mirror of https://gitlab.com/QEF/q-e.git
1523 lines
52 KiB
Plaintext
1523 lines
52 KiB
Plaintext
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Program PWCOND v.6.0 (svn rev. 13317) starts on 18Feb2017 at 20:41:57
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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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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 1 processors
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Reading data from directory:
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/scratch/scitas/nvarini/espresso_trunk_svn/tempdir/Auwire.save
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Info: using nr1, nr2, nr3 values from input
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Info: using nr1, nr2, nr3 values from input
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IMPORTANT: XC functional enforced from input :
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Exchange-correlation = LDA ( 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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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 2701 1789 577 33063 17971 3265
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negative rho (up, down): 1.073E-05 0.000E+00
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===== INPUT FILE containing the left lead =====
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GEOMETRY:
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lattice parameter (alat) = 15.0000 a.u.
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the volume = 1066.5000 (a.u.)^3
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the cross section = 225.0000 (a.u.)^2
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l of the unit cell = 0.3160 (alat)
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number of atoms/cell = 1
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number of atomic types = 1
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crystal axes: (cart. coord. in units of alat)
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a(1) = ( 1.0000 0.0000 0.0000 )
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a(2) = ( 0.0000 1.0000 0.0000 )
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a(3) = ( 0.0000 0.0000 0.3160 )
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Cartesian axes
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site n. atom positions (alat units)
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1 Au tau( 1)=( 0.0000 0.0000 0.3160 )
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nr1s = 48
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nr2s = 48
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nr3s = 15
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nr1sx = 48
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nr2sx = 48
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nr3sx = 15
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nr1 = 60
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nr2 = 60
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nr3 = 20
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nr1x = 60
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nr2x = 60
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nr3x = 20
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_______________________________
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Radii of nonlocal spheres:
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type ibeta ang. mom. radius (alat units)
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Au 1 1 0.2254
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Au 2 2 0.2254
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Au 3 2 0.2254
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----- General information -----
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----- Complex band structure calculation -----
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nrx = 48
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nry = 48
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nz1 = 3
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energy0 = 1.0E+00
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denergy = -5.0E-02
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nenergy = 100
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ecut2d = 2.5E+01
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ewind = 4.0E+00
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epsproj = 1.0E-05
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number of k_|| points= 1
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cryst. coord.
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k( 1) = ( 0.0000000 0.0000000), wk = 1.0000000
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----- Information about left lead -----
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nocros = 13
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noins = 0
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norb = 26
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norbf = 26
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nrz = 15
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iorb type ibeta ang. mom. m position (alat)
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1 1 1 1 1 taunew( 1)=( 0.0000 0.0000 0.0000)
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2 1 1 1 2 taunew( 2)=( 0.0000 0.0000 0.0000)
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3 1 1 1 3 taunew( 3)=( 0.0000 0.0000 0.0000)
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4 1 2 2 1 taunew( 4)=( 0.0000 0.0000 0.0000)
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5 1 2 2 2 taunew( 5)=( 0.0000 0.0000 0.0000)
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6 1 2 2 3 taunew( 6)=( 0.0000 0.0000 0.0000)
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7 1 2 2 4 taunew( 7)=( 0.0000 0.0000 0.0000)
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8 1 2 2 5 taunew( 8)=( 0.0000 0.0000 0.0000)
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9 1 3 2 1 taunew( 9)=( 0.0000 0.0000 0.0000)
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10 1 3 2 2 taunew( 10)=( 0.0000 0.0000 0.0000)
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11 1 3 2 3 taunew( 11)=( 0.0000 0.0000 0.0000)
