meV Im[Sigma]= 56.066642 meV Z= 1.000168 lam= -0.000168
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.333058 meV Im[Sigma]= 57.066894 meV Z= 1.000464 lam= -0.000464
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -11.004624 meV Im[Sigma]= 83.963508 meV Z= 1.018399 lam= -0.018067
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -4.796235 meV Im[Sigma]= 78.111371 meV Z= 1.002530 lam= -0.002523
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 164 coord.: 0.6666667 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870807 meV Im[Sigma]= 79.954191 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492359 meV Im[Sigma]= 75.573745 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339368 meV Im[Sigma]= 41.486201 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462594 meV Im[Sigma]= 78.066713 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 165 coord.: 0.6666667 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808845 meV Im[Sigma]= 61.803175 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747644 meV Im[Sigma]= 66.398417 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527605 meV Im[Sigma]= 76.766865 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744309 meV Im[Sigma]= 111.080426 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 166 coord.: 0.6666667 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205361 meV Im[Sigma]= 62.539264 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484192 meV Im[Sigma]= 65.234016 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755229 meV Im[Sigma]= 134.097700 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528263 meV Im[Sigma]= 142.414265 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 167 coord.: 0.6666667 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.564684 meV Im[Sigma]= 68.247710 meV Z= 1.015117 lam= -0.014892
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.255477 meV Im[Sigma]= 57.759975 meV Z= 1.005393 lam= -0.005364
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 0.487945 meV Im[Sigma]= 121.319293 meV Z= 1.022859 lam= -0.022348
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.740646 meV Im[Sigma]= 161.646342 meV Z= 1.042871 lam= -0.041109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 168 coord.: 0.6666667 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720861 meV Im[Sigma]= 72.549628 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814046 meV Im[Sigma]= 49.833040 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489428 meV Im[Sigma]= 87.637203 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725049 meV Im[Sigma]= 142.112602 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 169 coord.: 0.6666667 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -17.3646 eV Re[Sigma]= -58.928431 meV Im[Sigma]= 42.126579 meV Z= 0.994716 lam= 0.005312
|
|
E( 2 )= -6.7590 eV Re[Sigma]= -15.655590 meV Im[Sigma]= 108.546956 meV Z= 1.011615 lam= -0.011482
|
|
E( 3 )= -5.2110 eV Re[Sigma]= 2.859922 meV Im[Sigma]= 106.351989 meV Z= 1.019113 lam= -0.018754
|
|
E( 4 )= -5.2110 eV Re[Sigma]= 2.859922 meV Im[Sigma]= 106.351989 meV Z= 1.019113 lam= -0.018754
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 170 coord.: 0.6666667 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305307 meV Im[Sigma]= 56.075424 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714390 meV Im[Sigma]= 56.832451 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546382 meV Im[Sigma]= 82.755356 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241856 meV Im[Sigma]= 80.024466 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 171 coord.: 0.6666667 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.7489 eV Re[Sigma]= -39.579932 meV Im[Sigma]= 60.620620 meV Z= 1.003810 lam= -0.003796
|
|
E( 2 )= -10.6632 eV Re[Sigma]= -15.301198 meV Im[Sigma]= 65.093404 meV Z= 1.006752 lam= -0.006706
|
|
E( 3 )= -9.4579 eV Re[Sigma]= 2.604277 meV Im[Sigma]= 39.545131 meV Z= 0.995881 lam= 0.004136
|
|
E( 4 )= -4.5555 eV Re[Sigma]= 12.354885 meV Im[Sigma]= 124.562010 meV Z= 1.016621 lam= -0.016350
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 172 coord.: 0.6666667 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621535 meV Im[Sigma]= 68.209772 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103285 meV Im[Sigma]= 57.852414 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340355 meV Im[Sigma]= 120.235614 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263251 meV Im[Sigma]= 163.894463 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 173 coord.: 0.6666667 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.3978 eV Re[Sigma]= -56.337421 meV Im[Sigma]= 40.533087 meV Z= 1.002330 lam= -0.002325
|
|
E( 2 )= -9.2191 eV Re[Sigma]= -13.642944 meV Im[Sigma]= 49.627187 meV Z= 0.997292 lam= 0.002716
|
|
E( 3 )= -2.0907 eV Re[Sigma]= 96.622516 meV Im[Sigma]= 145.974912 meV Z= 1.021934 lam= -0.021464
|
|
E( 4 )= -2.0907 eV Re[Sigma]= 96.622516 meV Im[Sigma]= 145.974912 meV Z= 1.021934 lam= -0.021464
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 174 coord.: 0.6666667 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013567 meV Im[Sigma]= 43.222866 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958151 meV Im[Sigma]= 102.187992 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271339 meV Im[Sigma]= 167.529247 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473075 meV Im[Sigma]= 167.234148 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 175 coord.: 0.6666667 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004729 meV Im[Sigma]= 43.008392 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492983 meV Im[Sigma]= 103.623497 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956527 meV Im[Sigma]= 163.844933 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524234 meV Im[Sigma]= 170.822056 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 176 coord.: 0.6666667 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835587 meV Im[Sigma]= 72.504499 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613301 meV Im[Sigma]= 50.529536 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879559 meV Im[Sigma]= 87.562201 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625810 meV Im[Sigma]= 143.145776 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 177 coord.: 0.6666667 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.808845 meV Im[Sigma]= 61.803176 meV Z= 1.001409 lam= -0.001407
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.747631 meV Im[Sigma]= 66.398424 meV Z= 1.009667 lam= -0.009575
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.527640 meV Im[Sigma]= 76.766891 meV Z= 1.006441 lam= -0.006400
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 1.744315 meV Im[Sigma]= 111.080412 meV Z= 1.020936 lam= -0.020506
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 178 coord.: 0.6666667 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835602 meV Im[Sigma]= 72.504454 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613309 meV Im[Sigma]= 50.529558 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879568 meV Im[Sigma]= 87.562237 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625811 meV Im[Sigma]= 143.145701 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 179 coord.: 0.6666667 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.004786 meV Im[Sigma]= 43.008213 meV Z= 1.007519 lam= -0.007463
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.492858 meV Im[Sigma]= 103.623576 meV Z= 1.018620 lam= -0.018280
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.956555 meV Im[Sigma]= 163.845069 meV Z= 1.034365 lam= -0.033223
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.524073 meV Im[Sigma]= 170.822172 meV Z= 1.043890 lam= -0.042045
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 180 coord.: 0.6666667 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034045 meV Im[Sigma]= 34.911983 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131592 meV Im[Sigma]= 135.235438 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453895 meV Im[Sigma]= 173.776014 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886502 meV Im[Sigma]= 86.616301 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 181 coord.: 0.8333333 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.522205 meV Im[Sigma]= 15.299058 meV Z= 0.997612 lam= 0.002394
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 91.316790 meV Im[Sigma]= 184.014413 meV Z= 1.046154 lam= -0.044117
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 133.604808 meV Im[Sigma]= 76.853779 meV Z= 1.002107 lam= -0.002102
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 133.604808 meV Im[Sigma]= 76.853779 meV Z= 1.002107 lam= -0.002102
