Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 23:22:24 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Hg.save/ file Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 71 29 8 3634 954 144 Max 72 30 9 3637 989 148 Sum 5133 2111 603 261777 69599 10461 bravais-lattice index = 14 lattice parameter (alat) = 12.9730 a.u. unit-cell volume = 1827.4445 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 1 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 43.0000 Ry charge density cutoff = 416.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.972969 celldm(2)= 0.920029 celldm(3)= 0.998980 celldm(4)= 0.413104 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 0.920029 0.000000 ) a(3) = ( 0.000000 0.412683 0.909755 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.086922 -0.493050 ) b(3) = ( 0.000000 0.000000 1.099197 ) PseudoPot. # 1 for Hg read from file: /users/gautes/Pseudo/Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: a7fd98bfb2640362c6e2ed76594f1960 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1279 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Hg 12.00 200.59000 Hg( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.2063416 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4548775 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) f =( -0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.2063416 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.4548775 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,0,0] -C2 -2 180 deg rotation - cart. axis [1,0,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,0,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,0,0] E Cartesian axes number of k points= 228 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 2) = ( 0.0000000 0.0000000 0.0211384), wk = 0.0043860 k( 3) = ( 0.0000000 0.0000000 0.0422768), wk = 0.0043860 k( 4) = ( 0.0000000 0.0000000 0.0634152), wk = 0.0043860 k( 5) = ( 0.0000000 0.0000000 0.0845536), wk = 0.0043860 k( 6) = ( 0.0000000 0.0000000 0.1056920), wk = 0.0043860 k( 7) = ( 0.0000000 0.0000000 0.1268304), wk = 0.0043860 k( 8) = ( 0.0000000 0.0000000 0.1479688), wk = 0.0043860 k( 9) = ( 0.0000000 0.0000000 0.1691072), wk = 0.0043860 k( 10) = ( 0.0000000 0.0000000 0.1902456), wk = 0.0043860 k( 11) = ( 0.0000000 0.0000000 0.2113840), wk = 0.0043860 k( 12) = ( 0.0000000 0.0000000 0.2325224), wk = 0.0043860 k( 13) = ( 0.0000000 0.0000000 0.2536608), wk = 0.0043860 k( 14) = ( 0.0000000 0.0000000 0.2747992), wk = 0.0043860 k( 15) = ( 0.0000000 0.0000000 0.2959376), wk = 0.0043860 k( 16) = ( 0.0000000 0.0000000 0.3170760), wk = 0.0043860 k( 17) = ( 0.0000000 0.0000000 0.3382144), wk = 0.0043860 k( 18) = ( 0.0000000 0.0000000 0.3593529), wk = 0.0043860 k( 19) = ( 0.0000000 0.0000000 0.3804913), wk = 0.0043860 k( 20) = ( 0.0000000 0.0000000 0.4016297), wk = 0.0043860 k( 21) = ( 0.0000000 0.0000000 0.4227681), wk = 0.0043860 k( 22) = ( 0.0000000 0.0000000 0.4439065), wk = 0.0043860 k( 23) = ( 0.0000000 0.0000000 0.4650449), wk = 0.0043860 k( 24) = ( 0.0000000 0.0000000 0.4861833), wk = 0.0043860 k( 25) = ( 0.0000000 0.0000000 0.5073217), wk = 0.0043860 k( 26) = ( 0.0000000 0.0000000 0.5284601), wk = 0.0043860 k( 27) = ( 0.0000000 0.0000000 0.5495985), wk = 0.0043860 k( 28) = ( 0.0000000 0.0000000 0.5495985), wk = 0.0043860 k( 29) = ( 0.0000000 0.0213674 0.5495985), wk = 0.0043860 k( 30) = ( 0.0000000 0.0427348 0.5495985), wk = 0.0043860 k( 31) = ( 0.0000000 0.0641022 0.5495985), wk = 0.0043860 k( 32) = ( 0.0000000 0.0854696 0.5495985), wk = 0.0043860 k( 33) = ( 0.0000000 0.1068370 0.5495985), wk = 0.0043860 k( 34) = ( 0.0000000 0.1282045 0.5495985), wk = 0.0043860 k( 35) = ( 0.0000000 0.1495719 0.5495985), wk = 0.0043860 k( 36) = ( 0.0000000 0.1709393 0.5495985), wk = 0.0043860 k( 37) = ( 0.0000000 0.1923067 0.5495985), wk = 0.0043860 k( 38) = ( 0.0000000 0.2136741 0.5495985), wk = 0.0043860 k( 39) = ( 0.0000000 0.2350415 0.5495985), wk = 0.0043860 k( 40) = ( 0.0000000 0.2564089 0.5495985), wk = 0.0043860 k( 41) = ( 0.0000000 0.2777763 0.5495985), wk = 0.0043860 k( 42) = ( 0.0000000 0.2991437 0.5495985), wk = 0.0043860 k( 43) = ( 0.0000000 0.3205111 0.5495985), wk = 0.0043860 k( 44) = ( 0.0000000 0.3418785 0.5495985), wk = 0.0043860 k( 45) = ( 0.0000000 0.3632459 0.5495985), wk = 0.0043860 k( 46) = ( 0.0000000 0.3846134 0.5495985), wk = 0.0043860 k( 47) = ( 0.0000000 0.4059808 0.5495985), wk = 0.0043860 k( 48) = ( 0.0000000 0.4059808 0.5495985), wk = 0.0043860 k( 49) = ( 0.0000000 0.4165562 0.5306350), wk = 0.0043860 k( 50) = ( 0.0000000 0.4271316 0.5116716), wk = 0.0043860 k( 51) = ( 0.0000000 0.4377070 0.4927081), wk = 0.0043860 k( 52) = ( 0.0000000 0.4482824 0.4737447), wk = 0.0043860 k( 53) = ( 0.0000000 0.4588578 0.4547812), wk = 0.0043860 k( 54) = ( 0.0000000 0.4694332 0.4358178), wk = 0.0043860 k( 55) = ( 0.0000000 0.4800086 0.4168543), wk = 0.0043860 k( 56) = ( 0.0000000 0.4905840 0.3978909), wk = 0.0043860 k( 57) = ( 0.0000000 0.5011594 0.3789274), wk = 0.0043860 k( 58) = ( 0.0000000 0.5117348 0.3599640), wk = 0.0043860 k( 59) = ( 0.0000000 0.5223102 0.3410005), wk = 0.0043860 k( 60) = ( 0.0000000 0.5328856 0.3220371), wk = 0.0043860 k( 61) = ( 0.0000000 0.5434611 0.3030736), wk = 0.0043860 k( 62) = ( 0.0000000 0.5434611 0.3030736), wk = 0.0043860 k( 63) = ( 0.0217391 0.5434611 0.3030736), wk = 0.0043860 k( 64) = ( 0.0434783 0.5434611 0.3030736), wk = 0.0043860 k( 65) = ( 0.0652174 0.5434611 0.3030736), wk = 0.0043860 k( 66) = ( 0.0869565 0.5434611 0.3030736), wk = 0.0043860 k( 67) = ( 0.1086957 0.5434611 0.3030736), wk = 0.0043860 k( 68) = ( 0.1304348 0.5434611 0.3030736), wk = 0.0043860 k( 69) = ( 0.1521739 0.5434611 0.3030736), wk = 0.0043860 k( 70) = ( 0.1739130 0.5434611 0.3030736), wk = 0.0043860 k( 71) = ( 0.1956522 0.5434611 0.3030736), wk = 0.0043860 k( 72) = ( 0.2173913 0.5434611 0.3030736), wk = 0.0043860 k( 73) = ( 0.2391304 0.5434611 0.3030736), wk = 0.0043860 k( 