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12 1 3 2 4 taunew( 12)=( 0.0000 0.0000 0.0000)
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13 1 3 2 5 taunew( 13)=( 0.0000 0.0000 0.0000)
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14 1 1 1 1 taunew( 14)=( 0.0000 0.0000 0.3160)
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15 1 1 1 2 taunew( 15)=( 0.0000 0.0000 0.3160)
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16 1 1 1 3 taunew( 16)=( 0.0000 0.0000 0.3160)
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17 1 2 2 1 taunew( 17)=( 0.0000 0.0000 0.3160)
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18 1 2 2 2 taunew( 18)=( 0.0000 0.0000 0.3160)
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19 1 2 2 3 taunew( 19)=( 0.0000 0.0000 0.3160)
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20 1 2 2 4 taunew( 20)=( 0.0000 0.0000 0.3160)
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21 1 2 2 5 taunew( 21)=( 0.0000 0.0000 0.3160)
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22 1 3 2 1 taunew( 22)=( 0.0000 0.0000 0.3160)
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23 1 3 2 2 taunew( 23)=( 0.0000 0.0000 0.3160)
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24 1 3 2 3 taunew( 24)=( 0.0000 0.0000 0.3160)
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25 1 3 2 4 taunew( 25)=( 0.0000 0.0000 0.3160)
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26 1 3 2 5 taunew( 26)=( 0.0000 0.0000 0.3160)
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k slab z(k) z(k+1) crossing(iorb=1,norb)
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1 0.0000 0.0211 0.0211 11111111111110000000000000
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2 0.0211 0.0421 0.0211 11111111111110000000000000
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3 0.0421 0.0632 0.0211 11111111111110000000000000
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4 0.0632 0.0843 0.0211 11111111111110000000000000
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5 0.0843 0.1053 0.0211 11111111111111111111111111
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6 0.1053 0.1264 0.0211 11111111111111111111111111
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7 0.1264 0.1475 0.0211 11111111111111111111111111
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8 0.1475 0.1685 0.0211 11111111111111111111111111
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9 0.1685 0.1896 0.0211 11111111111111111111111111
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10 0.1896 0.2107 0.0211 11111111111111111111111111
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11 0.2107 0.2317 0.0211 11111111111111111111111111
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12 0.2317 0.2528 0.0211 00000000000001111111111111
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13 0.2528 0.2739 0.0211 00000000000001111111111111
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14 0.2739 0.2949 0.0211 00000000000001111111111111
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15 0.2949 0.3160 0.0211 00000000000001111111111111
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ngper, shell number = 437 58
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ngper, n2d = 437 122
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--- E-Ef = 1.0000000 k = 0.0000000 0.0000000
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--- ie = 1 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3438900 0.0000000 1.0000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3438900 0.0000000 1.0000000
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--- E-Ef = 0.9500000 k = 0.0000000 0.0000000
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--- ie = 2 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3416115 0.0000000 0.9500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3416115 0.0000000 0.9500000
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--- E-Ef = 0.9000000 k = 0.0000000 0.0000000
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--- ie = 3 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3392878 0.0000000 0.9000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3392878 0.0000000 0.9000000
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--- E-Ef = 0.8500000 k = 0.0000000 0.0000000
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--- ie = 4 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3369152 0.0000000 0.8500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3369152 0.0000000 0.8500000
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--- E-Ef = 0.8000000 k = 0.0000000 0.0000000
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--- ie = 5 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3344897 0.0000000 0.8000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3344897 0.0000000 0.8000000
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--- E-Ef = 0.7500000 k = 0.0000000 0.0000000
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--- ie = 6 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3320067 0.0000000 0.7500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3320067 0.0000000 0.7500000
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--- E-Ef = 0.7000000 k = 0.0000000 0.0000000
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--- ie = 7 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3294611 0.0000000 0.7000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3294611 0.0000000 0.7000000
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--- E-Ef = 0.6500000 k = 0.0000000 0.0000000
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--- ie = 8 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3268475 0.0000000 0.6500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3268475 0.0000000 0.6500000
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--- E-Ef = 0.6000000 k = 0.0000000 0.0000000
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--- ie = 9 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3241598 0.0000000 0.6000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3241598 -0.0000000 0.6000000
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--- E-Ef = 0.5500000 k = 0.0000000 0.0000000