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 182 coord.: 0.8333333 0.0000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034048 meV Im[Sigma]= 34.911996 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131560 meV Im[Sigma]= 135.235387 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453896 meV Im[Sigma]= 173.775997 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886526 meV Im[Sigma]= 86.616324 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 183 coord.: 0.8333333 0.0000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621542 meV Im[Sigma]= 68.209785 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103262 meV Im[Sigma]= 57.852422 meV Z= 1.005376 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340367 meV Im[Sigma]= 120.235616 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263249 meV Im[Sigma]= 163.894456 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 184 coord.: 0.8333333 0.0000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205353 meV Im[Sigma]= 62.539156 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484168 meV Im[Sigma]= 65.234138 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755230 meV Im[Sigma]= 134.097707 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528254 meV Im[Sigma]= 142.414146 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 185 coord.: 0.8333333 0.0000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013529 meV Im[Sigma]= 43.222793 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958224 meV Im[Sigma]= 102.188085 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271313 meV Im[Sigma]= 167.529124 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473157 meV Im[Sigma]= 167.234100 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 186 coord.: 0.8333333 0.0000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353198 meV Im[Sigma]= 17.271963 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918124 meV Im[Sigma]= 132.880512 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245291 meV Im[Sigma]= 113.308705 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245291 meV Im[Sigma]= 113.308705 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 187 coord.: 0.8333333 0.1666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083445 meV Im[Sigma]= 34.876209 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.541009 meV Im[Sigma]= 135.931660 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611718 meV Im[Sigma]= 170.381688 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502365 meV Im[Sigma]= 85.833213 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 188 coord.: 0.8333333 0.1666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013530 meV Im[Sigma]= 43.222800 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958215 meV Im[Sigma]= 102.188087 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271317 meV Im[Sigma]= 167.529117 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473132 meV Im[Sigma]= 167.234025 meV Z= 1.042446 lam= -0.040717
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 189 coord.: 0.8333333 0.1666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835600 meV Im[Sigma]= 72.504465 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613289 meV Im[Sigma]= 50.529548 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879557 meV Im[Sigma]= 87.562225 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625825 meV Im[Sigma]= 143.145681 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 190 coord.: 0.8333333 0.1666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865175 meV Im[Sigma]= 61.528375 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501747 meV Im[Sigma]= 67.451647 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378192 meV Im[Sigma]= 76.056415 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810835 meV Im[Sigma]= 109.181715 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 191 coord.: 0.8333333 0.1666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720856 meV Im[Sigma]= 72.549565 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814071 meV Im[Sigma]= 49.833100 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489459 meV Im[Sigma]= 87.637192 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724966 meV Im[Sigma]= 142.112670 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 192 coord.: 0.8333333 0.1666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103079 meV Im[Sigma]= 43.282658 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692286 meV Im[Sigma]= 102.511827 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487774 meV Im[Sigma]= 163.651760 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229136 meV Im[Sigma]= 166.718491 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 193 coord.: 0.8333333 0.3333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635471 meV Im[Sigma]= 68.663094 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173981 meV Im[Sigma]= 57.645904 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807813 meV Im[Sigma]= 119.639454 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839680 meV Im[Sigma]= 161.382379 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 194 coord.: 0.8333333 0.3333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720854 meV Im[Sigma]= 72.549571 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814066 meV Im[Sigma]= 49.833095 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489438 meV Im[Sigma]= 87.637190 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.724985 meV Im[Sigma]= 142.112622 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 195 coord.: 0.8333333 0.3333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305299 meV Im[Sigma]= 56.075392 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714394 meV Im[Sigma]= 56.832482 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546312 meV Im[Sigma]= 82.755401 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241862 meV Im[Sigma]= 80.024448 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 196 coord.: 0.8333333 0.3333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870816 meV Im[Sigma]= 79.954193 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492361 meV Im[Sigma]= 75.573745 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339369 meV Im[Sigma]= 41.486204 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462589 meV Im[Sigma]= 78.066735 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 197 coord.: 0.8333333 0.3333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540792 meV Im[Sigma]= 61.499513 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454815 meV Im[Sigma]= 66.905003 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849527 meV Im[Sigma]= 76.188409 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263379 meV Im[Sigma]= 108.408243 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 198 coord.: 0.8333333 0.3333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865283 meV Im[Sigma]= 63.143315 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.545026 meV Im[Sigma]= 65.716375 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.060033 meV Im[Sigma]= 133.531520 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408018 meV Im[Sigma]= 139.502510 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 199 coord.: 0.8333333 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -39.865308 meV Im[Sigma]= 63.143242 meV Z= 1.004350 lam= -0.004331
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.544949 meV Im[Sigma]= 65.716415 meV Z= 1.008844 lam= -0.008767
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 13.059983 meV Im[Sigma]= 133.531510 meV Z= 1.018110 lam= -0.017787
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.408084 meV Im[Sigma]= 139.502362 meV Z= 1.024600 lam= -0.024009
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 200 coord.: 0.8333333 0.5000000 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.540786 meV Im[Sigma]= 61.499512 meV Z= 1.001086 lam= -0.001085
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.454815 meV Im[Sigma]= 66.904993 meV Z= 1.010113 lam= -0.010012
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -18.849502 meV Im[Sigma]= 76.188404 meV Z= 1.006297 lam= -0.006257
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 3.263380 meV Im[Sigma]= 108.408229 meV Z= 1.020209 lam= -0.019809
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 201 coord.: 0.8333333 0.5000000 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -12.0052 eV Re[Sigma]= -24.870848 meV Im[Sigma]= 79.954235 meV Z= 1.015946 lam= -0.015696
|
|
E( 2 )= -11.7636 eV Re[Sigma]= -23.492399 meV Im[Sigma]= 75.573765 meV Z= 1.006778 lam= -0.006733
|
|
E( 3 )= -8.4117 eV Re[Sigma]= -8.339346 meV Im[Sigma]= 41.486220 meV Z= 0.992729 lam= 0.007324
|
|
E( 4 )= -7.0563 eV Re[Sigma]= -3.462606 meV Im[Sigma]= 78.066609 meV Z= 1.016948 lam= -0.016665
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 202 coord.: 0.8333333 0.5000000 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -14.5793 eV Re[Sigma]= -37.305304 meV Im[Sigma]= 56.075424 meV Z= 1.000191 lam= -0.000191
|
|
E( 2 )= -10.2664 eV Re[Sigma]= -12.714420 meV Im[Sigma]= 56.832448 meV Z= 1.000355 lam= -0.000355
|
|
E( 3 )= -7.2955 eV Re[Sigma]= -10.546353 meV Im[Sigma]= 82.755357 meV Z= 1.018010 lam= -0.017692
|
|
E( 4 )= -5.9070 eV Re[Sigma]= -5.241883 meV Im[Sigma]= 80.024501 meV Z= 1.002837 lam= -0.002829