74) = ( 0.2608696 0.5434611 0.3030736), wk = 0.0043860 k( 75) = ( 0.2826087 0.5434611 0.3030736), wk = 0.0043860 k( 76) = ( 0.3043478 0.5434611 0.3030736), wk = 0.0043860 k( 77) = ( 0.3260870 0.5434611 0.3030736), wk = 0.0043860 k( 78) = ( 0.3478261 0.5434611 0.3030736), wk = 0.0043860 k( 79) = ( 0.3695652 0.5434611 0.3030736), wk = 0.0043860 k( 80) = ( 0.3913044 0.5434611 0.3030736), wk = 0.0043860 k( 81) = ( 0.4130435 0.5434611 0.3030736), wk = 0.0043860 k( 82) = ( 0.4347826 0.5434611 0.3030736), wk = 0.0043860 k( 83) = ( 0.4565217 0.5434611 0.3030736), wk = 0.0043860 k( 84) = ( 0.4782609 0.5434611 0.3030736), wk = 0.0043860 k( 85) = ( 0.5000000 0.5434611 0.3030736), wk = 0.0043860 k( 86) = ( 0.5000000 0.5434611 0.3030736), wk = 0.0043860 k( 87) = ( 0.5000000 0.5540365 0.2841102), wk = 0.0043860 k( 88) = ( 0.5000000 0.5646119 0.2651467), wk = 0.0043860 k( 89) = ( 0.5000000 0.5751873 0.2461833), wk = 0.0043860 k( 90) = ( 0.5000000 0.5857627 0.2272198), wk = 0.0043860 k( 91) = ( 0.5000000 0.5963381 0.2082564), wk = 0.0043860 k( 92) = ( 0.5000000 0.6069135 0.1892929), wk = 0.0043860 k( 93) = ( 0.5000000 0.6174889 0.1703295), wk = 0.0043860 k( 94) = ( 0.5000000 0.6280643 0.1513660), wk = 0.0043860 k( 95) = ( 0.5000000 0.6386397 0.1324025), wk = 0.0043860 k( 96) = ( 0.5000000 0.6492151 0.1134391), wk = 0.0043860 k( 97) = ( 0.5000000 0.6597905 0.0944756), wk = 0.0043860 k( 98) = ( 0.5000000 0.6703659 0.0755122), wk = 0.0043860 k( 99) = ( 0.5000000 0.6809413 0.0565487), wk = 0.0043860 k( 100) = ( 0.5000000 0.6809413 0.0565487), wk = 0.0043860 k( 101) = ( 0.5000000 0.6723488 0.0376066), wk = 0.0043860 k( 102) = ( 0.5000000 0.6637563 0.0186645), wk = 0.0043860 k( 103) = ( 0.5000000 0.6551638 -0.0002776), wk = 0.0043860 k( 104) = ( 0.5000000 0.6465713 -0.0192197), wk = 0.0043860 k( 105) = ( 0.5000000 0.6379788 -0.0381618), wk = 0.0043860 k( 106) = ( 0.5000000 0.6293862 -0.0571039), wk = 0.0043860 k( 107) = ( 0.5000000 0.6207937 -0.0760460), wk = 0.0043860 k( 108) = ( 0.5000000 0.6122012 -0.0949881), wk = 0.0043860 k( 109) = ( 0.5000000 0.6036087 -0.1139302), wk = 0.0043860 k( 110) = ( 0.5000000 0.5950162 -0.1328723), wk = 0.0043860 k( 111) = ( 0.5000000 0.5864236 -0.1518144), wk = 0.0043860 k( 112) = ( 0.5000000 0.5778311 -0.1707565), wk = 0.0043860 k( 113) = ( 0.5000000 0.5692386 -0.1896986), wk = 0.0043860 k( 114) = ( 0.5000000 0.5606461 -0.2086407), wk = 0.0043860 k( 115) = ( 0.5000000 0.5520536 -0.2275828), wk = 0.0043860 k( 116) = ( 0.5000000 0.5434611 -0.2465249), wk = 0.0043860 k( 117) = ( 0.5000000 0.5434611 -0.2465249), wk = 0.0043860 k( 118) = ( 0.4782609 0.5434611 -0.2465249), wk = 0.0043860 k( 119) = ( 0.4565217 0.5434611 -0.2465249), wk = 0.0043860 k( 120) = ( 0.4347826 0.5434611 -0.2465249), wk = 0.0043860 k( 121) = ( 0.4130435 0.5434611 -0.2465249), wk = 0.0043860 k( 122) = ( 0.3913044 0.5434611 -0.2465249), wk = 0.0043860 k( 123) = ( 0.3695652 0.5434611 -0.2465249), wk = 0.0043860 k( 124) = ( 0.3478261 0.5434611 -0.2465249), wk = 0.0043860 k( 125) = ( 0.3260870 0.5434611 -0.2465249), wk = 0.0043860 k( 126) = ( 0.3043478 0.5434611 -0.2465249), wk = 0.0043860 k( 127) = ( 0.2826087 0.5434611 -0.2465249), wk = 0.0043860 k( 128) = ( 0.2608696 0.5434611 -0.2465249), wk = 0.0043860 k( 129) = ( 0.2391304 0.5434611 -0.2465249), wk = 0.0043860 k( 130) = ( 0.2173913 0.5434611 -0.2465249), wk = 0.0043860 k( 131) = ( 0.1956522 0.5434611 -0.2465249), wk = 0.0043860 k( 132) = ( 0.1739130 0.5434611 -0.2465249), wk = 0.0043860 k( 133) = ( 0.1521739 0.5434611 -0.2465249), wk = 0.0043860 k( 134) = ( 0.1304348 0.5434611 -0.2465249), wk = 0.0043860 k( 135) = ( 0.1086957 0.5434611 -0.2465249), wk = 0.0043860 k( 136) = ( 0.0869565 0.5434611 -0.2465249), wk = 0.0043860 k( 137) = ( 0.0652174 0.5434611 -0.2465249), wk = 0.0043860 k( 138) = ( 0.0434783 0.5434611 -0.2465249), wk = 0.0043860 k( 139) = ( 0.0217391 0.5434611 -0.2465249), wk = 0.0043860 k( 140) = ( 0.0000000 0.5434611 -0.2465249), wk = 0.0043860 k( 141) = ( 0.0000000 0.5434611 -0.2465249), wk = 0.0043860 k( 142) = ( 0.0000000 0.5520536 -0.2275828), wk = 0.0043860 k( 143) = ( 0.0000000 0.5606461 -0.2086407), wk = 0.0043860 k( 144) = ( 0.0000000 0.5692386 -0.1896986), wk = 0.0043860 k( 145) = ( 0.0000000 0.5778311 -0.1707565), wk = 0.0043860 k( 146) = ( 0.0000000 0.5864236 -0.1518144), wk = 0.0043860 k( 147) = ( 0.0000000 0.5950162 -0.1328723), wk = 0.0043860 k( 148) = ( 0.0000000 0.6036087 -0.1139302), wk = 0.0043860 k( 149) = ( 0.0000000 0.6122012 -0.0949881), wk = 0.0043860 k( 150) = ( 0.0000000 0.6207937 -0.0760460), wk = 0.0043860 k( 151) = ( 0.0000000 0.6293862 -0.0571039), wk = 0.0043860 k( 152) = ( 0.0000000 0.6379788 -0.0381618), wk = 0.0043860 k( 153) = ( 0.0000000 0.6465713 -0.0192197), wk = 0.0043860 k( 154) = ( 0.0000000 0.6551638 -0.0002776), wk = 0.0043860 k( 155) = ( 0.0000000 0.6637563 0.0186645), wk = 0.0043860 k( 156) = ( 0.0000000 0.6723488 0.0376066), wk = 0.0043860 k( 157) = ( 0.0000000 0.6809413 0.0565487), wk = 0.0043860 k( 158) = ( 0.5000000 0.4059808 0.5495985), wk = 0.0043860 k( 159) = ( 0.5000000 0.3846134 0.5495985), wk = 0.0043860 k( 160) = ( 0.5000000 0.3632459 0.5495985), wk = 0.0043860 k( 161) = ( 0.5000000 0.3418785 0.5495985), wk = 0.0043860 k( 162) = ( 0.5000000 0.3205111 0.5495985), wk = 0.0043860 k( 163) = ( 0.5000000 0.2991437 0.5495985), wk = 0.0043860 k( 164) = ( 0.5000000 0.2777763 0.5495985), wk = 0.0043860 k( 165) = ( 0.5000000 0.2564089 0.5495985), wk = 0.0043860 k( 166) = ( 0.5000000 0.2350415 0.5495985), wk = 0.0043860 k( 167) = ( 0.5000000 0.2136741 0.5495985), wk = 0.0043860 k( 168) = ( 0.5000000 0.1923067 0.5495985), wk = 0.0043860 k( 169) = ( 0.5000000 0.1709393 0.5495985), wk = 0.0043860 k( 170) = ( 0.5000000 0.1495719 0.5495985), wk = 0.0043860 k( 171) = ( 0.5000000 0.1282045 0.5495985), wk = 0.0043860 k( 172) = ( 0.5000000 0.1068370 0.5495985), wk = 0.0043860 k( 173) = ( 0.5000000 0.0854696 0.5495985), wk = 0.0043860 k( 