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--- ie = 10 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3213914 0.0000000 0.5500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3213914 -0.0000000 0.5500000
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--- E-Ef = 0.5000000 k = 0.0000000 0.0000000
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--- ie = 11 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3185348 0.0000000 0.5000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3185348 -0.0000000 0.5000000
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--- E-Ef = 0.4500000 k = 0.0000000 0.0000000
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--- ie = 12 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3155820 0.0000000 0.4500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3155820 -0.0000000 0.4500000
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--- E-Ef = 0.4000000 k = 0.0000000 0.0000000
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--- ie = 13 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3125244 0.0000000 0.4000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3125244 -0.0000000 0.4000000
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--- E-Ef = 0.3500000 k = 0.0000000 0.0000000
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--- ie = 14 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3093522 0.0000000 0.3500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3093522 -0.0000000 0.3500000
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--- E-Ef = 0.3000000 k = 0.0000000 0.0000000
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--- ie = 15 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3060553 0.0000000 0.3000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3060553 -0.0000000 0.3000000
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--- E-Ef = 0.2500000 k = 0.0000000 0.0000000
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--- ie = 16 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.3026222 0.0000000 0.2500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.3026222 -0.0000000 0.2500000
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--- E-Ef = 0.2000000 k = 0.0000000 0.0000000
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--- ie = 17 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.2990413 0.0000000 0.2000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.2990413 -0.0000000 0.2000000
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--- E-Ef = 0.1500000 k = 0.0000000 0.0000000
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--- ie = 18 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.2952996 0.0000000 0.1500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.2952996 -0.0000000 0.1500000
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--- E-Ef = 0.1000000 k = 0.0000000 0.0000000
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--- ie = 19 ik = 1
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Nchannels of the left tip = 1
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.2913841 0.0000000 0.1000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.2913841 -0.0000000 0.1000000
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--- E-Ef = 0.0500000 k = 0.0000000 0.0000000
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--- ie = 20 ik = 1
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Nchannels of the left tip = 3
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0242920 0.0000000 0.0500000
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-0.0242920 0.0000000 0.0500000
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0.2872807 0.0000000 0.0500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0242920 0.0000000 0.0500000
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0.0242920 0.0000000 0.0500000
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-0.2872807 -0.0000000 0.0500000
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--- E-Ef = 0.0000000 k = 0.0000000 0.0000000
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--- ie = 21 ik = 1
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Nchannels of the left tip = 3
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0391006 0.0000000 0.0000000
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-0.0391006 0.0000000 0.0000000
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0.2829753 0.0000000 0.0000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0391006 0.0000000 0.0000000
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0.0391006 0.0000000 0.0000000
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-0.2829753 -0.0000000 0.0000000
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--- E-Ef = -0.0500000 k = 0.0000000 0.0000000
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--- ie = 22 ik = 1
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Nchannels of the left tip = 3
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0499361 0.0000000 -0.0500000
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-0.0499361 0.0000000 -0.0500000
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0.2784535 0.0000000 -0.0500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0499361 0.0000000 -0.0500000
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0.0499361 0.0000000 -0.0500000
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-0.2784535 -0.0000000 -0.0500000
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--- E-Ef = -0.1000000 k = 0.0000000 0.0000000
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--- ie = 23 ik = 1
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Nchannels of the left tip = 4
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0590321 0.0000000 -0.1000000
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-0.0590321 0.0000000 -0.1000000
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0.2737009 0.0000000 -0.1000000
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0.4753378 -0.0000000 -0.1000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0590321 0.0000000 -0.1000000
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0.0590321 0.0000000 -0.1000000
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-0.2737009 -0.0000000 -0.1000000
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-0.4753378 -0.0000000 -0.1000000
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--- E-Ef = -0.1500000 k = 0.0000000 0.0000000