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 203 coord.: 0.8333333 0.5000000 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720860 meV Im[Sigma]= 72.549624 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814065 meV Im[Sigma]= 49.833044 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489445 meV Im[Sigma]= 87.637217 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725037 meV Im[Sigma]= 142.112621 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 204 coord.: 0.8333333 0.5000000 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.635476 meV Im[Sigma]= 68.663003 meV Z= 1.015239 lam= -0.015010
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.173929 meV Im[Sigma]= 57.645838 meV Z= 1.005261 lam= -0.005233
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.807857 meV Im[Sigma]= 119.639346 meV Z= 1.022489 lam= -0.021994
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 70.839755 meV Im[Sigma]= 161.382310 meV Z= 1.042851 lam= -0.041090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 205 coord.: 0.8333333 0.6666667 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.103101 meV Im[Sigma]= 43.282605 meV Z= 1.007631 lam= -0.007573
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -11.692283 meV Im[Sigma]= 102.511948 meV Z= 1.017928 lam= -0.017612
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 46.487696 meV Im[Sigma]= 163.651549 meV Z= 1.034583 lam= -0.033427
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.229239 meV Im[Sigma]= 166.718320 meV Z= 1.042258 lam= -0.040545
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 206 coord.: 0.8333333 0.6666667 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.720857 meV Im[Sigma]= 72.549624 meV Z= 1.014355 lam= -0.014151
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.814035 meV Im[Sigma]= 49.833034 meV Z= 0.996141 lam= 0.003874
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.489434 meV Im[Sigma]= 87.637218 meV Z= 1.015650 lam= -0.015409
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.725033 meV Im[Sigma]= 142.112608 meV Z= 1.024786 lam= -0.024187
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 207 coord.: 0.8333333 0.6666667 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -13.5072 eV Re[Sigma]= -42.865158 meV Im[Sigma]= 61.528420 meV Z= 1.001109 lam= -0.001108
|
|
E( 2 )= -11.9153 eV Re[Sigma]= -4.501734 meV Im[Sigma]= 67.451538 meV Z= 1.010417 lam= -0.010310
|
|
E( 3 )= -7.7465 eV Re[Sigma]= -19.378264 meV Im[Sigma]= 76.056364 meV Z= 1.006225 lam= -0.006186
|
|
E( 4 )= -5.2565 eV Re[Sigma]= 2.810860 meV Im[Sigma]= 109.181775 meV Z= 1.020288 lam= -0.019884
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 208 coord.: 0.8333333 0.6666667 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.2688 eV Re[Sigma]= -48.835581 meV Im[Sigma]= 72.504503 meV Z= 1.014393 lam= -0.014189
|
|
E( 2 )= -8.9488 eV Re[Sigma]= -18.613312 meV Im[Sigma]= 50.529533 meV Z= 0.996386 lam= 0.003628
|
|
E( 3 )= -6.9060 eV Re[Sigma]= -4.879568 meV Im[Sigma]= 87.562193 meV Z= 1.015486 lam= -0.015250
|
|
E( 4 )= -3.9563 eV Re[Sigma]= 26.625796 meV Im[Sigma]= 143.145803 meV Z= 1.024969 lam= -0.024360
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 209 coord.: 0.8333333 0.6666667 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013552 meV Im[Sigma]= 43.222866 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958152 meV Im[Sigma]= 102.187995 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271324 meV Im[Sigma]= 167.529306 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473082 meV Im[Sigma]= 167.234203 meV Z= 1.042446 lam= -0.040718
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 210 coord.: 0.8333333 0.6666667 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.083493 meV Im[Sigma]= 34.876221 meV Z= 1.000936 lam= -0.000935
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -2.540920 meV Im[Sigma]= 135.931517 meV Z= 1.027848 lam= -0.027093
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.611737 meV Im[Sigma]= 170.381632 meV Z= 1.033357 lam= -0.032281
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 114.502325 meV Im[Sigma]= 85.833212 meV Z= 1.005284 lam= -0.005257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 211 coord.: 0.8333333 0.8333333 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.5714 eV Re[Sigma]= -65.353236 meV Im[Sigma]= 17.271916 meV Z= 0.996894 lam= 0.003115
|
|
E( 2 )= -1.7294 eV Re[Sigma]= 116.918061 meV Im[Sigma]= 132.880427 meV Z= 1.010075 lam= -0.009975
|
|
E( 3 )= -1.5590 eV Re[Sigma]= 114.245298 meV Im[Sigma]= 113.308699 meV Z= 1.005604 lam= -0.005573
|
|
E( 4 )= -1.5590 eV Re[Sigma]= 114.245298 meV Im[Sigma]= 113.308699 meV Z= 1.005604 lam= -0.005573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 212 coord.: 0.8333333 0.8333333 0.1666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -18.6527 eV Re[Sigma]= -59.013561 meV Im[Sigma]= 43.222872 meV Z= 1.007620 lam= -0.007562
|
|
E( 2 )= -6.9063 eV Re[Sigma]= -10.958122 meV Im[Sigma]= 102.187979 meV Z= 1.018021 lam= -0.017702
|
|
E( 3 )= -3.2910 eV Re[Sigma]= 47.271349 meV Im[Sigma]= 167.529254 meV Z= 1.035891 lam= -0.034647
|
|
E( 4 )= -2.6027 eV Re[Sigma]= 80.473085 meV Im[Sigma]= 167.234204 meV Z= 1.042446 lam= -0.040718
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 213 coord.: 0.8333333 0.8333333 0.3333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -15.5565 eV Re[Sigma]= -40.205359 meV Im[Sigma]= 62.539268 meV Z= 1.004137 lam= -0.004120
|
|
E( 2 )= -12.4383 eV Re[Sigma]= -11.484177 meV Im[Sigma]= 65.234028 meV Z= 1.008652 lam= -0.008578
|
|
E( 3 )= -4.5379 eV Re[Sigma]= 12.755233 meV Im[Sigma]= 134.097694 meV Z= 1.018132 lam= -0.017809
|
|
E( 4 )= -3.8929 eV Re[Sigma]= 24.528269 meV Im[Sigma]= 142.414248 meV Z= 1.025045 lam= -0.024433
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 214 coord.: 0.8333333 0.8333333 0.5000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -16.6105 eV Re[Sigma]= -54.621485 meV Im[Sigma]= 68.209706 meV Z= 1.015079 lam= -0.014855
|
|
E( 2 )= -10.7517 eV Re[Sigma]= -7.103244 meV Im[Sigma]= 57.852397 meV Z= 1.005375 lam= -0.005347
|
|
E( 3 )= -5.2472 eV Re[Sigma]= 1.340389 meV Im[Sigma]= 120.235677 meV Z= 1.022394 lam= -0.021904
|
|
E( 4 )= -2.6593 eV Re[Sigma]= 72.263289 meV Im[Sigma]= 163.894416 meV Z= 1.043274 lam= -0.041479
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 215 coord.: 0.8333333 0.8333333 0.6666667
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -19.4313 eV Re[Sigma]= -66.034042 meV Im[Sigma]= 34.911996 meV Z= 1.000969 lam= -0.000968
|
|
E( 2 )= -5.3692 eV Re[Sigma]= -1.131560 meV Im[Sigma]= 135.235432 meV Z= 1.027486 lam= -0.026751
|
|
E( 3 )= -3.4193 eV Re[Sigma]= 47.453895 meV Im[Sigma]= 173.775976 meV Z= 1.035222 lam= -0.034024
|
|
E( 4 )= -0.9512 eV Re[Sigma]= 116.886527 meV Im[Sigma]= 86.616319 meV Z= 1.004789 lam= -0.004766
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 216 coord.: 0.8333333 0.8333333 0.8333333
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -20.7958 eV Re[Sigma]= -65.522212 meV Im[Sigma]= 15.299010 meV Z= 0.997611 lam= 0.002394
|
|
E( 2 )= -2.5926 eV Re[Sigma]= 91.316794 meV Im[Sigma]= 184.013999 meV Z= 1.046153 lam= -0.044117
|
|
E( 3 )= -0.4527 eV Re[Sigma]= 133.604855 meV Im[Sigma]= 76.853818 meV Z= 1.002107 lam= -0.002102
|
|
E( 4 )= -0.4527 eV Re[Sigma]= 133.604855 meV Im[Sigma]= 76.853818 meV Z= 1.002107 lam= -0.002102
|
|
-------------------------------------------------------------------
|
|
|
|
1 1 -21.5330 -64.6722 6.8119 0.9934 0.0067
|
|
2 1 -20.7958 -65.5222 15.2990 0.9976 0.0024
|
|
3 1 -18.3978 -56.3374 40.5331 1.0023 -0.0023
|
|
4 1 -15.6077 -40.9646 59.5721 1.0048 -0.0047
|
|
5 1 -18.3978 -56.3373 40.5331 1.0023 -0.0023
|
|
6 1 -20.7958 -65.5222 15.2991 0.9976 0.0024
|
|
7 1 -20.7958 -65.4842 15.4070 0.9977 0.0023
|
|
8 1 -20.5714 -65.3532 17.2720 0.9969 0.0031
|
|
9 1 -18.6527 -59.0048 43.0082 1.0075 -0.0075
|
|
10 1 -15.5565 -40.2225 63.2847 1.0046 -0.0046
|
|
11 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
12 1 -19.4313 -66.0834 34.8762 1.0009 -0.0009
|
|
13 1 -18.3978 -56.5794 40.5526 1.0023 -0.0023
|
|
14 1 -18.6527 -59.1031 43.2827 1.0076 -0.0076
|
|
15 1 -17.3646 -58.9284 42.1266 0.9947 0.0053
|
|
16 1 -14.5793 -37.5068 56.0524 1.0002 -0.0002
|
|
17 1 -13.7489 -39.5248 60.3278 1.0035 -0.0035
|
|
18 1 -16.6105 -54.6355 68.6631 1.0152 -0.0150
|
|
19 1 -15.6077 -40.4536 58.9362 1.0042 -0.0042
|
|
20 1 -15.5565 -39.8653 63.1433 1.0043 -0.0043
|
|
21 1 -14.5793 -37.2202 56.0665 1.0002 -0.0002
|
|
22 1 -12.8708 -28.9969 63.1406 1.0005 -0.0005
|
|
23 1 -14.5793 -37.2203 56.0666 1.0002 -0.0002
|
|
24 1 -15.5565 -39.8653 63.1432 1.0043 -0.0043
|
|
25 1 -18.3978 -56.5793 40.5526 1.0023 -0.0023
|
|
26 1 -16.6105 -54.6355 68.6630 1.0152 -0.0150
|
|
27 1 -13.7489 -39.5248 60.3277 1.0035 -0.0035
|
|
28 1 -14.5793 -37.5067 56.0523 1.0002 -0.0002
|
|
29 1 -17.3646 -58.9284 42.1266 0.9947 0.0053
|
|
30 1 -18.6527 -59.1031 43.2826 1.0076 -0.0076
|
|
31 1 -20.7958 -65.4842 15.4069 0.9977 0.0023
|
|
32 1 -19.4313 -66.0835 34.8762 1.0009 -0.0009
|
|
33 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
34 1 -15.5565 -40.2224 63.2846 1.0046 -0.0046
|
|
35 1 -18.6527 -59.0047 43.0084 1.0075 -0.0075
|
|