174) = ( 0.5000000 0.0641022 0.5495985), wk = 0.0043860 k( 175) = ( 0.5000000 0.0427348 0.5495985), wk = 0.0043860 k( 176) = ( 0.5000000 0.0213674 0.5495985), wk = 0.0043860 k( 177) = ( 0.5000000 -0.0000000 0.5495985), wk = 0.0043860 k( 178) = ( 0.5000000 -0.0000000 0.5495985), wk = 0.0043860 k( 179) = ( 0.5000000 -0.0000000 0.5284601), wk = 0.0043860 k( 180) = ( 0.5000000 -0.0000000 0.5073217), wk = 0.0043860 k( 181) = ( 0.5000000 -0.0000000 0.4861833), wk = 0.0043860 k( 182) = ( 0.5000000 -0.0000000 0.4650449), wk = 0.0043860 k( 183) = ( 0.5000000 -0.0000000 0.4439065), wk = 0.0043860 k( 184) = ( 0.5000000 -0.0000000 0.4227681), wk = 0.0043860 k( 185) = ( 0.5000000 -0.0000000 0.4016297), wk = 0.0043860 k( 186) = ( 0.5000000 -0.0000000 0.3804913), wk = 0.0043860 k( 187) = ( 0.5000000 -0.0000000 0.3593529), wk = 0.0043860 k( 188) = ( 0.5000000 -0.0000000 0.3382144), wk = 0.0043860 k( 189) = ( 0.5000000 -0.0000000 0.3170760), wk = 0.0043860 k( 190) = ( 0.5000000 -0.0000000 0.2959376), wk = 0.0043860 k( 191) = ( 0.5000000 -0.0000000 0.2747992), wk = 0.0043860 k( 192) = ( 0.5000000 -0.0000000 0.2536608), wk = 0.0043860 k( 193) = ( 0.5000000 -0.0000000 0.2325224), wk = 0.0043860 k( 194) = ( 0.5000000 -0.0000000 0.2113840), wk = 0.0043860 k( 195) = ( 0.5000000 -0.0000000 0.1902456), wk = 0.0043860 k( 196) = ( 0.5000000 -0.0000000 0.1691072), wk = 0.0043860 k( 197) = ( 0.5000000 -0.0000000 0.1479688), wk = 0.0043860 k( 198) = ( 0.5000000 -0.0000000 0.1268304), wk = 0.0043860 k( 199) = ( 0.5000000 -0.0000000 0.1056920), wk = 0.0043860 k( 200) = ( 0.5000000 -0.0000000 0.0845536), wk = 0.0043860 k( 201) = ( 0.5000000 -0.0000000 0.0634152), wk = 0.0043860 k( 202) = ( 0.5000000 -0.0000000 0.0422768), wk = 0.0043860 k( 203) = ( 0.5000000 -0.0000000 0.0211384), wk = 0.0043860 k( 204) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0043860 k( 205) = ( 0.0000000 0.0000000 0.5495985), wk = 0.0043860 k( 206) = ( 0.0217391 -0.0000000 0.5495985), wk = 0.0043860 k( 207) = ( 0.0434783 -0.0000000 0.5495985), wk = 0.0043860 k( 208) = ( 0.0652174 -0.0000000 0.5495985), wk = 0.0043860 k( 209) = ( 0.0869565 -0.0000000 0.5495985), wk = 0.0043860 k( 210) = ( 0.1086957 -0.0000000 0.5495985), wk = 0.0043860 k( 211) = ( 0.1304348 -0.0000000 0.5495985), wk = 0.0043860 k( 212) = ( 0.1521739 -0.0000000 0.5495985), wk = 0.0043860 k( 213) = ( 0.1739130 -0.0000000 0.5495985), wk = 0.0043860 k( 214) = ( 0.1956522 -0.0000000 0.5495985), wk = 0.0043860 k( 215) = ( 0.2173913 -0.0000000 0.5495985), wk = 0.0043860 k( 216) = ( 0.2391304 -0.0000000 0.5495985), wk = 0.0043860 k( 217) = ( 0.2608696 -0.0000000 0.5495985), wk = 0.0043860 k( 218) = ( 0.2826087 -0.0000000 0.5495985), wk = 0.0043860 k( 219) = ( 0.3043478 -0.0000000 0.5495985), wk = 0.0043860 k( 220) = ( 0.3260870 -0.0000000 0.5495985), wk = 0.0043860 k( 221) = ( 0.3478261 -0.0000000 0.5495985), wk = 0.0043860 k( 222) = ( 0.3695652 -0.0000000 0.5495985), wk = 0.0043860 k( 223) = ( 0.3913044 -0.0000000 0.5495985), wk = 0.0043860 k( 224) = ( 0.4130435 -0.0000000 0.5495985), wk = 0.0043860 k( 225) = ( 0.4347826 -0.0000000 0.5495985), wk = 0.0043860 k( 226) = ( 0.4565217 -0.0000000 0.5495985), wk = 0.0043860 k( 227) = ( 0.4782609 -0.0000000 0.5495985), wk = 0.0043860 k( 228) = ( 0.5000000 -0.0000000 0.5495985), wk = 0.0043860 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0043860 k( 2) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0043860 k( 3) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0043860 k( 4) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0043860 k( 5) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0043860 k( 6) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0043860 k( 7) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0043860 k( 8) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0043860 k( 9) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0043860 k( 10) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0043860 k( 11) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0043860 k( 12) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0043860 k( 13) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0043860 k( 14) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0043860 k( 15) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0043860 k( 16) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0043860 k( 17) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0043860 k( 18) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0043860 k( 19) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0043860 k( 20) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0043860 k( 21) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0043860 k( 22) = ( 0.0000000 0.0000000 0.4038461), wk = 0.0043860 k( 23) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0043860 k( 24) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0043860 k( 25) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0043860 k( 26) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0043860 k( 27) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043860 k( 28) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043860 k( 29) = ( 0.0000000 0.0196586 0.5088180), wk = 0.0043860 k( 30) = ( 0.0000000 0.0393173 0.5176359), wk = 0.0043860 k( 31) = ( 0.0000000 0.0589759 0.5264539), wk = 0.0043860 k( 32) = ( 0.0000000 0.0786345 0.5352719), wk = 0.0043860 k( 33) = ( 0.0000000 0.0982932 0.5440898), wk = 0.0043860 k( 34) = ( 0.0000000 0.1179518 0.5529078), wk = 0.0043860 k( 35) = ( 0.0000000 0.1376105 0.5617258), wk = 0.0043860 k( 36) = ( 0.0000000 0.1572691 0.5705438), wk = 0.0043860 k( 37) = ( 0.0000000 0.1769277 0.5793617), wk = 0.0043860 k( 38) = ( 0.0000000 0.1965864 0.5881797), wk = 0.0043860 k( 39) = ( 0.0000000 0.2162450 0.5969977), wk = 0.0043860 k( 40) = ( 0.0000000 0.2359037 0.6058157), wk = 0.0043860 k( 41) = ( 0.0000000 0.2555623 0.6146336), wk = 0.0043860 k( 42) = ( 0.0000000 