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--- ie = 24 ik = 1
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Nchannels of the left tip = 4
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0671030 0.0000000 -0.1500000
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-0.0671030 0.0000000 -0.1500000
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0.2687035 0.0000000 -0.1500000
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0.4505741 -0.0000000 -0.1500000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0671030 0.0000000 -0.1500000
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0.0671030 0.0000000 -0.1500000
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-0.2687035 -0.0000000 -0.1500000
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-0.4505741 -0.0000000 -0.1500000
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--- E-Ef = -0.2000000 k = 0.0000000 0.0000000
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--- ie = 25 ik = 1
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Nchannels of the left tip = 4
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Right moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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-0.0744859 0.0000000 -0.2000000
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-0.0744859 0.0000000 -0.2000000
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0.2634475 0.0000000 -0.2000000
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0.4348190 -0.0000000 -0.2000000
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Left moving states:
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k1(2pi/a) k2(2pi/a) E-Ef (eV)
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0.0744859 0.0000000 -0.2000000
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0.0744859 0.0000000 -0.2000000
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-0.2634475 -0.0000000 -0.2000000
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-0.4348190 -0.0000000 -0.2000000
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--- E-Ef = -0.2500000 k = 0.0000000 0.0000000
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--- ie = 26 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0813714 0.0000000 -0.2500000
|
|
-0.0813714 0.0000000 -0.2500000
|
|
0.2579195 0.0000000 -0.2500000
|
|
0.4224058 -0.0000000 -0.2500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0813714 0.0000000 -0.2500000
|
|
0.0813714 0.0000000 -0.2500000
|
|
-0.2579195 -0.0000000 -0.2500000
|
|
-0.4224058 -0.0000000 -0.2500000
|
|
|
|
--- E-Ef = -0.3000000 k = 0.0000000 0.0000000
|
|
--- ie = 27 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0878793 0.0000000 -0.3000000
|
|
-0.0878793 0.0000000 -0.3000000
|
|
0.2521068 0.0000000 -0.3000000
|
|
0.4119315 -0.0000000 -0.3000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0878793 0.0000000 -0.3000000
|
|
0.0878793 0.0000000 -0.3000000
|
|
-0.2521068 -0.0000000 -0.3000000
|
|
-0.4119315 -0.0000000 -0.3000000
|
|
|
|
--- E-Ef = -0.3500000 k = 0.0000000 0.0000000
|
|
--- ie = 28 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0940910 0.0000000 -0.3500000
|
|
-0.0940910 0.0000000 -0.3500000
|
|
0.2459970 -0.0000000 -0.3500000
|
|
0.4027834 -0.0000000 -0.3500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0940910 0.0000000 -0.3500000
|
|
0.0940910 0.0000000 -0.3500000
|
|
-0.2459970 -0.0000000 -0.3500000
|
|
-0.4027834 -0.0000000 -0.3500000
|
|
|
|
--- E-Ef = -0.4000000 k = 0.0000000 0.0000000
|
|
--- ie = 29 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1000645 0.0000000 -0.4000000
|
|
-0.1000645 0.0000000 -0.4000000
|
|
0.2395774 -0.0000000 -0.4000000
|
|
0.3946267 -0.0000000 -0.4000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1000645 0.0000000 -0.4000000
|
|
0.1000645 0.0000000 -0.4000000
|
|
-0.2395774 -0.0000000 -0.4000000
|
|
-0.3946267 -0.0000000 -0.4000000
|
|
|
|
--- E-Ef = -0.4500000 k = 0.0000000 0.0000000
|
|
--- ie = 30 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1058431 0.0000000 -0.4500000
|
|
-0.1058431 0.0000000 -0.4500000
|
|
0.2328350 -0.0000000 -0.4500000
|
|
0.3872530 -0.0000000 -0.4500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1058431 0.0000000 -0.4500000
|
|
0.1058431 0.0000000 -0.4500000
|
|
-0.2328350 -0.0000000 -0.4500000
|
|
-0.3872530 -0.0000000 -0.4500000
|
|
|
|
--- E-Ef = -0.5000000 k = 0.0000000 0.0000000
|
|
--- ie = 31 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1114598 0.0000000 -0.5000000
|
|
-0.1114598 0.0000000 -0.5000000
|
|
0.2257556 -0.0000000 -0.5000000
|
|
0.3805201 -0.0000000 -0.5000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1114598 0.0000000 -0.5000000
|
|
0.1114598 0.0000000 -0.5000000
|
|
-0.2257556 -0.0000000 -0.5000000
|
|
-0.3805201 -0.0000000 -0.5000000
|
|
|
|
--- E-Ef = -0.5500000 k = 0.0000000 0.0000000
|
|
--- ie = 32 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1169410 0.0000000 -0.5500000
|
|
-0.1169410 0.0000000 -0.5500000
|
|
0.2183228 -0.0000000 -0.5500000
|
|
0.3743250 -0.0000000 -0.5500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1169410 0.0000000 -0.5500000
|
|
0.1169410 0.0000000 -0.5500000
|
|
-0.2183228 -0.0000000 -0.5500000
|
|
-0.3743250 -0.0000000 -0.5500000
|
|
|
|
--- E-Ef = -0.6000000 k = 0.0000000 0.0000000
|
|
--- ie = 33 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1223077 0.0000000 -0.6000000
|
|
-0.1223077 0.0000000 -0.6000000
|
|
0.2105166 -0.0000000 -0.6000000
|
|
0.3685888 -0.0000000 -0.6000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1223077 0.0000000 -0.6000000
|
|
0.1223077 0.0000000 -0.6000000
|
|
-0.2105166 -0.0000000 -0.6000000
|
|
-0.3685888 -0.0000000 -0.6000000
|
|
|
|
--- E-Ef = -0.6500000 k = 0.0000000 0.0000000
|
|
--- ie = 34 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1275775 0.0000000 -0.6500000
|
|
-0.1275775 0.0000000 -0.6500000
|
|
0.2023122 -0.0000000 -0.6500000
|
|
0.3632488 -0.0000000 -0.6500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1275775 0.0000000 -0.6500000
|
|
0.1275775 0.0000000 -0.6500000
|
|
-0.2023122 -0.0000000 -0.6500000
|
|
-0.3632488 -0.0000000 -0.6500000
|
|
|
|
--- E-Ef = -0.7000000 k = 0.0000000 0.0000000
|
|
--- ie = 35 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1327647 0.0000000 -0.7000000
|
|
-0.1327647 0.0000000 -0.7000000
|
|
0.1936779 -0.0000000 -0.7000000
|
|