36 1 -20.5714 -65.3532 17.2719 0.9969 0.0031
|
|
37 1 -20.7958 -65.5222 15.2990 0.9976 0.0024
|
|
38 1 -20.5714 -65.3532 17.2719 0.9969 0.0031
|
|
39 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
40 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
41 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
42 1 -19.4313 -66.0340 34.9120 1.0010 -0.0010
|
|
43 1 -20.5714 -65.3532 17.2720 0.9969 0.0031
|
|
44 1 -20.7958 -65.5222 15.2991 0.9976 0.0024
|
|
45 1 -19.4313 -66.0341 34.9120 1.0010 -0.0010
|
|
46 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
47 1 -15.5565 -40.2054 62.5391 1.0041 -0.0041
|
|
48 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
49 1 -18.6527 -59.1031 43.2827 1.0076 -0.0076
|
|
50 1 -19.4313 -66.0835 34.8762 1.0009 -0.0009
|
|
51 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
52 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
53 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
54 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
55 1 -15.5565 -39.8653 63.1433 1.0043 -0.0043
|
|
56 1 -16.6105 -54.6355 68.6631 1.0152 -0.0150
|
|
57 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
58 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
59 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
60 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
61 1 -16.6105 -54.6355 68.6630 1.0152 -0.0150
|
|
62 1 -15.5565 -39.8653 63.1432 1.0043 -0.0043
|
|
63 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
64 1 -12.0052 -24.8709 79.9542 1.0159 -0.0157
|
|
65 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
66 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
67 1 -19.4313 -66.0835 34.8762 1.0009 -0.0009
|
|
68 1 -18.6527 -59.1031 43.2826 1.0076 -0.0076
|
|
69 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
70 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
71 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
72 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
73 1 -18.3978 -56.3374 40.5331 1.0023 -0.0023
|
|
74 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
75 1 -17.3646 -58.9284 42.1266 0.9947 0.0053
|
|
76 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
77 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
78 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
79 1 -18.6527 -59.0048 43.0082 1.0075 -0.0075
|
|
80 1 -19.4313 -66.0341 34.9120 1.0010 -0.0010
|
|
81 1 -18.6527 -59.0047 43.0084 1.0075 -0.0075
|
|
82 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
83 1 -13.5072 -42.8088 61.8032 1.0014 -0.0014
|
|
84 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
85 1 -17.3646 -58.9284 42.1266 0.9947 0.0053
|
|
86 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
87 1 -18.3978 -56.3373 40.5331 1.0023 -0.0023
|
|
88 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
89 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
90 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
91 1 -14.5793 -37.2202 56.0665 1.0002 -0.0002
|
|
92 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
93 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
94 1 -15.5565 -40.2054 62.5392 1.0041 -0.0041
|
|
95 1 -13.5072 -42.8088 61.8032 1.0014 -0.0014
|
|
96 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
97 1 -13.7489 -39.5248 60.3277 1.0035 -0.0035
|
|
98 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
99 1 -13.7489 -39.5248 60.3278 1.0035 -0.0035
|
|
100 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
101 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
102 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
103 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
104 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
105 1 -14.5793 -37.2203 56.0666 1.0002 -0.0002
|
|
106 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
107 1 -13.5072 -42.8089 61.8032 1.0014 -0.0014
|
|
108 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
109 1 -15.6077 -40.9646 59.5721 1.0048 -0.0047
|
|
110 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
111 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
112 1 -12.8708 -28.9969 63.1406 1.0005 -0.0005
|
|
113 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
114 1 -15.5565 -40.2054 62.5391 1.0041 -0.0041
|
|
115 1 -15.5565 -40.2225 63.2847 1.0046 -0.0046
|
|
116 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
117 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
118 1 -14.5793 -37.5067 56.0523 1.0002 -0.0002
|
|
119 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
120 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
121 1 -14.5793 -37.5068 56.0524 1.0002 -0.0002
|
|
122 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
123 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
124 1 -15.5565 -40.2225 63.2846 1.0046 -0.0046
|
|
125 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
126 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
127 1 -12.8708 -28.9969 63.1406 1.0005 -0.0005
|
|
128 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
129 1 -15.5565 -40.2054 62.5392 1.0041 -0.0041
|
|
130 1 -15.6077 -40.9646 59.5721 1.0048 -0.0047
|
|
131 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
132 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
133 1 -14.5793 -37.5067 56.0523 1.0002 -0.0002
|
|
134 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
135 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
136 1 -15.5565 -40.2225 63.2847 1.0046 -0.0046
|
|
137 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
138 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
139 1 -15.5565 -40.2225 63.2846 1.0046 -0.0046
|
|
140 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
141 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
142 1 -14.5793 -37.5067 56.0524 1.0002 -0.0002
|
|
143 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
144 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
145 1 -18.3978 -56.3373 40.5331 1.0023 -0.0023
|
|
146 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
147 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
148 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
149 1 -17.3646 -58.9284 42.1265 0.9947 0.0053
|
|
150 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
151 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
152 1 -15.5565 -40.2054 62.5391 1.0041 -0.0041
|
|
153 1 -13.5072 -42.8088 61.8032 1.0014 -0.0014
|
|
154 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
155 1 -14.5793 -37.2202 56.0665 1.0002 -0.0002
|
|
156 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
157 1 -13.7489 -39.5248 60.3278 1.0035 -0.0035
|
|
158 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
159 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
160 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
161 1 -13.7489 -39.5248 60.3277 1.0035 -0.0035
|
|
162 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
163 1 -14.5793 -37.2203 56.0666 1.0002 -0.0002
|
|
164 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
165 1 -13.5072 -42.8088 61.8032 1.0014 -0.0014
|
|
166 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
167 1 -16.6105 -54.5647 68.2477 1.0151 -0.0149
|
|
168 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
169 1 -17.3646 -58.9284 42.1266 0.9947 0.0053
|
|
170 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
171 1 -13.7489 -39.5799 60.6206 1.0038 -0.0038
|
|
172 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
173 1 -18.3978 -56.3374 40.5331 1.0023 -0.0023
|
|
174 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
175 1 -18.6527 -59.0047 43.0084 1.0075 -0.0075
|
|
176 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
177 1 -13.5072 -42.8088 61.8032 1.0014 -0.0014
|
|
178 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
179 1 -18.6527 -59.0048 43.0082 1.0075 -0.0075
|
|
180 1 -19.4313 -66.0340 34.9120 1.0010 -0.0010
|
|
181 1 -20.7958 -65.5222 15.2991 0.9976 0.0024
|
|
182 1 -19.4313 -66.0340 34.9120 1.0010 -0.0010
|
|
183 1 -16.6105 -54.6215 68.2098 1.0151 -0.0149
|
|
184 1 -15.5565 -40.2054 62.5392 1.0041 -0.0041
|
|
185 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
186 1 -20.5714 -65.3532 17.2720 0.9969 0.0031
|
|
187 1 -19.4313 -66.0834 34.8762 1.0009 -0.0009
|
|
188 1 -18.6527 -59.0135 43.2228 1.0076 -0.0076
|
|
189 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
190 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
191 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
192 1 -18.6527 -59.1031 43.2827 1.0076 -0.0076
|
|
193 1 -16.6105 -54.6355 68.6631 1.0152 -0.0150
|
|
194 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
195 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
196 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
197 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
198 1 -15.5565 -39.8653 63.1433 1.0043 -0.0043
|
|
199 1 -15.5565 -39.8653 63.1432 1.0043 -0.0043
|
|
200 1 -13.5072 -42.5408 61.4995 1.0011 -0.0011
|
|
201 1 -12.0052 -24.8708 79.9542 1.0159 -0.0157
|
|
202 1 -14.5793 -37.3053 56.0754 1.0002 -0.0002
|
|
203 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