0.2752209 0.6234516), wk = 0.0043860 k( 43) = ( 0.0000000 0.2948796 0.6322696), wk = 0.0043860 k( 44) = ( 0.0000000 0.3145382 0.6410875), wk = 0.0043860 k( 45) = ( 0.0000000 0.3341968 0.6499055), wk = 0.0043860 k( 46) = ( 0.0000000 0.3538555 0.6587235), wk = 0.0043860 k( 47) = ( 0.0000000 0.3735141 0.6675414), wk = 0.0043860 k( 48) = ( 0.0000000 0.3735141 0.6675414), wk = 0.0043860 k( 49) = ( 0.0000000 0.3832438 0.6546536), wk = 0.0043860 k( 50) = ( 0.0000000 0.3929735 0.6417658), wk = 0.0043860 k( 51) = ( 0.0000000 0.4027032 0.6288780), wk = 0.0043860 k( 52) = ( 0.0000000 0.4124329 0.6159902), wk = 0.0043860 k( 53) = ( 0.0000000 0.4221625 0.6031024), wk = 0.0043860 k( 54) = ( 0.0000000 0.4318922 0.5902146), wk = 0.0043860 k( 55) = ( 0.0000000 0.4416219 0.5773268), wk = 0.0043860 k( 56) = ( 0.0000000 0.4513516 0.5644390), wk = 0.0043860 k( 57) = ( 0.0000000 0.4610813 0.5515512), wk = 0.0043860 k( 58) = ( 0.0000000 0.4708109 0.5386634), wk = 0.0043860 k( 59) = ( 0.0000000 0.4805406 0.5257756), wk = 0.0043860 k( 60) = ( 0.0000000 0.4902703 0.5128878), wk = 0.0043860 k( 61) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0043860 k( 62) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0043860 k( 63) = ( 0.0217391 0.5000000 0.5000000), wk = 0.0043860 k( 64) = ( 0.0434783 0.5000000 0.5000000), wk = 0.0043860 k( 65) = ( 0.0652174 0.5000000 0.5000000), wk = 0.0043860 k( 66) = ( 0.0869565 0.5000000 0.5000000), wk = 0.0043860 k( 67) = ( 0.1086957 0.5000000 0.5000000), wk = 0.0043860 k( 68) = ( 0.1304348 0.5000000 0.5000000), wk = 0.0043860 k( 69) = ( 0.1521739 0.5000000 0.5000000), wk = 0.0043860 k( 70) = ( 0.1739130 0.5000000 0.5000000), wk = 0.0043860 k( 71) = ( 0.1956522 0.5000000 0.5000000), wk = 0.0043860 k( 72) = ( 0.2173913 0.5000000 0.5000000), wk = 0.0043860 k( 73) = ( 0.2391304 0.5000000 0.5000000), wk = 0.0043860 k( 74) = ( 0.2608696 0.5000000 0.5000000), wk = 0.0043860 k( 75) = ( 0.2826087 0.5000000 0.5000000), wk = 0.0043860 k( 76) = ( 0.3043478 0.5000000 0.5000000), wk = 0.0043860 k( 77) = ( 0.3260870 0.5000000 0.5000000), wk = 0.0043860 k( 78) = ( 0.3478261 0.5000000 0.5000000), wk = 0.0043860 k( 79) = ( 0.3695652 0.5000000 0.5000000), wk = 0.0043860 k( 80) = ( 0.3913044 0.5000000 0.5000000), wk = 0.0043860 k( 81) = ( 0.4130435 0.5000000 0.5000000), wk = 0.0043860 k( 82) = ( 0.4347826 0.5000000 0.5000000), wk = 0.0043860 k( 83) = ( 0.4565217 0.5000000 0.5000000), wk = 0.0043860 k( 84) = ( 0.4782609 0.5000000 0.5000000), wk = 0.0043860 k( 85) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 86) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0043860 k( 87) = ( 0.5000000 0.5097297 0.4871122), wk = 0.0043860 k( 88) = ( 0.5000000 0.5194594 0.4742244), wk = 0.0043860 k( 89) = ( 0.5000000 0.5291891 0.4613366), wk = 0.0043860 k( 90) = ( 0.5000000 0.5389187 0.4484488), wk = 0.0043860 k( 91) = ( 0.5000000 0.5486484 0.4355610), wk = 0.0043860 k( 92) = ( 0.5000000 0.5583781 0.4226732), wk = 0.0043860 k( 93) = ( 0.5000000 0.5681078 0.4097854), wk = 0.0043860 k( 94) = ( 0.5000000 0.5778375 0.3968976), wk = 0.0043860 k( 95) = ( 0.5000000 0.5875671 0.3840098), wk = 0.0043860 k( 96) = ( 0.5000000 0.5972968 0.3711220), wk = 0.0043860 k( 97) = ( 0.5000000 0.6070265 0.3582342), wk = 0.0043860 k( 98) = ( 0.5000000 0.6167562 0.3453464), wk = 0.0043860 k( 99) = ( 0.5000000 0.6264859 0.3324586), wk = 0.0043860 k( 100) = ( 0.5000000 0.6264859 0.3324586), wk = 0.0043860 k( 101) = ( 0.5000000 0.6185805 0.3116799), wk = 0.0043860 k( 102) = ( 0.5000000 0.6106751 0.2909012), wk = 0.0043860 k( 103) = ( 0.5000000 0.6027698 0.2701226), wk = 0.0043860 k( 104) = ( 0.5000000 0.5948644 0.2493439), wk = 0.0043860 k( 105) = ( 0.5000000 0.5869590 0.2285653), wk = 0.0043860 k( 106) = ( 0.5000000 0.5790537 0.2077866), wk = 0.0043860 k( 107) = ( 0.5000000 0.5711483 0.1870079), wk = 0.0043860 k( 108) = ( 0.5000000 0.5632429 0.1662293), wk = 0.0043860 k( 109) = ( 0.5000000 0.5553376 0.1454506), wk = 0.0043860 k( 110) = ( 0.5000000 0.5474322 0.1246720), wk = 0.0043860 k( 111) = ( 0.5000000 0.5395268 0.1038933), wk = 0.0043860 k( 112) = ( 0.5000000 0.5316215 0.0831146), wk = 0.0043860 k( 113) = ( 0.5000000 0.5237161 0.0623360), wk = 0.0043860 k( 114) = ( 0.5000000 0.5158107 0.0415573), wk = 0.0043860 k( 115) = ( 0.5000000 0.5079054 0.0207787), wk = 0.0043860 k( 116) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043860 k( 117) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0043860 k( 118) = ( 0.4782609 0.5000000 0.0000000), wk = 0.0043860 k( 119) = ( 0.4565217 0.5000000 0.0000000), wk = 0.0043860 k( 120) = ( 0.4347826 0.5000000 0.0000000), wk = 0.0043860 k( 121) = ( 0.4130435 0.5000000 -0.0000000), wk = 0.0043860 k( 122) = ( 0.3913044 0.5000000 -0.0000000), wk = 0.0043860 k( 123) = ( 0.3695652 0.5000000 -0.0000000), wk = 0.0043860 k( 124) = ( 0.3478261 0.5000000 -0.0000000), wk = 0.0043860 k( 125) = ( 0.3260870 0.5000000 -0.0000000), wk = 0.0043860 k( 126) = ( 0.3043478 0.5000000 -0.0000000), wk = 0.0043860 k( 127) = ( 0.2826087 0.5000000 -0.0000000), wk = 0.0043860 k( 128) = ( 0.2608696 0.5000000 -0.0000000), wk = 0.0043860 k( 129) = ( 0.2391304 0.5000000 -0.0000000), wk = 0.0043860 k( 130) = ( 0.2173913 0.5000000 -0.0000000), wk = 0.0043860 k( 131) = ( 0.1956522 0.5000000 0.0000000), wk = 0.0043860 k( 132) = ( 0.1739130 0.5000000 0.0000000), wk = 0.0043860 k( 133) = ( 0.1521739 0.5000000 0.0000000), wk = 0.0043860 k( 134) = ( 0.1304348 0.5000000 -0.0000000), wk = 0.0043860 k( 135) = ( 0.1086957 0.5000000 -0.0000000), wk = 0.0043860 k( 136) = ( 0.0869565 0.5000000 -0.0000000), wk = 0.0043860 k( 137) = ( 0.0652174 0.5000000 -0.0000000), wk = 0.0043860 k( 138) = ( 0.0434783 0.5000000 -0.0000000), wk = 0.0043860 k( 139) = ( 0.0217391 0.5000000 -0.0000000), wk = 0.0043860 k( 140) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043860 k( 141) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0043860 k( 142) = ( 0.0000000 