0.3582539 -0.0000000 -0.7000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1327647 0.0000000 -0.7000000
|
|
0.1327647 0.0000000 -0.7000000
|
|
-0.1936779 -0.0000000 -0.7000000
|
|
-0.3582539 -0.0000000 -0.7000000
|
|
|
|
--- E-Ef = -0.7500000 k = 0.0000000 0.0000000
|
|
--- ie = 36 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1378818 0.0000000 -0.7500000
|
|
-0.1378818 0.0000000 -0.7500000
|
|
0.1845721 -0.0000000 -0.7500000
|
|
0.3535612 -0.0000000 -0.7500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1378818 0.0000000 -0.7500000
|
|
0.1378818 0.0000000 -0.7500000
|
|
-0.1845721 -0.0000000 -0.7500000
|
|
-0.3535612 -0.0000000 -0.7500000
|
|
|
|
--- E-Ef = -0.8000000 k = 0.0000000 0.0000000
|
|
--- ie = 37 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1429395 0.0000000 -0.8000000
|
|
-0.1429395 0.0000000 -0.8000000
|
|
0.1749398 -0.0000000 -0.8000000
|
|
0.3491343 -0.0000000 -0.8000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1429395 0.0000000 -0.8000000
|
|
0.1429395 0.0000000 -0.8000000
|
|
-0.1749398 -0.0000000 -0.8000000
|
|
-0.3491343 -0.0000000 -0.8000000
|
|
|
|
--- E-Ef = -0.8500000 k = 0.0000000 0.0000000
|
|
--- ie = 38 ik = 1
|
|
Nchannels of the left tip = 4
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1479470 0.0000000 -0.8500000
|
|
-0.1479470 0.0000000 -0.8500000
|
|
0.1647067 -0.0000000 -0.8500000
|
|
0.3449421 -0.0000000 -0.8500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1479470 0.0000000 -0.8500000
|
|
0.1479470 0.0000000 -0.8500000
|
|
-0.1647067 -0.0000000 -0.8500000
|
|
-0.3449421 -0.0000000 -0.8500000
|
|
|
|
--- E-Ef = -0.9000000 k = 0.0000000 0.0000000
|
|
--- ie = 39 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1529125 0.0000000 -0.9000000
|
|
-0.1529125 0.0000000 -0.9000000
|
|
0.1537706 -0.0000000 -0.9000000
|
|
0.3409574 -0.0000000 -0.9000000
|
|
0.4191992 -0.0000000 -0.9000000
|
|
0.4195293 -0.0000000 -0.9000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1529125 0.0000000 -0.9000000
|
|
0.1529125 0.0000000 -0.9000000
|
|
-0.1537706 -0.0000000 -0.9000000
|
|
-0.3409574 -0.0000000 -0.9000000
|
|
-0.4191992 -0.0000000 -0.9000000
|
|
-0.4195293 -0.0000000 -0.9000000
|
|
|
|
--- E-Ef = -0.9500000 k = 0.0000000 0.0000000
|
|
--- ie = 40 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1419860 -0.0000000 -0.9500000
|
|
-0.1578434 0.0000000 -0.9500000
|
|
-0.1578434 0.0000000 -0.9500000
|
|
0.3371566 -0.0000000 -0.9500000
|
|
0.3806307 -0.0000000 -0.9500000
|
|
0.3808231 -0.0000000 -0.9500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1419860 -0.0000000 -0.9500000
|
|
0.1578434 0.0000000 -0.9500000
|
|
0.1578434 0.0000000 -0.9500000
|
|
-0.3371566 -0.0000000 -0.9500000
|
|
-0.3806307 -0.0000000 -0.9500000
|
|
-0.3808231 -0.0000000 -0.9500000
|
|
|
|
--- E-Ef = -1.0000000 k = 0.0000000 0.0000000
|
|
--- ie = 41 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1291372 -0.0000000 -1.0000000
|
|
-0.1627462 0.0000000 -1.0000000
|
|
-0.1627462 0.0000000 -1.0000000
|
|
0.3335190 -0.0000000 -1.0000000
|
|
0.3500800 -0.0000000 -1.0000000
|
|
0.3502031 -0.0000000 -1.0000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1291372 -0.0000000 -1.0000000
|
|
0.1627462 0.0000000 -1.0000000
|
|
0.1627462 0.0000000 -1.0000000
|
|
-0.3335190 -0.0000000 -1.0000000
|
|
-0.3500800 -0.0000000 -1.0000000
|
|
-0.3502031 -0.0000000 -1.0000000
|
|
|
|
--- E-Ef = -1.0500000 k = 0.0000000 0.0000000
|
|
--- ie = 42 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1148834 -0.0000000 -1.0500000
|
|
-0.1676270 0.0000000 -1.0500000
|
|
-0.1676270 0.0000000 -1.0500000
|
|
0.3231159 -0.0000000 -1.0500000
|
|
0.3231893 -0.0000000 -1.0500000
|
|
0.3300266 -0.0000000 -1.0500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1148834 -0.0000000 -1.0500000
|
|
0.1676270 0.0000000 -1.0500000
|
|
0.1676270 0.0000000 -1.0500000
|
|
-0.3231159 -0.0000000 -1.0500000
|
|
-0.3231893 -0.0000000 -1.0500000
|
|
-0.3300266 -0.0000000 -1.0500000
|
|
|
|
--- E-Ef = -1.1000000 k = 0.0000000 0.0000000
|
|
--- ie = 43 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0986333 -0.0000000 -1.1000000
|
|
-0.1724913 0.0000000 -1.1000000
|
|
-0.1724913 0.0000000 -1.1000000
|
|
0.2980472 -0.0000000 -1.1000000
|
|
0.2980783 -0.0000000 -1.1000000
|
|
0.3266633 -0.0000000 -1.1000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0986333 -0.0000000 -1.1000000
|
|
0.1724913 0.0000000 -1.1000000
|
|
0.1724913 0.0000000 -1.1000000
|
|
-0.2980472 -0.0000000 -1.1000000
|
|
-0.2980783 -0.0000000 -1.1000000
|
|
-0.3266633 -0.0000000 -1.1000000
|
|
|
|
--- E-Ef = -1.1500000 k = 0.0000000 0.0000000
|
|
--- ie = 44 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0791839 -0.0000000 -1.1500000
|
|
-0.1773442 0.0000000 -1.1500000
|
|
-0.1773442 0.0000000 -1.1500000
|
|
0.2739428 -0.0000000 -1.1500000
|
|
0.2739517 -0.0000000 -1.1500000
|
|
0.3234150 -0.0000000 -1.1500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0791839 -0.0000000 -1.1500000
|
|
0.1773442 0.0000000 -1.1500000
|
|
0.1773442 0.0000000 -1.1500000
|
|
-0.2739517 -0.0000000 -1.1500000
|
|
-0.2739517 -0.0000000 -1.1500000
|
|
-0.3234150 -0.0000000 -1.1500000
|
|
|
|
--- E-Ef = -1.2000000 k = 0.0000000 0.0000000
|
|
--- ie = 45 ik = 1
|
|
Nchannels of the left tip = 6
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0531518 -0.0000000 -1.2000000
|
|
-0.1821908 0.0000000 -1.2000000
|
|
-0.1821908 0.0000000 -1.2000000
|
|
0.2501418 -0.0000000 -1.2000000
|
|
0.2501916 -0.0000000 -1.2000000
|
|
0.3202693 -0.0000000 -1.2000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0531518 -0.0000000 -1.2000000
|
|
0.1821908 0.0000000 -1.2000000
|
|
0.1821908 0.0000000 -1.2000000
|
|
-0.2501418 -0.0000000 -1.2000000
|
|
-0.2501916 -0.0000000 -1.2000000
|
|
-0.3202693 -0.0000000 -1.2000000
|
|
|
|
--- E-Ef = -1.2500000 k = 0.0000000 0.0000000
|
|
--- ie = 46 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1870354 0.0000000 -1.2500000
|
|
-0.1870354 0.0000000 -1.2500000
|
|
0.2261274 -0.0000000 -1.2500000
|
|
0.2262217 -0.0000000 -1.2500000
|
|
0.3172152 -0.0000000 -1.2500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1870354 0.0000000 -1.2500000
|
|
0.1870354 0.0000000 -1.2500000
|
|
-0.2261274 -0.0000000 -1.2500000
|
|
-0.2262217 -0.0000000 -1.2500000
|
|
-0.3172152 -0.0000000 -1.2500000
|
|
|
|
--- E-Ef = -1.3000000 k = 0.0000000 0.0000000
|
|
--- ie = 47 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1918826 0.0000000 -1.3000000