204 1 -16.6105 -54.6355 68.6630 1.0152 -0.0150
|
|
205 1 -18.6527 -59.1031 43.2826 1.0076 -0.0076
|
|
206 1 -16.2688 -48.7209 72.5496 1.0144 -0.0142
|
|
207 1 -13.5072 -42.8652 61.5284 1.0011 -0.0011
|
|
208 1 -16.2688 -48.8356 72.5045 1.0144 -0.0142
|
|
209 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
210 1 -19.4313 -66.0835 34.8762 1.0009 -0.0009
|
|
211 1 -20.5714 -65.3532 17.2719 0.9969 0.0031
|
|
212 1 -18.6527 -59.0136 43.2229 1.0076 -0.0076
|
|
213 1 -15.5565 -40.2054 62.5393 1.0041 -0.0041
|
|
214 1 -16.6105 -54.6215 68.2097 1.0151 -0.0149
|
|
215 1 -19.4313 -66.0340 34.9120 1.0010 -0.0010
|
|
216 1 -20.7958 -65.5222 15.2990 0.9976 0.0024
|
|
|
|
1 2 0.3145 144.0782 42.0239 0.9828 0.0175
|
|
2 2 -2.5926 91.3168 184.0139 1.0462 -0.0441
|
|
3 2 -9.2191 -13.6429 49.6272 0.9973 0.0027
|
|
4 2 -14.0678 -10.0555 62.4573 1.0036 -0.0036
|
|
5 2 -9.2191 -13.6430 49.6272 0.9973 0.0027
|
|
6 2 -2.5926 91.3168 184.0144 1.0462 -0.0441
|
|
7 2 -2.5926 90.7704 187.3123 1.0476 -0.0454
|
|
8 2 -1.7294 116.9181 132.8805 1.0101 -0.0100
|
|
9 2 -6.9063 -10.4928 103.6235 1.0186 -0.0183
|
|
10 2 -12.4383 -11.3370 65.6203 1.0087 -0.0086
|
|
11 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
12 2 -5.3692 -2.5410 135.9316 1.0278 -0.0271
|
|
13 2 -9.2191 -14.1270 49.3772 0.9971 0.0029
|
|
14 2 -6.9063 -11.6923 102.5118 1.0179 -0.0176
|
|
15 2 -6.7590 -15.6555 108.5470 1.0116 -0.0115
|
|
16 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
17 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
18 2 -10.7517 -7.1740 57.6459 1.0053 -0.0052
|
|
19 2 -14.0678 -10.7793 63.2222 1.0041 -0.0041
|
|
20 2 -12.4383 -11.5450 65.7164 1.0088 -0.0088
|
|
21 2 -10.2664 -12.3331 57.0670 1.0005 -0.0005
|
|
22 2 -11.9934 -20.8051 78.3140 1.0124 -0.0123
|
|
23 2 -10.2664 -12.3331 57.0669 1.0005 -0.0005
|
|
24 2 -12.4383 -11.5450 65.7164 1.0088 -0.0088
|
|
25 2 -9.2191 -14.1270 49.3772 0.9971 0.0029
|
|
26 2 -10.7517 -7.1739 57.6458 1.0053 -0.0052
|
|
27 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
28 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
29 2 -6.7590 -15.6556 108.5470 1.0116 -0.0115
|
|
30 2 -6.9063 -11.6923 102.5120 1.0179 -0.0176
|
|
31 2 -2.5926 90.7704 187.3121 1.0476 -0.0454
|
|
32 2 -5.3692 -2.5409 135.9315 1.0278 -0.0271
|
|
33 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
34 2 -12.4383 -11.3370 65.6202 1.0087 -0.0086
|
|
35 2 -6.9063 -10.4930 103.6235 1.0186 -0.0183
|
|
36 2 -1.7294 116.9181 132.8805 1.0101 -0.0100
|
|
37 2 -2.5926 91.3168 184.0140 1.0462 -0.0441
|
|
38 2 -1.7294 116.9181 132.8805 1.0101 -0.0100
|
|
39 2 -6.9063 -10.9581 102.1880 1.0180 -0.0177
|
|
40 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
41 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
42 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
43 2 -1.7294 116.9181 132.8805 1.0101 -0.0100
|
|
44 2 -2.5926 91.3168 184.0145 1.0462 -0.0441
|
|
45 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
46 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
47 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
48 2 -6.9063 -10.9582 102.1881 1.0180 -0.0177
|
|
49 2 -6.9063 -11.6923 102.5118 1.0179 -0.0176
|
|
50 2 -5.3692 -2.5410 135.9316 1.0278 -0.0271
|
|
51 2 -6.9063 -10.9582 102.1881 1.0180 -0.0177
|
|
52 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
53 2 -11.9153 -4.5017 67.4516 1.0104 -0.0103
|
|
54 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
55 2 -12.4383 -11.5450 65.7164 1.0088 -0.0088
|
|
56 2 -10.7517 -7.1740 57.6459 1.0053 -0.0052
|
|
57 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
58 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
59 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
60 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
61 2 -10.7517 -7.1739 57.6458 1.0053 -0.0052
|
|
62 2 -12.4383 -11.5450 65.7164 1.0088 -0.0088
|
|
63 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
64 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
65 2 -10.2664 -12.7144 56.8324 1.0004 -0.0004
|
|
66 2 -8.9488 -18.8141 49.8330 0.9961 0.0039
|
|
67 2 -5.3692 -2.5409 135.9315 1.0278 -0.0271
|
|
68 2 -6.9063 -11.6923 102.5119 1.0179 -0.0176
|
|
69 2 -8.9488 -18.8140 49.8330 0.9961 0.0039
|
|
70 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
71 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
72 2 -6.9063 -10.9582 102.1880 1.0180 -0.0177
|
|
73 2 -9.2191 -13.6429 49.6272 0.9973 0.0027
|
|
74 2 -6.9063 -10.9581 102.1880 1.0180 -0.0177
|
|
75 2 -6.7590 -15.6555 108.5469 1.0116 -0.0115
|
|
76 2 -10.2664 -12.7144 56.8324 1.0004 -0.0004
|
|
77 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
78 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
79 2 -6.9063 -10.4928 103.6235 1.0186 -0.0183
|
|
80 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
81 2 -6.9063 -10.4930 103.6235 1.0186 -0.0183
|
|
82 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
83 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
84 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
85 2 -6.7590 -15.6555 108.5470 1.0116 -0.0115
|
|
86 2 -6.9063 -10.9582 102.1881 1.0180 -0.0177
|
|
87 2 -9.2191 -13.6430 49.6272 0.9973 0.0027
|
|
88 2 -10.7517 -7.1032 57.8524 1.0054 -0.0053
|
|
89 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
90 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
91 2 -10.2664 -12.3331 57.0670 1.0005 -0.0005
|
|
92 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
93 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
94 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
95 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
96 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
97 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
98 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
99 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
100 2 -11.9153 -4.5017 67.4517 1.0104 -0.0103
|
|
101 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
102 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
103 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
104 2 -8.9488 -18.8140 49.8330 0.9961 0.0039
|
|
105 2 -10.2664 -12.3330 57.0669 1.0005 -0.0005
|
|
106 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
107 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
108 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
109 2 -14.0678 -10.0555 62.4573 1.0036 -0.0036
|
|
110 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
111 2 -10.2664 -12.7144 56.8324 1.0004 -0.0004
|
|
112 2 -11.9934 -20.8051 78.3140 1.0124 -0.0123
|
|
113 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
114 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
115 2 -12.4383 -11.3370 65.6203 1.0087 -0.0086
|
|
116 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
117 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
118 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
119 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
120 2 -11.9153 -4.5017 67.4517 1.0104 -0.0103
|
|
121 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
122 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
123 2 -10.7517 -7.1032 57.8524 1.0054 -0.0053
|
|
124 2 -12.4383 -11.3370 65.6202 1.0087 -0.0086
|
|
125 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
126 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
127 2 -11.9934 -20.8051 78.3140 1.0124 -0.0123
|
|
128 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
129 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
130 2 -14.0678 -10.0555 62.4573 1.0036 -0.0036
|
|
131 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
132 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
133 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
134 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
135 2 -11.9153 -4.5018 67.4516 1.0104 -0.0103
|
|
136 2 -12.4383 -11.3370 65.6203 1.0087 -0.0086
|
|
137 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
138 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
139 2 -12.4383 -11.3370 65.6202 1.0087 -0.0086
|
|
140 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
141 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
142 2 -10.2664 -12.7694 57.1675 1.0004 -0.0004
|
|
143 2 -8.9488 -18.6133 50.5296 0.9964 0.0036
|
|
144 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
145 2 -9.2191 -13.6430 49.6272 0.9973 0.0027
|
|
146 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
147 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
148 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
149 2 -6.7590 -15.6556 108.5470 1.0116 -0.0115
|
|
150 2 -6.9063 -10.9583 102.1881 1.0180 -0.0177
|
|
151 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
152 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
153 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
154 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
155 2 -10.2664 -12.3331 57.0670 1.0005 -0.0005
|
|
156 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
157 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
158 2 -11.9153 -4.5017 67.4517 1.0104 -0.0103
|
|
159 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