0.5079054 0.0207787), wk = 0.0043860 k( 143) = ( 0.0000000 0.5158107 0.0415573), wk = 0.0043860 k( 144) = ( 0.0000000 0.5237161 0.0623360), wk = 0.0043860 k( 145) = ( 0.0000000 0.5316215 0.0831146), wk = 0.0043860 k( 146) = ( 0.0000000 0.5395268 0.1038933), wk = 0.0043860 k( 147) = ( 0.0000000 0.5474322 0.1246720), wk = 0.0043860 k( 148) = ( 0.0000000 0.5553376 0.1454506), wk = 0.0043860 k( 149) = ( 0.0000000 0.5632429 0.1662293), wk = 0.0043860 k( 150) = ( 0.0000000 0.5711483 0.1870079), wk = 0.0043860 k( 151) = ( 0.0000000 0.5790537 0.2077866), wk = 0.0043860 k( 152) = ( 0.0000000 0.5869590 0.2285653), wk = 0.0043860 k( 153) = ( 0.0000000 0.5948644 0.2493439), wk = 0.0043860 k( 154) = ( 0.0000000 0.6027698 0.2701226), wk = 0.0043860 k( 155) = ( 0.0000000 0.6106751 0.2909012), wk = 0.0043860 k( 156) = ( 0.0000000 0.6185805 0.3116799), wk = 0.0043860 k( 157) = ( 0.0000000 0.6264859 0.3324586), wk = 0.0043860 k( 158) = ( 0.5000000 0.3735141 0.6675414), wk = 0.0043860 k( 159) = ( 0.5000000 0.3538555 0.6587235), wk = 0.0043860 k( 160) = ( 0.5000000 0.3341968 0.6499055), wk = 0.0043860 k( 161) = ( 0.5000000 0.3145382 0.6410875), wk = 0.0043860 k( 162) = ( 0.5000000 0.2948796 0.6322696), wk = 0.0043860 k( 163) = ( 0.5000000 0.2752209 0.6234516), wk = 0.0043860 k( 164) = ( 0.5000000 0.2555623 0.6146336), wk = 0.0043860 k( 165) = ( 0.5000000 0.2359037 0.6058156), wk = 0.0043860 k( 166) = ( 0.5000000 0.2162450 0.5969977), wk = 0.0043860 k( 167) = ( 0.5000000 0.1965864 0.5881797), wk = 0.0043860 k( 168) = ( 0.5000000 0.1769277 0.5793617), wk = 0.0043860 k( 169) = ( 0.5000000 0.1572691 0.5705438), wk = 0.0043860 k( 170) = ( 0.5000000 0.1376105 0.5617258), wk = 0.0043860 k( 171) = ( 0.5000000 0.1179518 0.5529078), wk = 0.0043860 k( 172) = ( 0.5000000 0.0982932 0.5440898), wk = 0.0043860 k( 173) = ( 0.5000000 0.0786345 0.5352719), wk = 0.0043860 k( 174) = ( 0.5000000 0.0589759 0.5264539), wk = 0.0043860 k( 175) = ( 0.5000000 0.0393173 0.5176359), wk = 0.0043860 k( 176) = ( 0.5000000 0.0196586 0.5088180), wk = 0.0043860 k( 177) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0043860 k( 178) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0043860 k( 179) = ( 0.5000000 0.0000000 0.4807692), wk = 0.0043860 k( 180) = ( 0.5000000 0.0000000 0.4615385), wk = 0.0043860 k( 181) = ( 0.5000000 0.0000000 0.4423077), wk = 0.0043860 k( 182) = ( 0.5000000 0.0000000 0.4230769), wk = 0.0043860 k( 183) = ( 0.5000000 0.0000000 0.4038461), wk = 0.0043860 k( 184) = ( 0.5000000 0.0000000 0.3846154), wk = 0.0043860 k( 185) = ( 0.5000000 0.0000000 0.3653846), wk = 0.0043860 k( 186) = ( 0.5000000 0.0000000 0.3461538), wk = 0.0043860 k( 187) = ( 0.5000000 0.0000000 0.3269231), wk = 0.0043860 k( 188) = ( 0.5000000 0.0000000 0.3076923), wk = 0.0043860 k( 189) = ( 0.5000000 0.0000000 0.2884615), wk = 0.0043860 k( 190) = ( 0.5000000 0.0000000 0.2692308), wk = 0.0043860 k( 191) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0043860 k( 192) = ( 0.5000000 0.0000000 0.2307692), wk = 0.0043860 k( 193) = ( 0.5000000 0.0000000 0.2115385), wk = 0.0043860 k( 194) = ( 0.5000000 0.0000000 0.1923077), wk = 0.0043860 k( 195) = ( 0.5000000 0.0000000 0.1730769), wk = 0.0043860 k( 196) = ( 0.5000000 0.0000000 0.1538461), wk = 0.0043860 k( 197) = ( 0.5000000 0.0000000 0.1346154), wk = 0.0043860 k( 198) = ( 0.5000000 0.0000000 0.1153846), wk = 0.0043860 k( 199) = ( 0.5000000 0.0000000 0.0961538), wk = 0.0043860 k( 200) = ( 0.5000000 0.0000000 0.0769231), wk = 0.0043860 k( 201) = ( 0.5000000 0.0000000 0.0576923), wk = 0.0043860 k( 202) = ( 0.5000000 0.0000000 0.0384615), wk = 0.0043860 k( 203) = ( 0.5000000 0.0000000 0.0192308), wk = 0.0043860 k( 204) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0043860 k( 205) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0043860 k( 206) = ( 0.0217391 -0.0000000 0.5000000), wk = 0.0043860 k( 207) = ( 0.0434783 -0.0000000 0.5000000), wk = 0.0043860 k( 208) = ( 0.0652174 -0.0000000 0.5000000), wk = 0.0043860 k( 209) = ( 0.0869565 -0.0000000 0.5000000), wk = 0.0043860 k( 210) = ( 0.1086957 -0.0000000 0.5000000), wk = 0.0043860 k( 211) = ( 0.1304348 -0.0000000 0.5000000), wk = 0.0043860 k( 212) = ( 0.1521739 -0.0000000 0.5000000), wk = 0.0043860 k( 213) = ( 0.1739130 -0.0000000 0.5000000), wk = 0.0043860 k( 214) = ( 0.1956522 -0.0000000 0.5000000), wk = 0.0043860 k( 215) = ( 0.2173913 -0.0000000 0.5000000), wk = 0.0043860 k( 216) = ( 0.2391304 -0.0000000 0.5000000), wk = 0.0043860 k( 217) = ( 0.2608696 0.0000000 0.5000000), wk = 0.0043860 k( 218) = ( 0.2826087 -0.0000000 0.5000000), wk = 0.0043860 k( 219) = ( 0.3043478 0.0000000 0.5000000), wk = 0.0043860 k( 220) = ( 0.3260870 -0.0000000 0.5000000), wk = 0.0043860 k( 221) = ( 0.3478261 -0.0000000 0.5000000), wk = 0.0043860 k( 222) = ( 0.3695652 -0.0000000 0.5000000), wk = 0.0043860 k( 223) = ( 0.3913044 -0.0000000 0.5000000), wk = 0.0043860 k( 224) = ( 0.4130435 -0.0000000 0.5000000), wk = 0.0043860 k( 225) = ( 0.4347826 -0.0000000 0.5000000), wk = 0.0043860 k( 226) = ( 0.4565217 -0.0000000 0.5000000), wk = 0.0043860 k( 227) = ( 0.4782609 0.0000000 0.5000000), wk = 0.0043860 k( 228) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0043860 Dense grid: 261777 G-vectors FFT dimensions: ( 90, 80, 90) Smooth grid: 69599 G-vectors FFT dimensions: ( 60, 50, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.32 Mb ( 244, 86) NL pseudopotentials 0.38 Mb ( 122, 204) Each V/rho on FFT grid 0.22 Mb ( 14400) Each G-vector array 0.03 Mb ( 3637) G-vector shells 0.03 Mb ( 3566) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.28 Mb ( 244, 344) Each subspace H/S matrix 0.05 Mb ( 57, 57) Each matrix 0.54 Mb ( 204, 2, 86) The potential is recalculated from file : ./Hg.save/charge-density.dat Starting wfc are 108 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.4 secs Computing kpt #: 2 total cpu time spent up to now is 10.6 secs Computing kpt #: 3 total cpu time spent up to