|
|
-0.1918826 0.0000000 -1.3000000
|
|
0.2013206 -0.0000000 -1.3000000
|
|
0.2014667 -0.0000000 -1.3000000
|
|
0.3142427 -0.0000000 -1.3000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1918826 0.0000000 -1.3000000
|
|
0.1918826 0.0000000 -1.3000000
|
|
-0.2013206 -0.0000000 -1.3000000
|
|
-0.2014667 -0.0000000 -1.3000000
|
|
-0.3142427 -0.0000000 -1.3000000
|
|
|
|
--- E-Ef = -1.3500000 k = 0.0000000 0.0000000
|
|
--- ie = 48 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1749698 -0.0000000 -1.3500000
|
|
0.1751806 -0.0000000 -1.3500000
|
|
-0.1967367 0.0000000 -1.3500000
|
|
-0.1967367 0.0000000 -1.3500000
|
|
0.3113434 -0.0000000 -1.3500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1749698 -0.0000000 -1.3500000
|
|
-0.1751806 -0.0000000 -1.3500000
|
|
0.1967367 0.0000000 -1.3500000
|
|
0.1967367 0.0000000 -1.3500000
|
|
-0.3113434 -0.0000000 -1.3500000
|
|
|
|
--- E-Ef = -1.4000000 k = 0.0000000 0.0000000
|
|
--- ie = 49 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1458703 -0.0000000 -1.4000000
|
|
0.1461714 -0.0000000 -1.4000000
|
|
-0.2016017 0.0000000 -1.4000000
|
|
-0.2016017 0.0000000 -1.4000000
|
|
0.3085093 -0.0000000 -1.4000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1458703 -0.0000000 -1.4000000
|
|
-0.1461714 -0.0000000 -1.4000000
|
|
0.2016017 0.0000000 -1.4000000
|
|
0.2016017 0.0000000 -1.4000000
|
|
-0.3085093 -0.0000000 -1.4000000
|
|
|
|
--- E-Ef = -1.4500000 k = 0.0000000 0.0000000
|
|
--- ie = 50 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1115233 -0.0000000 -1.4500000
|
|
0.1119769 -0.0000000 -1.4500000
|
|
-0.2064819 0.0000000 -1.4500000
|
|
-0.2064819 0.0000000 -1.4500000
|
|
0.3057335 -0.0000000 -1.4500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1115233 -0.0000000 -1.4500000
|
|
-0.1119769 -0.0000000 -1.4500000
|
|
0.2064819 0.0000000 -1.4500000
|
|
0.2064819 0.0000000 -1.4500000
|
|
-0.3057335 -0.0000000 -1.4500000
|
|
|
|
--- E-Ef = -1.5000000 k = 0.0000000 0.0000000
|
|
--- ie = 51 ik = 1
|
|
Nchannels of the left tip = 5
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.0634543 -0.0000000 -1.5000000
|
|
0.0643489 -0.0000000 -1.5000000
|
|
-0.2113812 0.0000000 -1.5000000
|
|
-0.2113812 0.0000000 -1.5000000
|
|
0.3030100 -0.0000000 -1.5000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.0634543 -0.0000000 -1.5000000
|
|
-0.0643489 -0.0000000 -1.5000000
|
|
0.2113812 0.0000000 -1.5000000
|
|
0.2113812 0.0000000 -1.5000000
|
|
-0.3030100 -0.0000000 -1.5000000
|
|
|
|
--- E-Ef = -1.5500000 k = 0.0000000 0.0000000
|
|
--- ie = 52 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2163038 0.0000000 -1.5500000
|
|
-0.2163038 0.0000000 -1.5500000
|
|
0.3003330 -0.0000000 -1.5500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2163038 0.0000000 -1.5500000
|
|
0.2163038 0.0000000 -1.5500000
|
|
-0.3003330 -0.0000000 -1.5500000
|
|
|
|
--- E-Ef = -1.6000000 k = 0.0000000 0.0000000
|
|
--- ie = 53 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2212538 0.0000000 -1.6000000
|
|
-0.2212538 0.0000000 -1.6000000
|
|
0.2976977 -0.0000000 -1.6000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2212538 0.0000000 -1.6000000
|
|
0.2212538 0.0000000 -1.6000000
|
|
-0.2976977 -0.0000000 -1.6000000
|
|
|
|
--- E-Ef = -1.6500000 k = 0.0000000 0.0000000
|
|
--- ie = 54 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2262354 0.0000000 -1.6500000
|
|
-0.2262354 0.0000000 -1.6500000
|
|
0.2950995 -0.0000000 -1.6500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2262354 0.0000000 -1.6500000
|
|
0.2262354 0.0000000 -1.6500000
|
|
-0.2950995 -0.0000000 -1.6500000
|
|
|
|
--- E-Ef = -1.7000000 k = 0.0000000 0.0000000
|
|
--- ie = 55 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2312530 0.0000000 -1.7000000
|
|
-0.2312530 0.0000000 -1.7000000
|
|
0.2925344 -0.0000000 -1.7000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2312530 0.0000000 -1.7000000
|
|
0.2312530 0.0000000 -1.7000000
|
|
-0.2925344 -0.0000000 -1.7000000
|
|
|
|
--- E-Ef = -1.7500000 k = 0.0000000 0.0000000
|
|
--- ie = 56 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2363109 0.0000000 -1.7500000
|
|
-0.2363109 0.0000000 -1.7500000
|
|
0.2899987 -0.0000000 -1.7500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2363109 0.0000000 -1.7500000
|
|
0.2363109 0.0000000 -1.7500000
|
|
-0.2899987 -0.0000000 -1.7500000
|
|
|
|
--- E-Ef = -1.8000000 k = 0.0000000 0.0000000
|
|
--- ie = 57 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2414140 0.0000000 -1.8000000
|
|
-0.2414140 0.0000000 -1.8000000
|
|
0.2874891 -0.0000000 -1.8000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2414140 0.0000000 -1.8000000
|
|
0.2414140 0.0000000 -1.8000000
|
|
-0.2874891 -0.0000000 -1.8000000
|
|
|
|
--- E-Ef = -1.8500000 k = 0.0000000 0.0000000
|
|
--- ie = 58 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2465671 0.0000000 -1.8500000
|
|
-0.2465671 0.0000000 -1.8500000
|
|
0.2850025 -0.0000000 -1.8500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2465671 0.0000000 -1.8500000
|
|
0.2465671 0.0000000 -1.8500000
|
|
-0.2850025 -0.0000000 -1.8500000
|
|
|
|
--- E-Ef = -1.9000000 k = 0.0000000 0.0000000
|
|
--- ie = 59 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2517754 0.0000000 -1.9000000
|
|
-0.2517754 0.0000000 -1.9000000
|
|
0.2825362 -0.0000000 -1.9000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2517754 0.0000000 -1.9000000
|
|
0.2517754 0.0000000 -1.9000000
|
|
-0.2825362 -0.0000000 -1.9000000
|
|
|
|
--- E-Ef = -1.9500000 k = 0.0000000 0.0000000
|
|
--- ie = 60 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2570445 0.0000000 -1.9500000
|
|
-0.2570445 0.0000000 -1.9500000
|
|
0.2800875 -0.0000000 -1.9500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2570445 0.0000000 -1.9500000
|
|
0.2570445 0.0000000 -1.9500000
|
|
-0.2800875 -0.0000000 -1.9500000
|
|
|
|
--- E-Ef = -2.0000000 k = 0.0000000 0.0000000
|
|
--- ie = 61 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2623802 0.0000000 -2.0000000
|
|
-0.2623802 0.0000000 -2.0000000
|
|
0.2776543 -0.0000000 -2.0000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2623802 0.0000000 -2.0000000
|
|
0.2623802 0.0000000 -2.0000000
|
|
-0.2776543 -0.0000000 -2.0000000
|
|
|
|
--- E-Ef = -2.0500000 k = 0.0000000 0.0000000
|
|
--- ie = 62 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2677892 0.0000000 -2.0500000