160 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
161 2 -10.6632 -14.9281 64.8467 1.0067 -0.0067
|
|
162 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
163 2 -10.2664 -12.3331 57.0669 1.0005 -0.0005
|
|
164 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
165 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
166 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
167 2 -10.7517 -7.2555 57.7600 1.0054 -0.0054
|
|
168 2 -8.9488 -18.8140 49.8330 0.9961 0.0039
|
|
169 2 -6.7590 -15.6556 108.5470 1.0116 -0.0115
|
|
170 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
171 2 -10.6632 -15.3012 65.0934 1.0068 -0.0067
|
|
172 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
173 2 -9.2191 -13.6429 49.6272 0.9973 0.0027
|
|
174 2 -6.9063 -10.9582 102.1880 1.0180 -0.0177
|
|
175 2 -6.9063 -10.4930 103.6235 1.0186 -0.0183
|
|
176 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
177 2 -11.9153 -4.7476 66.3984 1.0097 -0.0096
|
|
178 2 -8.9488 -18.6133 50.5296 0.9964 0.0036
|
|
179 2 -6.9063 -10.4929 103.6236 1.0186 -0.0183
|
|
180 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
181 2 -2.5926 91.3168 184.0144 1.0462 -0.0441
|
|
182 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
183 2 -10.7517 -7.1033 57.8524 1.0054 -0.0053
|
|
184 2 -12.4383 -11.4842 65.2341 1.0087 -0.0086
|
|
185 2 -6.9063 -10.9582 102.1881 1.0180 -0.0177
|
|
186 2 -1.7294 116.9181 132.8805 1.0101 -0.0100
|
|
187 2 -5.3692 -2.5410 135.9317 1.0278 -0.0271
|
|
188 2 -6.9063 -10.9582 102.1881 1.0180 -0.0177
|
|
189 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
190 2 -11.9153 -4.5017 67.4516 1.0104 -0.0103
|
|
191 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
192 2 -6.9063 -11.6923 102.5118 1.0179 -0.0176
|
|
193 2 -10.7517 -7.1740 57.6459 1.0053 -0.0052
|
|
194 2 -8.9488 -18.8141 49.8331 0.9961 0.0039
|
|
195 2 -10.2664 -12.7144 56.8325 1.0004 -0.0004
|
|
196 2 -11.7636 -23.4924 75.5737 1.0068 -0.0067
|
|
197 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
198 2 -12.4383 -11.5450 65.7164 1.0088 -0.0088
|
|
199 2 -12.4383 -11.5449 65.7164 1.0088 -0.0088
|
|
200 2 -11.9153 -4.4548 66.9050 1.0101 -0.0100
|
|
201 2 -11.7636 -23.4924 75.5738 1.0068 -0.0067
|
|
202 2 -10.2664 -12.7144 56.8324 1.0004 -0.0004
|
|
203 2 -8.9488 -18.8141 49.8330 0.9961 0.0039
|
|
204 2 -10.7517 -7.1739 57.6458 1.0053 -0.0052
|
|
205 2 -6.9063 -11.6923 102.5119 1.0179 -0.0176
|
|
206 2 -8.9488 -18.8140 49.8330 0.9961 0.0039
|
|
207 2 -11.9153 -4.5017 67.4515 1.0104 -0.0103
|
|
208 2 -8.9488 -18.6133 50.5295 0.9964 0.0036
|
|
209 2 -6.9063 -10.9582 102.1880 1.0180 -0.0177
|
|
210 2 -5.3692 -2.5409 135.9315 1.0278 -0.0271
|
|
211 2 -1.7294 116.9181 132.8804 1.0101 -0.0100
|
|
212 2 -6.9063 -10.9581 102.1880 1.0180 -0.0177
|
|
213 2 -12.4383 -11.4842 65.2340 1.0087 -0.0086
|
|
214 2 -10.7517 -7.1032 57.8524 1.0054 -0.0053
|
|
215 2 -5.3692 -1.1316 135.2354 1.0275 -0.0268
|
|
216 2 -2.5926 91.3168 184.0140 1.0462 -0.0441
|
|
|
|
1 3 0.3145 144.0782 42.0239 0.9828 0.0175
|
|
2 3 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
3 3 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
4 3 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
5 3 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
6 3 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
7 3 -0.4527 131.2854 74.6315 1.0017 -0.0017
|
|
8 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
9 3 -3.2910 46.9566 163.8450 1.0344 -0.0332
|
|
10 3 -4.5379 12.1039 135.5071 1.0184 -0.0180
|
|
11 3 -5.2472 0.4880 121.3192 1.0229 -0.0223
|
|
12 3 -3.4193 47.6117 170.3817 1.0334 -0.0323
|
|
13 3 -2.0907 95.2716 142.8482 1.0214 -0.0209
|
|
14 3 -3.2910 46.4878 163.6517 1.0346 -0.0334
|
|
15 3 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
16 3 -7.2955 -11.4063 84.7355 1.0189 -0.0185
|
|
17 3 -9.4579 2.0421 40.7663 0.9962 0.0038
|
|
18 3 -5.2472 1.8078 119.6395 1.0225 -0.0220
|
|
19 3 -2.9614 53.1758 169.6932 1.0452 -0.0432
|
|
20 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
21 3 -7.2955 -11.0047 83.9634 1.0184 -0.0181
|
|
22 3 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
23 3 -7.2955 -11.0047 83.9635 1.0184 -0.0181
|
|
24 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
25 3 -2.0907 95.2716 142.8480 1.0214 -0.0209
|
|
26 3 -5.2472 1.8079 119.6393 1.0225 -0.0220
|
|
27 3 -9.4579 2.0421 40.7663 0.9962 0.0038
|
|
28 3 -7.2955 -11.4063 84.7354 1.0189 -0.0185
|
|
29 3 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
30 3 -3.2910 46.4877 163.6516 1.0346 -0.0334
|
|
31 3 -0.4527 131.2853 74.6315 1.0017 -0.0017
|
|
32 3 -3.4193 47.6117 170.3816 1.0334 -0.0323
|
|
33 3 -5.2472 0.4879 121.3193 1.0229 -0.0223
|
|
34 3 -4.5379 12.1038 135.5073 1.0184 -0.0180
|
|
35 3 -3.2910 46.9565 163.8449 1.0344 -0.0332
|
|
36 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
37 3 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
38 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
39 3 -3.2910 47.2714 167.5292 1.0359 -0.0346
|
|
40 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
41 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
42 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
43 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
44 3 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
45 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
46 3 -5.2472 1.3404 120.2356 1.0224 -0.0219
|
|
47 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
48 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
49 3 -3.2910 46.4878 163.6517 1.0346 -0.0334
|
|
50 3 -3.4193 47.6117 170.3817 1.0334 -0.0323
|
|
51 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
52 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
53 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
54 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
55 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
56 3 -5.2472 1.8078 119.6394 1.0225 -0.0220
|
|
57 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
58 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
59 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
60 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
61 3 -5.2472 1.8079 119.6394 1.0225 -0.0220
|
|
62 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
63 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
64 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
65 3 -7.2955 -10.5464 82.7553 1.0180 -0.0177
|
|
66 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
67 3 -3.4193 47.6117 170.3816 1.0334 -0.0323
|
|
68 3 -3.2910 46.4877 163.6514 1.0346 -0.0334
|
|
69 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
70 3 -7.7465 -19.3783 76.0564 1.0062 -0.0062
|
|
71 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
72 3 -3.2910 47.2713 167.5293 1.0359 -0.0346
|
|
73 3 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
74 3 -3.2910 47.2713 167.5292 1.0359 -0.0346
|
|
75 3 -5.2110 2.8600 106.3519 1.0191 -0.0188
|
|
76 3 -7.2955 -10.5463 82.7553 1.0180 -0.0177
|
|
77 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
78 3 -5.2472 1.3404 120.2356 1.0224 -0.0219
|
|
79 3 -3.2910 46.9566 163.8450 1.0344 -0.0332
|
|
80 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
81 3 -3.2910 46.9565 163.8448 1.0344 -0.0332
|
|
82 3 -6.9060 -4.8795 87.5622 1.0155 -0.0153
|
|
83 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
84 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
85 3 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
86 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
87 3 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
88 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
89 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
90 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
91 3 -7.2955 -11.0047 83.9634 1.0184 -0.0181
|
|
92 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
93 3 -5.2472 0.4880 121.3192 1.0229 -0.0223
|
|
94 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
95 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
96 3 -8.4117 -8.3393 41.4862 0.9927 0.0073
|
|
97 3 -9.4579 2.0421 40.7663 0.9962 0.0038
|
|
98 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
99 3 -9.4579 2.0422 40.7663 0.9962 0.0038
|
|
100 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
101 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
102 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
103 3 -5.2472 0.4880 121.3193 1.0229 -0.0223
|
|
104 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
105 3 -7.2955 -11.0046 83.9635 1.0184 -0.0181
|
|
106 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
107 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
108 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
109 3 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
110 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
111 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
112 3 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
113 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
114 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
115 3 -4.5379 12.1039 135.5071 1.0184 -0.0180