now is 13.9 secs Computing kpt #: 4 total cpu time spent up to now is 16.6 secs Computing kpt #: 5 total cpu time spent up to now is 19.2 secs Computing kpt #: 6 total cpu time spent up to now is 21.6 secs Computing kpt #: 7 total cpu time spent up to now is 24.0 secs Computing kpt #: 8 total cpu time spent up to now is 26.4 secs Computing kpt #: 9 total cpu time spent up to now is 28.8 secs Computing kpt #: 10 total cpu time spent up to now is 31.1 secs Computing kpt #: 11 total cpu time spent up to now is 33.5 secs Computing kpt #: 12 total cpu time spent up to now is 36.4 secs Computing kpt #: 13 total cpu time spent up to now is 38.8 secs Computing kpt #: 14 total cpu time spent up to now is 41.3 secs Computing kpt #: 15 total cpu time spent up to now is 43.7 secs Computing kpt #: 16 total cpu time spent up to now is 46.0 secs Computing kpt #: 17 total cpu time spent up to now is 48.3 secs Computing kpt #: 18 total cpu time spent up to now is 50.6 secs Computing kpt #: 19 total cpu time spent up to now is 52.8 secs Computing kpt #: 20 total cpu time spent up to now is 55.2 secs Computing kpt #: 21 total cpu time spent up to now is 57.7 secs Computing kpt #: 22 total cpu time spent up to now is 60.0 secs Computing kpt #: 23 total cpu time spent up to now is 62.5 secs Computing kpt #: 24 total cpu time spent up to now is 65.0 secs Computing kpt #: 25 total cpu time spent up to now is 67.7 secs Computing kpt #: 26 total cpu time spent up to now is 70.7 secs Computing kpt #: 27 total cpu time spent up to now is 73.1 secs Computing kpt #: 28 total cpu time spent up to now is 75.5 secs Computing kpt #: 29 total cpu time spent up to now is 78.3 secs Computing kpt #: 30 total cpu time spent up to now is 80.7 secs Computing kpt #: 31 total cpu time spent up to now is 83.2 secs Computing kpt #: 32 total cpu time spent up to now is 85.6 secs Computing kpt #: 33 total cpu time spent up to now is 87.9 secs Computing kpt #: 34 total cpu time spent up to now is 90.1 secs Computing kpt #: 35 total cpu time spent up to now is 92.3 secs Computing kpt #: 36 total cpu time spent up to now is 94.5 secs Computing kpt #: 37 total cpu time spent up to now is 96.6 secs Computing kpt #: 38 total cpu time spent up to now is 98.5 secs Computing kpt #: 39 total cpu time spent up to now is 100.5 secs Computing kpt #: 40 total cpu time spent up to now is 102.6 secs Computing kpt #: 41 total cpu time spent up to now is 104.8 secs Computing kpt #: 42 total cpu time spent up to now is 107.0 secs Computing kpt #: 43 total cpu time spent up to now is 109.2 secs Computing kpt #: 44 total cpu time spent up to now is 111.4 secs Computing kpt #: 45 total cpu time spent up to now is 113.7 secs Computing kpt #: 46 total cpu time spent up to now is 116.0 secs Computing kpt #: 47 total cpu time spent up to now is 118.3 secs Computing kpt #: 48 total cpu time spent up to now is 120.6 secs Computing kpt #: 49 total cpu time spent up to now is 123.0 secs Computing kpt #: 50 total cpu time spent up to now is 125.3 secs Computing kpt #: 51 total cpu time spent up to now is 127.7 secs Computing kpt #: 52 total cpu time spent up to now is 130.1 secs Computing kpt #: 53 total cpu time spent up to now is 132.4 secs Computing kpt #: 54 total cpu time spent up to now is 134.8 secs Computing kpt #: 55 total cpu time spent up to now is 137.1 secs Computing kpt #: 56 total cpu time spent up to now is 139.3 secs Computing kpt #: 57 total cpu time spent up to now is 141.4 secs Computing kpt #: 58 total cpu time spent up to now is 143.5 secs Computing kpt #: 59 total cpu time spent up to now is 145.6 secs Computing kpt #: 60 total cpu time spent up to now is 148.0 secs Computing kpt #: 61 total cpu time spent up to now is 150.3 secs Computing kpt #: 62 total cpu time spent up to now is 152.7 secs Computing kpt #: 63 total cpu time spent up to now is 154.6 secs Computing kpt #: 64 total cpu time spent up to now is 157.6 secs Computing kpt #: 65 total cpu time spent up to now is 160.6 secs Computing kpt #: 66 total cpu time spent up to now is 164.1 secs Computing kpt #: 67 total cpu time spent up to now is 167.2 secs Computing kpt #: 68 total cpu time spent up to now is 170.2 secs Computing kpt #: 69 total cpu time spent up to now is 173.2 secs Computing kpt #: 70 total cpu time spent up to now is 176.1 secs Computing kpt #: 71 total cpu time spent up to now is 178.7 secs Computing kpt #: 72 total cpu time spent up to now is 181.3 secs Computing kpt #: 73 total cpu time spent up to now is 183.9 secs Computing kpt #: 74 total cpu time spent up to now is 186.3 secs Computing kpt #: 75 total cpu time spent up to now is 188.9 secs Computing kpt #: 76 total cpu time spent up to now is 191.5 secs Computing kpt #: 77 total cpu time spent up to now is 194.1 secs Computing kpt #: 78 total cpu time spent up to now is 196.6 secs Computing kpt #: 79 total cpu time spent up to now is 199.1 secs Computing kpt #: 80 total cpu time spent up to now is 201.9 secs Computing kpt #: 81 total cpu time spent up to now is 205.0 secs Computing kpt #: 82 total cpu time spent up to now is 207.8 secs Computing kpt #: 83 total cpu time spent up to now is 210.6 secs Computing kpt #: 84 total cpu time spent up to now is 213.2 secs Computing kpt #: 85 total cpu time spent up to now is 215.8 secs Computing kpt #: 86 total cpu time spent up to now is 218.2 secs Computing kpt #: 87 total cpu time spent up to now is 220.7 secs Computing kpt #: 88 total cpu time spent up to now is 223.2 secs Computing kpt #: 89 total cpu time spent up to now is 225.8 secs Computing kpt #: 90 total cpu time spent up to now is 228.5 secs Computing kpt #: 91 total cpu time spent up to now is 231.3 secs Computing kpt #: 92 total cpu time spent up to now is 234.5 secs Computing kpt #: 93 total cpu time spent up to now is 237.4 secs Computing kpt #: 94 total cpu time spent up to now is 240.4 secs Computing kpt #: 95 total cpu