|
|
-0.2677892 0.0000000 -2.0500000
|
|
0.2752342 -0.0000000 -2.0500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2677892 0.0000000 -2.0500000
|
|
0.2677892 0.0000000 -2.0500000
|
|
-0.2752342 -0.0000000 -2.0500000
|
|
|
|
--- E-Ef = -2.1000000 k = 0.0000000 0.0000000
|
|
--- ie = 63 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2728254 -0.0000000 -2.1000000
|
|
-0.2732782 0.0000000 -2.1000000
|
|
-0.2732782 0.0000000 -2.1000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2728254 -0.0000000 -2.1000000
|
|
0.2732782 0.0000000 -2.1000000
|
|
0.2732782 0.0000000 -2.1000000
|
|
|
|
--- E-Ef = -2.1500000 k = 0.0000000 0.0000000
|
|
--- ie = 64 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2704260 -0.0000000 -2.1500000
|
|
-0.2788551 0.0000000 -2.1500000
|
|
-0.2788551 0.0000000 -2.1500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2704260 -0.0000000 -2.1500000
|
|
0.2788551 0.0000000 -2.1500000
|
|
0.2788551 0.0000000 -2.1500000
|
|
|
|
--- E-Ef = -2.2000000 k = 0.0000000 0.0000000
|
|
--- ie = 65 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2680342 -0.0000000 -2.2000000
|
|
-0.2845282 0.0000000 -2.2000000
|
|
-0.2845282 0.0000000 -2.2000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2680342 -0.0000000 -2.2000000
|
|
0.2845282 0.0000000 -2.2000000
|
|
0.2845282 0.0000000 -2.2000000
|
|
|
|
--- E-Ef = -2.2500000 k = 0.0000000 0.0000000
|
|
--- ie = 66 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2656484 -0.0000000 -2.2500000
|
|
-0.2903071 0.0000000 -2.2500000
|
|
-0.2903071 0.0000000 -2.2500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2656484 -0.0000000 -2.2500000
|
|
0.2903071 0.0000000 -2.2500000
|
|
0.2903071 0.0000000 -2.2500000
|
|
|
|
--- E-Ef = -2.3000000 k = 0.0000000 0.0000000
|
|
--- ie = 67 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2632672 -0.0000000 -2.3000000
|
|
-0.2962021 0.0000000 -2.3000000
|
|
-0.2962021 0.0000000 -2.3000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2632672 -0.0000000 -2.3000000
|
|
0.2962021 0.0000000 -2.3000000
|
|
0.2962021 0.0000000 -2.3000000
|
|
|
|
--- E-Ef = -2.3500000 k = 0.0000000 0.0000000
|
|
--- ie = 68 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2608890 -0.0000000 -2.3500000
|
|
-0.3022253 0.0000000 -2.3500000
|
|
-0.3022253 0.0000000 -2.3500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2608890 -0.0000000 -2.3500000
|
|
0.3022253 0.0000000 -2.3500000
|
|
0.3022253 0.0000000 -2.3500000
|
|
|
|
--- E-Ef = -2.4000000 k = 0.0000000 0.0000000
|
|
--- ie = 69 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2585126 -0.0000000 -2.4000000
|
|
-0.3083902 0.0000000 -2.4000000
|
|
-0.3083902 0.0000000 -2.4000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2585126 -0.0000000 -2.4000000
|
|
0.3083902 0.0000000 -2.4000000
|
|
0.3083902 0.0000000 -2.4000000
|
|
|
|
--- E-Ef = -2.4500000 k = 0.0000000 0.0000000
|
|
--- ie = 70 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2561367 -0.0000000 -2.4500000
|
|
-0.3147125 0.0000000 -2.4500000
|
|
-0.3147125 0.0000000 -2.4500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2561367 -0.0000000 -2.4500000
|
|
0.3147125 0.0000000 -2.4500000
|
|
0.3147125 0.0000000 -2.4500000
|
|
|
|
--- E-Ef = -2.5000000 k = 0.0000000 0.0000000
|
|
--- ie = 71 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2537601 -0.0000000 -2.5000000
|
|
-0.3212101 0.0000000 -2.5000000
|
|
-0.3212101 0.0000000 -2.5000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2537601 -0.0000000 -2.5000000
|
|
0.3212101 0.0000000 -2.5000000
|
|
0.3212101 0.0000000 -2.5000000
|
|
|
|
--- E-Ef = -2.5500000 k = 0.0000000 0.0000000
|
|
--- ie = 72 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2513815 -0.0000000 -2.5500000
|
|
-0.3279044 0.0000000 -2.5500000
|
|
-0.3279044 0.0000000 -2.5500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2513815 -0.0000000 -2.5500000
|
|
0.3279044 0.0000000 -2.5500000
|
|
0.3279044 0.0000000 -2.5500000
|
|
|
|
--- E-Ef = -2.6000000 k = 0.0000000 0.0000000
|
|
--- ie = 73 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2489999 -0.0000000 -2.6000000
|
|
-0.3348208 0.0000000 -2.6000000
|
|
-0.3348208 0.0000000 -2.6000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2489999 -0.0000000 -2.6000000
|
|
0.3348208 0.0000000 -2.6000000
|
|
0.3348208 0.0000000 -2.6000000
|
|
|
|
--- E-Ef = -2.6500000 k = 0.0000000 0.0000000
|
|
--- ie = 74 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2466142 -0.0000000 -2.6500000
|
|
-0.3419897 0.0000000 -2.6500000
|
|
-0.3419897 0.0000000 -2.6500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2466142 -0.0000000 -2.6500000
|
|
0.3419897 0.0000000 -2.6500000
|
|
0.3419897 0.0000000 -2.6500000
|
|
|
|
--- E-Ef = -2.7000000 k = 0.0000000 0.0000000
|
|
--- ie = 75 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2442234 -0.0000000 -2.7000000
|
|
-0.3494487 0.0000000 -2.7000000
|
|
-0.3494487 0.0000000 -2.7000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2442234 -0.0000000 -2.7000000
|
|
0.3494487 0.0000000 -2.7000000
|
|
0.3494487 0.0000000 -2.7000000
|
|
|
|
--- E-Ef = -2.7500000 k = 0.0000000 0.0000000
|
|
--- ie = 76 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2418263 -0.0000000 -2.7500000
|
|
-0.3572446 0.0000000 -2.7500000
|
|
-0.3572446 0.0000000 -2.7500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2418263 -0.0000000 -2.7500000
|
|
0.3572446 0.0000000 -2.7500000
|
|
0.3572446 0.0000000 -2.7500000
|
|
|
|
--- E-Ef = -2.8000000 k = 0.0000000 0.0000000
|
|
--- ie = 77 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2394220 -0.0000000 -2.8000000
|
|
-0.3654373 0.0000000 -2.8000000
|
|
-0.3654373 0.0000000 -2.8000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2394220 -0.0000000 -2.8000000
|
|
0.3654373 0.0000000 -2.8000000
|
|
0.3654373 0.0000000 -2.8000000
|
|
|
|
--- E-Ef = -2.8500000 k = 0.0000000 0.0000000
|
|
--- ie = 78 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2370095 -0.0000000 -2.8500000
|
|
-0.3741058 0.0000000 -2.8500000
|
|
-0.3741058 0.0000000 -2.8500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2370095 -0.0000000 -2.8500000
|
|
0.3741058 0.0000000 -2.8500000
|
|
0.3741058 0.0000000 -2.8500000
|
|
|
|
--- E-Ef = -2.9000000 k = 0.0000000 0.0000000
|
|
--- ie = 79 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2345879 -0.0000000 -2.9000000
|
|