|
|
116 3 -5.2472 1.3404 120.2356 1.0224 -0.0219
|
|
117 3 -6.9060 -4.8795 87.5622 1.0155 -0.0153
|
|
118 3 -7.2955 -11.4063 84.7354 1.0189 -0.0185
|
|
119 3 -8.4117 -8.3393 41.4862 0.9927 0.0073
|
|
120 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
121 3 -7.2955 -11.4063 84.7355 1.0189 -0.0185
|
|
122 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
123 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
124 3 -4.5379 12.1039 135.5072 1.0184 -0.0180
|
|
125 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
126 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
127 3 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
128 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
129 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
130 3 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
131 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
132 3 -7.2955 -10.5464 82.7554 1.0180 -0.0177
|
|
133 3 -7.2955 -11.4063 84.7353 1.0189 -0.0185
|
|
134 3 -8.4117 -8.3393 41.4862 0.9927 0.0073
|
|
135 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
136 3 -4.5379 12.1039 135.5071 1.0184 -0.0180
|
|
137 3 -5.2472 1.3403 120.2356 1.0224 -0.0219
|
|
138 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
139 3 -4.5379 12.1039 135.5072 1.0184 -0.0180
|
|
140 3 -7.7465 -19.3782 76.0563 1.0062 -0.0062
|
|
141 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
142 3 -7.2955 -11.4063 84.7355 1.0189 -0.0185
|
|
143 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
144 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
145 3 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
146 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
147 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
148 3 -7.2955 -10.5464 82.7554 1.0180 -0.0177
|
|
149 3 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
150 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
151 3 -5.2472 0.4880 121.3192 1.0229 -0.0223
|
|
152 3 -4.5379 12.7552 134.0976 1.0181 -0.0178
|
|
153 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
154 3 -8.4117 -8.3393 41.4862 0.9927 0.0073
|
|
155 3 -7.2955 -11.0047 83.9634 1.0184 -0.0181
|
|
156 3 -6.9060 -4.4895 87.6372 1.0157 -0.0154
|
|
157 3 -9.4579 2.0422 40.7663 0.9962 0.0038
|
|
158 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
159 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
160 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
161 3 -9.4579 2.0421 40.7663 0.9962 0.0038
|
|
162 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
163 3 -7.2955 -11.0046 83.9635 1.0184 -0.0181
|
|
164 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
165 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
166 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
167 3 -5.2472 0.4879 121.3193 1.0229 -0.0223
|
|
168 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
169 3 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
170 3 -7.2955 -10.5464 82.7554 1.0180 -0.0177
|
|
171 3 -9.4579 2.6043 39.5451 0.9959 0.0041
|
|
172 3 -5.2472 1.3404 120.2356 1.0224 -0.0219
|
|
173 3 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
174 3 -3.2910 47.2713 167.5292 1.0359 -0.0346
|
|
175 3 -3.2910 46.9565 163.8449 1.0344 -0.0332
|
|
176 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
177 3 -7.7465 -18.5276 76.7669 1.0064 -0.0064
|
|
178 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
179 3 -3.2910 46.9566 163.8451 1.0344 -0.0332
|
|
180 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
181 3 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
182 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
183 3 -5.2472 1.3404 120.2356 1.0224 -0.0219
|
|
184 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
185 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
186 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
187 3 -3.4193 47.6117 170.3817 1.0334 -0.0323
|
|
188 3 -3.2910 47.2713 167.5291 1.0359 -0.0346
|
|
189 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
190 3 -7.7465 -19.3782 76.0564 1.0062 -0.0062
|
|
191 3 -6.9060 -4.4895 87.6372 1.0157 -0.0154
|
|
192 3 -3.2910 46.4878 163.6518 1.0346 -0.0334
|
|
193 3 -5.2472 1.8078 119.6395 1.0225 -0.0220
|
|
194 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
195 3 -7.2955 -10.5463 82.7554 1.0180 -0.0177
|
|
196 3 -8.4117 -8.3394 41.4862 0.9927 0.0073
|
|
197 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
198 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
199 3 -4.5379 13.0600 133.5315 1.0181 -0.0178
|
|
200 3 -7.7465 -18.8495 76.1884 1.0063 -0.0063
|
|
201 3 -8.4117 -8.3393 41.4862 0.9927 0.0073
|
|
202 3 -7.2955 -10.5464 82.7554 1.0180 -0.0177
|
|
203 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
204 3 -5.2472 1.8079 119.6393 1.0225 -0.0220
|
|
205 3 -3.2910 46.4877 163.6515 1.0346 -0.0334
|
|
206 3 -6.9060 -4.4894 87.6372 1.0157 -0.0154
|
|
207 3 -7.7465 -19.3783 76.0564 1.0062 -0.0062
|
|
208 3 -6.9060 -4.8796 87.5622 1.0155 -0.0153
|
|
209 3 -3.2910 47.2713 167.5293 1.0359 -0.0346
|
|
210 3 -3.4193 47.6117 170.3816 1.0334 -0.0323
|
|
211 3 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
212 3 -3.2910 47.2713 167.5293 1.0359 -0.0346
|
|
213 3 -4.5379 12.7552 134.0977 1.0181 -0.0178
|
|
214 3 -5.2472 1.3404 120.2357 1.0224 -0.0219
|
|
215 3 -3.4193 47.4539 173.7760 1.0352 -0.0340
|
|
216 3 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
|
|
1 4 0.3145 144.0782 42.0239 0.9828 0.0175
|
|
2 4 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
3 4 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
4 4 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
5 4 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
6 4 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
7 4 -0.4527 131.2854 74.6315 1.0017 -0.0017
|
|
8 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
9 4 -2.6027 80.5241 170.8222 1.0439 -0.0420
|
|
10 4 -3.8929 24.2468 140.5261 1.0248 -0.0242
|
|
11 4 -2.6593 70.7407 161.6464 1.0429 -0.0411
|
|
12 4 -0.9512 114.5024 85.8332 1.0053 -0.0053
|
|
13 4 -2.0907 95.2716 142.8482 1.0214 -0.0209
|
|
14 4 -2.6027 80.2291 166.7185 1.0423 -0.0405
|
|
15 4 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
16 4 -5.9070 -5.7628 78.3088 1.0027 -0.0027
|
|
17 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
18 4 -2.6593 70.8397 161.3824 1.0429 -0.0411
|
|
19 4 -2.9614 53.1758 169.6932 1.0452 -0.0432
|
|
20 4 -3.8929 24.4080 139.5025 1.0246 -0.0240
|
|
21 4 -5.9070 -4.7962 78.1113 1.0025 -0.0025
|
|
22 4 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
23 4 -5.9070 -4.7962 78.1114 1.0025 -0.0025
|
|
24 4 -3.8929 24.4081 139.5023 1.0246 -0.0240
|
|
25 4 -2.0907 95.2716 142.8480 1.0214 -0.0209
|
|
26 4 -2.6593 70.8397 161.3823 1.0429 -0.0411
|
|
27 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
28 4 -5.9070 -5.7629 78.3089 1.0027 -0.0027
|
|
29 4 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
30 4 -2.6027 80.2293 166.7184 1.0423 -0.0405
|
|
31 4 -0.4527 131.2853 74.6315 1.0017 -0.0017
|
|
32 4 -0.9512 114.5023 85.8332 1.0053 -0.0053
|
|
33 4 -2.6593 70.7406 161.6463 1.0429 -0.0411
|
|
34 4 -3.8929 24.2469 140.5260 1.0248 -0.0242
|
|
35 4 -2.6027 80.5242 170.8221 1.0439 -0.0420
|
|
36 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
37 4 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
38 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
39 4 -2.6027 80.4731 167.2341 1.0424 -0.0407
|
|
40 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
41 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
42 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
43 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
44 4 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
45 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
46 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
47 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
48 4 -2.6027 80.4731 167.2340 1.0424 -0.0407
|
|
49 4 -2.6027 80.2291 166.7185 1.0423 -0.0405
|
|
50 4 -0.9512 114.5024 85.8332 1.0053 -0.0053
|
|
51 4 -2.6027 80.4732 167.2340 1.0424 -0.0407
|
|
52 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
53 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
54 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
55 4 -3.8929 24.4080 139.5025 1.0246 -0.0240
|
|
56 4 -2.6593 70.8397 161.3824 1.0429 -0.0411
|
|
57 4 -3.9563 26.7250 142.1127 1.0248 -0.0242
|
|
58 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
59 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
60 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
61 4 -2.6593 70.8397 161.3823 1.0429 -0.0411
|
|
62 4 -3.8929 24.4081 139.5023 1.0246 -0.0240
|
|
63 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
64 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
65 4 -5.9070 -5.2419 80.0245 1.0028 -0.0028
|
|
66 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
67 4 -0.9512 114.5023 85.8332 1.0053 -0.0053
|
|
68 4 -2.6027 80.2293 166.7183 1.0423 -0.0405
|
|
69 4 -3.9563 26.7251 142.1126 1.0248 -0.0242
|
|
70 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
71 4 -3.9563 26.6258 143.1458 1.0250 -0.0244