time spent up to now is 243.4 secs Computing kpt #: 96 total cpu time spent up to now is 246.4 secs Computing kpt #: 97 total cpu time spent up to now is 249.7 secs Computing kpt #: 98 total cpu time spent up to now is 253.0 secs Computing kpt #: 99 total cpu time spent up to now is 256.2 secs Computing kpt #: 100 total cpu time spent up to now is 259.6 secs Computing kpt #: 101 total cpu time spent up to now is 263.2 secs Computing kpt #: 102 total cpu time spent up to now is 267.4 secs Computing kpt #: 103 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 272.5 secs Computing kpt #: 104 total cpu time spent up to now is 274.8 secs Computing kpt #: 105 total cpu time spent up to now is 277.9 secs Computing kpt #: 106 total cpu time spent up to now is 280.7 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.8 secs Computing kpt #: 108 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 290.9 secs Computing kpt #: 109 total cpu time spent up to now is 293.5 secs Computing kpt #: 110 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 298.8 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.9 secs Computing kpt #: 112 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 309.1 secs Computing kpt #: 113 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 314.4 secs Computing kpt #: 114 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 319.7 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 325.0 secs Computing kpt #: 116 total cpu time spent up to now is 327.3 secs Computing kpt #: 117 total cpu time spent up to now is 329.6 secs Computing kpt #: 118 total cpu time spent up to now is 332.1 secs Computing kpt #: 119 total cpu time spent up to now is 334.4 secs Computing kpt #: 120 total cpu time spent up to now is 336.8 secs Computing kpt #: 121 total cpu time spent up to now is 339.1 secs Computing kpt #: 122 total cpu time spent up to now is 341.3 secs Computing kpt #: 123 total cpu time spent up to now is 343.6 secs Computing kpt #: 124 total cpu time spent up to now is 346.0 secs Computing kpt #: 125 total cpu time spent up to now is 348.2 secs Computing kpt #: 126 total cpu time spent up to now is 350.3 secs Computing kpt #: 127 total cpu time spent up to now is 352.2 secs Computing kpt #: 128 total cpu time spent up to now is 354.1 secs Computing kpt #: 129 total cpu time spent up to now is 356.3 secs Computing kpt #: 130 total cpu time spent up to now is 358.3 secs Computing kpt #: 131 total cpu time spent up to now is 360.4 secs Computing kpt #: 132 total cpu time spent up to now is 362.6 secs Computing kpt #: 133 total cpu time spent up to now is 364.9 secs Computing kpt #: 134 total cpu time spent up to now is 367.2 secs Computing kpt #: 135 total cpu time spent up to now is 369.4 secs Computing kpt #: 136 total cpu time spent up to now is 371.5 secs Computing kpt #: 137 total cpu time spent up to now is 373.6 secs Computing kpt #: 138 total cpu time spent up to now is 375.7 secs Computing kpt #: 139 total cpu time spent up to now is 377.7 secs Computing kpt #: 140 total cpu time spent up to now is 379.7 secs Computing kpt #: 141 total cpu time spent up to now is 381.7 secs Computing kpt #: 142 total cpu time spent up to now is 383.7 secs Computing kpt #: 143 total cpu time spent up to now is 385.7 secs Computing kpt #: 144 total cpu time spent up to now is 387.6 secs Computing kpt #: 145 total cpu time spent up to now is 389.6 secs Computing kpt #: 146 total cpu time spent up to now is 391.6 secs Computing kpt #: 147 total cpu time spent up to now is 393.8 secs Computing kpt #: 148 total cpu time spent up to now is 396.0 secs Computing kpt #: 149 total cpu time spent up to now is 398.2 secs Computing kpt #: 150 total cpu time spent up to now is 400.5 secs Computing kpt #: 151 total cpu time spent up to now is 402.8 secs Computing kpt #: 152 total cpu time spent up to now is 405.2 secs Computing kpt #: 153 total cpu time spent up to now is 407.6 secs Computing kpt #: 154 total cpu time spent up to now is 410.1 secs Computing kpt #: 155 total cpu time spent up to now is 412.4 secs Computing kpt #: 156 total cpu time spent up to now is 414.8 secs Computing kpt #: 157 total cpu time spent up to now is 417.2 secs Computing kpt #: 158 total cpu time spent up to now is 420.7 secs Computing kpt #: 159 total cpu time spent up to now is 424.2 secs Computing kpt #: 160 total cpu time spent up to now is 427.6 secs Computing kpt #: 161 total cpu time spent up to now is 430.9 secs Computing kpt #: 162 total cpu time spent up to now is 434.1 secs Computing kpt #: 163 total cpu time spent up to now is 437.3 secs Computing kpt #: 164 total cpu time spent up to now is 440.5 secs Computing kpt #: 165 total cpu time spent up to now is 443.6 secs Computing kpt #: 166 total cpu time spent up to now is 446.7 secs Computing kpt #: 167 total cpu time spent up to now is 450.0 secs Computing kpt #: 168 total cpu time spent up to now is 454.5 secs Computing kpt #: 169 total cpu time spent up to now is 457.8 secs Computing kpt #: 170 total cpu time spent up to now is 462.0 secs Computing kpt #: 171 total cpu time spent up to now is 465.2 secs Computing kpt #: 172 total cpu time spent up to now is 468.6 secs Computing kpt #: 173 total cpu time spent up to now is 473.0 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 478.0 secs Computing kpt #: 175 total cpu time spent up to now is 481.4 secs Computing kpt #: 176 total cpu time spent up to now is 484.3 secs Computing kpt #: 177 total cpu time spent up to now is 486.8 secs Computing kpt #: 178 total cpu time spent up to now is 489.3 secs Computing kpt #: 179 total cpu time spent up to now is 492.1 secs Computing kpt #: 180 total cpu time spent up to now is 495.2 secs Computing kpt #: 181 total cpu time spent up to now is 498.3 secs Computing kpt #: 182 total cpu time spent up to now is 501.4 secs Computing kpt #: 183 total cpu time spent up to now is 504.5 secs