-0.3833576 0.0000000 -2.9000000
|
|
-0.3833576 0.0000000 -2.9000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2345879 -0.0000000 -2.9000000
|
|
0.3833576 0.0000000 -2.9000000
|
|
0.3833576 0.0000000 -2.9000000
|
|
|
|
--- E-Ef = -2.9500000 k = 0.0000000 0.0000000
|
|
--- ie = 80 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2321562 -0.0000000 -2.9500000
|
|
-0.3933461 0.0000000 -2.9500000
|
|
-0.3933461 0.0000000 -2.9500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2321562 -0.0000000 -2.9500000
|
|
0.3933461 0.0000000 -2.9500000
|
|
0.3933461 0.0000000 -2.9500000
|
|
|
|
--- E-Ef = -3.0000000 k = 0.0000000 0.0000000
|
|
--- ie = 81 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2297134 -0.0000000 -3.0000000
|
|
-0.4043031 0.0000000 -3.0000000
|
|
-0.4043031 0.0000000 -3.0000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2297134 -0.0000000 -3.0000000
|
|
0.4043031 0.0000000 -3.0000000
|
|
0.4043031 0.0000000 -3.0000000
|
|
|
|
--- E-Ef = -3.0500000 k = 0.0000000 0.0000000
|
|
--- ie = 82 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2272585 -0.0000000 -3.0500000
|
|
-0.4166115 0.0000000 -3.0500000
|
|
-0.4166115 0.0000000 -3.0500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2272585 -0.0000000 -3.0500000
|
|
0.4166115 0.0000000 -3.0500000
|
|
0.4166115 0.0000000 -3.0500000
|
|
|
|
--- E-Ef = -3.1000000 k = 0.0000000 0.0000000
|
|
--- ie = 83 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2247906 -0.0000000 -3.1000000
|
|
-0.4309929 0.0000000 -3.1000000
|
|
-0.4309929 0.0000000 -3.1000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2247906 -0.0000000 -3.1000000
|
|
0.4309929 0.0000000 -3.1000000
|
|
0.4309929 0.0000000 -3.1000000
|
|
|
|
--- E-Ef = -3.1500000 k = 0.0000000 0.0000000
|
|
--- ie = 84 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2223088 -0.0000000 -3.1500000
|
|
-0.4491803 0.0000000 -3.1500000
|
|
-0.4491803 0.0000000 -3.1500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2223088 -0.0000000 -3.1500000
|
|
0.4491803 0.0000000 -3.1500000
|
|
0.4491803 0.0000000 -3.1500000
|
|
|
|
--- E-Ef = -3.2000000 k = 0.0000000 0.0000000
|
|
--- ie = 85 ik = 1
|
|
Nchannels of the left tip = 3
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2198120 -0.0000000 -3.2000000
|
|
-0.4796200 0.0000000 -3.2000000
|
|
-0.4796200 0.0000000 -3.2000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2198120 -0.0000000 -3.2000000
|
|
0.4796200 0.0000000 -3.2000000
|
|
0.4796200 0.0000000 -3.2000000
|
|
|
|
--- E-Ef = -3.2500000 k = 0.0000000 0.0000000
|
|
--- ie = 86 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2172992 -0.0000000 -3.2500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2172992 -0.0000000 -3.2500000
|
|
|
|
--- E-Ef = -3.3000000 k = 0.0000000 0.0000000
|
|
--- ie = 87 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2147694 -0.0000000 -3.3000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2147694 -0.0000000 -3.3000000
|
|
|
|
--- E-Ef = -3.3500000 k = 0.0000000 0.0000000
|
|
--- ie = 88 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2122216 -0.0000000 -3.3500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2122216 -0.0000000 -3.3500000
|
|
|
|
--- E-Ef = -3.4000000 k = 0.0000000 0.0000000
|
|
--- ie = 89 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2096547 -0.0000000 -3.4000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2096547 -0.0000000 -3.4000000
|
|
|
|
--- E-Ef = -3.4500000 k = 0.0000000 0.0000000
|
|
--- ie = 90 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2070675 -0.0000000 -3.4500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2070675 -0.0000000 -3.4500000
|
|
|
|
--- E-Ef = -3.5000000 k = 0.0000000 0.0000000
|
|
--- ie = 91 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2044590 -0.0000000 -3.5000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2044590 -0.0000000 -3.5000000
|
|
|
|
--- E-Ef = -3.5500000 k = 0.0000000 0.0000000
|
|
--- ie = 92 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.2018279 -0.0000000 -3.5500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.2018279 -0.0000000 -3.5500000
|
|
|
|
--- E-Ef = -3.6000000 k = 0.0000000 0.0000000
|
|
--- ie = 93 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1991730 -0.0000000 -3.6000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1991730 -0.0000000 -3.6000000
|
|
|
|
--- E-Ef = -3.6500000 k = 0.0000000 0.0000000
|
|
--- ie = 94 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1964931 -0.0000000 -3.6500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1964931 -0.0000000 -3.6500000
|
|
|
|
--- E-Ef = -3.7000000 k = 0.0000000 0.0000000
|
|
--- ie = 95 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1937866 -0.0000000 -3.7000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1937866 -0.0000000 -3.7000000
|
|
|
|
--- E-Ef = -3.7500000 k = 0.0000000 0.0000000
|
|
--- ie = 96 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1910522 -0.0000000 -3.7500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1910522 -0.0000000 -3.7500000
|
|
|
|
--- E-Ef = -3.8000000 k = 0.0000000 0.0000000
|
|
--- ie = 97 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1882885 -0.0000000 -3.8000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1882885 -0.0000000 -3.8000000
|
|
|
|
--- E-Ef = -3.8500000 k = 0.0000000 0.0000000
|
|
--- ie = 98 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1854937 -0.0000000 -3.8500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1854937 -0.0000000 -3.8500000
|
|
|
|
--- E-Ef = -3.9000000 k = 0.0000000 0.0000000
|
|
--- ie = 99 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1826662 -0.0000000 -3.9000000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1826662 -0.0000000 -3.9000000
|
|
|
|
--- E-Ef = -3.9500000 k = 0.0000000 0.0000000
|
|
--- ie = 100 ik = 1
|
|
Nchannels of the left tip = 1
|
|
Right moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
0.1798042 -0.0000000 -3.9500000
|
|
Left moving states:
|
|
k1(2pi/a) k2(2pi/a) E-Ef (eV)
|
|
-0.1798042 -0.0000000 -3.9500000
|
|
|
|
|
|
PWCOND : 1m 8.44s CPU 1m21.38s WALL
|
|
|
|
init : 0.92s CPU 0.95s WALL ( 1 calls)
|
|
poten : 0.00s CPU 0.00s WALL ( 1 calls)
|
|
local : 1.02s CPU 1.03s WALL ( 1 calls)
|
|
|
|
scatter_forw : 50.32s CPU 50.36s WALL ( 100 calls)
|
|
|
|
compbs : 16.11s CPU 16.11s WALL ( 100 calls)
|
|
compbs_2 : 14.78s CPU 14.78s WALL ( 100 calls)
|
|
|