|
|
72 4 -2.6027 80.4731 167.2342 1.0424 -0.0407
|
|
73 4 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
74 4 -2.6027 80.4731 167.2341 1.0424 -0.0407
|
|
75 4 -5.2110 2.8600 106.3519 1.0191 -0.0188
|
|
76 4 -5.9070 -5.2418 80.0245 1.0028 -0.0028
|
|
77 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
78 4 -2.6593 72.2632 163.8944 1.0433 -0.0415
|
|
79 4 -2.6027 80.5241 170.8222 1.0439 -0.0420
|
|
80 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
81 4 -2.6027 80.5242 170.8220 1.0439 -0.0420
|
|
82 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
83 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
84 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
85 4 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
86 4 -2.6027 80.4732 167.2340 1.0424 -0.0407
|
|
87 4 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
88 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
89 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
90 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
91 4 -5.9070 -4.7962 78.1113 1.0025 -0.0025
|
|
92 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
93 4 -2.6593 70.7407 161.6464 1.0429 -0.0411
|
|
94 4 -3.8929 24.5283 142.4141 1.0250 -0.0244
|
|
95 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
96 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
97 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
98 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
99 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
100 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
101 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
102 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
103 4 -2.6593 70.7406 161.6463 1.0429 -0.0411
|
|
104 4 -3.9563 26.7251 142.1126 1.0248 -0.0242
|
|
105 4 -5.9070 -4.7962 78.1113 1.0025 -0.0025
|
|
106 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
107 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
108 4 -3.8929 24.5283 142.4143 1.0250 -0.0244
|
|
109 4 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
110 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
111 4 -5.9070 -5.2418 80.0245 1.0028 -0.0028
|
|
112 4 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
113 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
114 4 -3.8929 24.5283 142.4141 1.0250 -0.0244
|
|
115 4 -3.8929 24.2468 140.5261 1.0248 -0.0242
|
|
116 4 -2.6593 72.2632 163.8944 1.0433 -0.0415
|
|
117 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
118 4 -5.9070 -5.7628 78.3088 1.0027 -0.0027
|
|
119 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
120 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
121 4 -5.9070 -5.7628 78.3088 1.0027 -0.0027
|
|
122 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
123 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
124 4 -3.8929 24.2469 140.5260 1.0248 -0.0242
|
|
125 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
126 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
127 4 -6.9896 -4.1868 69.9999 1.0147 -0.0145
|
|
128 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
129 4 -3.8929 24.5283 142.4141 1.0250 -0.0244
|
|
130 4 -2.9614 54.1470 173.0161 1.0458 -0.0438
|
|
131 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
132 4 -5.9070 -5.2419 80.0245 1.0028 -0.0028
|
|
133 4 -5.9070 -5.7629 78.3089 1.0027 -0.0027
|
|
134 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
135 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
136 4 -3.8929 24.2468 140.5261 1.0248 -0.0242
|
|
137 4 -2.6593 72.2632 163.8944 1.0433 -0.0415
|
|
138 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
139 4 -3.8929 24.2469 140.5260 1.0248 -0.0242
|
|
140 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
141 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
142 4 -5.9070 -5.7629 78.3088 1.0027 -0.0027
|
|
143 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
144 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
145 4 -2.0907 96.6225 145.9748 1.0219 -0.0215
|
|
146 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
147 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
148 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
149 4 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
150 4 -2.6027 80.4732 167.2341 1.0424 -0.0407
|
|
151 4 -2.6593 70.7407 161.6464 1.0429 -0.0411
|
|
152 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
153 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
154 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
155 4 -5.9070 -4.7962 78.1113 1.0025 -0.0025
|
|
156 4 -3.9563 26.7250 142.1127 1.0248 -0.0242
|
|
157 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
158 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
159 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
160 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
161 4 -4.5555 11.6751 121.2748 1.0159 -0.0157
|
|
162 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
163 4 -5.9070 -4.7962 78.1114 1.0025 -0.0025
|
|
164 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
165 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
166 4 -3.8929 24.5283 142.4143 1.0250 -0.0244
|
|
167 4 -2.6593 70.7406 161.6463 1.0429 -0.0411
|
|
168 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
169 4 -5.2110 2.8599 106.3520 1.0191 -0.0188
|
|
170 4 -5.9070 -5.2419 80.0245 1.0028 -0.0028
|
|
171 4 -4.5555 12.3549 124.5620 1.0166 -0.0163
|
|
172 4 -2.6593 72.2633 163.8945 1.0433 -0.0415
|
|
173 4 -2.0907 96.6225 145.9749 1.0219 -0.0215
|
|
174 4 -2.6027 80.4731 167.2341 1.0424 -0.0407
|
|
175 4 -2.6027 80.5242 170.8221 1.0439 -0.0420
|
|
176 4 -3.9563 26.6258 143.1458 1.0250 -0.0244
|
|
177 4 -5.2565 1.7443 111.0804 1.0209 -0.0205
|
|
178 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
179 4 -2.6027 80.5241 170.8222 1.0439 -0.0420
|
|
180 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
181 4 -0.4527 133.6048 76.8538 1.0021 -0.0021
|
|
182 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
183 4 -2.6593 72.2632 163.8945 1.0433 -0.0415
|
|
184 4 -3.8929 24.5283 142.4141 1.0250 -0.0244
|
|
185 4 -2.6027 80.4732 167.2341 1.0424 -0.0407
|
|
186 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
187 4 -0.9512 114.5024 85.8332 1.0053 -0.0053
|
|
188 4 -2.6027 80.4731 167.2340 1.0424 -0.0407
|
|
189 4 -3.9563 26.6258 143.1457 1.0250 -0.0244
|
|
190 4 -5.2565 2.8108 109.1817 1.0203 -0.0199
|
|
191 4 -3.9563 26.7250 142.1127 1.0248 -0.0242
|
|
192 4 -2.6027 80.2291 166.7185 1.0423 -0.0405
|
|
193 4 -2.6593 70.8397 161.3824 1.0429 -0.0411
|
|
194 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
195 4 -5.9070 -5.2419 80.0244 1.0028 -0.0028
|
|
196 4 -7.0563 -3.4626 78.0667 1.0169 -0.0167
|
|
197 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
198 4 -3.8929 24.4080 139.5025 1.0246 -0.0240
|
|
199 4 -3.8929 24.4081 139.5024 1.0246 -0.0240
|
|
200 4 -5.2565 3.2634 108.4082 1.0202 -0.0198
|
|
201 4 -7.0563 -3.4626 78.0666 1.0169 -0.0167
|
|
202 4 -5.9070 -5.2419 80.0245 1.0028 -0.0028
|
|
203 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
204 4 -2.6593 70.8398 161.3823 1.0429 -0.0411
|
|
205 4 -2.6027 80.2292 166.7183 1.0423 -0.0405
|
|
206 4 -3.9563 26.7250 142.1126 1.0248 -0.0242
|
|
207 4 -5.2565 2.8109 109.1818 1.0203 -0.0199
|
|
208 4 -3.9563 26.6258 143.1458 1.0250 -0.0244
|
|
209 4 -2.6027 80.4731 167.2342 1.0424 -0.0407
|
|
210 4 -0.9512 114.5023 85.8332 1.0053 -0.0053
|
|
211 4 -1.5590 114.2453 113.3087 1.0056 -0.0056
|
|
212 4 -2.6027 80.4731 167.2342 1.0424 -0.0407
|
|
213 4 -3.8929 24.5283 142.4142 1.0250 -0.0244
|
|
214 4 -2.6593 72.2633 163.8944 1.0433 -0.0415
|
|
215 4 -0.9512 116.8865 86.6163 1.0048 -0.0048
|
|
216 4 -0.4527 133.6049 76.8538 1.0021 -0.0021
|
|
|
|
===================================================================
|
|
Memory usage: VmHWM = 38Mb
|
|
VmPeak = 451Mb
|
|
===================================================================
|
|
|
|
|
|
Unfolding on the coarse grid
|
|
elphon_wrap : 8.65s CPU 9.47s WALL ( 1 calls)
|
|
|
|
INITIALIZATION:
|
|
|
|
init_vloc : 0.01s CPU 0.02s WALL ( 29 calls)
|
|
init_us_1 : 0.31s CPU 0.32s WALL ( 29 calls)
|
|
|
|
|
|
Electron-Phonon interpolation
|
|
ephwann : 0.60s CPU 0.69s WALL ( 1 calls)
|
|
ep-interp : 0.50s CPU 0.59s WALL ( 216 calls)
|
|
|
|
Ham: step 1 : 0.00s CPU 0.00s WALL ( 1 calls)
|
|
Ham: step 2 : 0.00s CPU 0.00s WALL ( 1 calls)
|
|
ep: step 1 : 0.00s CPU 0.00s WALL ( 162 calls)
|
|
ep: step 2 : 0.02s CPU 0.02s WALL ( 162 calls)
|
|
DynW2B : 0.00s CPU 0.00s WALL ( 216 calls)
|
|
HamW2B : 0.11s CPU 0.11s WALL ( 23436 calls)
|
|
ephW2Bp : 0.05s CPU 0.06s WALL ( 216 calls)
|
|
|
|
|
|
Total program execution
|
|
EPW : 10.32s CPU 11.27s WALL
|
|
|
|
|
|
Please consider citing:
|
|
S. Ponce, E. R. Margine, C. Verdi and F. Giustino, Comput. Phys. Commun. 209, 116 (2016)
|
|
|
|
In addition, if you used anisotropic Eliashberg superconductivity please cite:
|
|
E. R. Margine and F. Giustino, Phys. Rev. B 87, 024505 (2013)
|
|
if you used transport properties (scattering rates, mobility) please cite:
|
|
S. Ponce, E. R. Margine and F. Giustino, Phys. Rev. B 97, 121201 (2018)
|