Computing kpt #: 184 total cpu time spent up to now is 507.3 secs Computing kpt #: 185 total cpu time spent up to now is 510.3 secs Computing kpt #: 186 total cpu time spent up to now is 513.3 secs Computing kpt #: 187 total cpu time spent up to now is 516.5 secs Computing kpt #: 188 total cpu time spent up to now is 520.0 secs Computing kpt #: 189 total cpu time spent up to now is 524.2 secs Computing kpt #: 190 total cpu time spent up to now is 528.6 secs Computing kpt #: 191 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 533.9 secs Computing kpt #: 192 total cpu time spent up to now is 538.2 secs Computing kpt #: 193 total cpu time spent up to now is 543.2 secs Computing kpt #: 194 total cpu time spent up to now is 546.1 secs Computing kpt #: 195 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 551.4 secs Computing kpt #: 196 total cpu time spent up to now is 555.6 secs Computing kpt #: 197 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 560.9 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 566.1 secs Computing kpt #: 199 total cpu time spent up to now is 570.5 secs Computing kpt #: 200 total cpu time spent up to now is 575.4 secs Computing kpt #: 201 total cpu time spent up to now is 579.7 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 584.9 secs Computing kpt #: 203 total cpu time spent up to now is 588.3 secs Computing kpt #: 204 total cpu time spent up to now is 590.3 secs Computing kpt #: 205 total cpu time spent up to now is 592.6 secs Computing kpt #: 206 total cpu time spent up to now is 595.8 secs Computing kpt #: 207 total cpu time spent up to now is 598.8 secs Computing kpt #: 208 total cpu time spent up to now is 601.6 secs Computing kpt #: 209 total cpu time spent up to now is 604.2 secs Computing kpt #: 210 total cpu time spent up to now is 606.7 secs Computing kpt #: 211 total cpu time spent up to now is 609.0 secs Computing kpt #: 212 total cpu time spent up to now is 611.2 secs Computing kpt #: 213 total cpu time spent up to now is 613.4 secs Computing kpt #: 214 total cpu time spent up to now is 615.9 secs Computing kpt #: 215 total cpu time spent up to now is 618.2 secs Computing kpt #: 216 total cpu time spent up to now is 620.7 secs Computing kpt #: 217 total cpu time spent up to now is 623.1 secs Computing kpt #: 218 total cpu time spent up to now is 625.5 secs Computing kpt #: 219 total cpu time spent up to now is 628.0 secs Computing kpt #: 220 total cpu time spent up to now is 630.4 secs Computing kpt #: 221 total cpu time spent up to now is 632.9 secs Computing kpt #: 222 total cpu time spent up to now is 635.4 secs Computing kpt #: 223 total cpu time spent up to now is 637.9 secs Computing kpt #: 224 total cpu time spent up to now is 640.5 secs Computing kpt #: 225 total cpu time spent up to now is 643.0 secs Computing kpt #: 226 total cpu time spent up to now is 645.9 secs Computing kpt #: 227 total cpu time spent up to now is 648.8 secs Computing kpt #: 228 total cpu time spent up to now is 651.3 secs ethr = 1.39E-08, avg # of iterations = 44.7 total cpu time spent up to now is 651.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8737 PWs) bands (ev): -3.1625 -3.1625 -3.1451 -3.1451 -3.1330 -3.1330 -3.1217 -3.1217 -3.1095 -3.1095 -3.0930 -3.0930 -3.0695 -3.0695 -3.0547 -3.0547 -3.0539 -3.0539 -3.0384 -3.0384 -3.0223 -3.0223 -3.0041 -3.0041 -1.7974 -1.7974 -1.4439 -1.4439 -1.4382 -1.4382 -1.3807 -1.3807 -1.3663 -1.3663 -1.3221 -1.3221 -1.3142 -1.3142 -1.2941 -1.2941 -1.2599 -1.2599 -1.2228 -1.2228 -1.2136 -1.2136 -1.1909 -1.1909 -1.1844 -1.1844 -1.1512 -1.1512 -1.1418 -1.1418 -1.0930 -1.0930 -1.0925 -1.0925 -1.0097 -1.0097 -0.9447 -0.9447 0.9320 0.9320 1.5893 1.5893 1.6914 1.6914 2.6632 2.6632 2.7469 2.7469 5.0443 5.0443 5.0890 5.0890 5.7753 5.7753 6.0046 6.0046 6.4661 6.4661 7.3135 7.3135 7.9660 7.9661 k = 0.0000 0.0000 0.0211 ( 8733 PWs) bands (ev): -3.1625 -3.1625 -3.1450 -3.1450 -3.1330 -3.1330 -3.1217 -3.1217 -3.1095 -3.1095 -3.0929 -3.0929 -3.0697 -3.0697 -3.0549 -3.0549 -3.0538 -3.0538 -3.0383 -3.0383 -3.0222 -3.0222 -3.0041 -3.0041 -1.7965 -1.7965 -1.4440 -1.4440 -1.4380 -1.4380 -1.3807 -1.3807 -1.3662 -1.3662 -1.3222 -1.3222 -1.3143 -1.3143 -1.2942 -1.2942 -1.2600 -1.2600 -1.2227 -1.2227 -1.2138 -1.2138 -1.1918 -1.1918 -1.1830 -1.1830 -1.1511 -1.1511 -1.1420 -1.1420 -1.0936 -1.0936 -1.0915 -1.0915 -1.0096 -1.0096 -0.9448 -0.9448 0.9267 0.9267 1.5913 1.5913 1.6924 1.6924 2.6621 2.6621 2.7458 2.7458 5.0468 5.0468 5.0951 5.0951 5.7735 5.7735 6.0027 6.0027 6.4549 6.4549 7.3201 7.3201 7.9568 7.9568 k = 0.0000 0.0000 0.0423 ( 8736 PWs) bands (ev): -3.1624 -3.1624 -3.1449 -3.1449 -3.1331 -3.1331 -3.1217 -3.1217 -3.1096 -3.1096 -3.0928 -3.0928 -3.0700 -3.0700 -3.0554 -3.0554 -3.0535 -3.0535 -3.0382 -3.0382 -3.0221 -3.0221 -3.0041 -3.0041 -1.7939 -1.7939 -1.4442 -1.4442 -1.4377 -1.4377 -1.3805 -1.3805 -1.3661 -1.3661 -1.3225 -1.3225 -1.3144 -1.3144 -1.2943 -1.2943 -1.2601 -1.2601 -1.2225 -1.2225 -1.2143 -1.2143 -1.1933 -1.1933 -1.1800 -1.1800 -1.1509 -1.1509 -1.1426 -1.1426 -1.0939 -1.0939 -1.0899 -1.0899 -1.0094 -1.0094 -0.9451 -0.9451 0.9112 0.9112 1.5969 1.5969 1.6954 1.6954 2.6588 2.6588 2.7425 2.7425 5.0541 5.0541 5.1132 5.1132 5.7675 5.7675 5.9976 5.9976 6.4228 6.4228 7.3385 7.3385 7.9406 7.9406 k = 0.0000 0.0000 0.0634 ( 8735 PWs) bands (ev): -3.1622 -3.1622 -3.1447 -3.1447 -3.1331 -3.1331 -3.1216 -3.1216 -3.1096 -3.1096 -3.0926 -3.0926 -3.0707 -3.0707 -3.0560 -3.0560 -3.0533 -3.0533 -3.0381 -3.0381 -3.0219 -3.0219 -3.0042 -3.0042 -1.7895 -1.7895 -1.4444 -1.4444 -1.4372 -1.4372 -1.3803 -1.3803 -1.3660 -1.3660 -1.3230 -1.3230 -1.3146 -1.3146 -1.2946 -1.2946 -1.2604 -1.2604 -1.2223 -1.2223 -1.2151 -1.2151 -1.1943 -1.1943 -1.1765 -1.1765 -1.1506 -1.1506 -1.1433 -1.1433 -1.0939 -1.0939 -1.0880 -1.0880 -1.0092 -1.0092 -0.9455 -0.9455 0.8860 0.8860 1.6059 1.6059 1.7003 1.7003 2.6535 2.6535 2.7371 2.7371 5.0662 5.0662 5.1429 5.1429 5.7561 5.7561 5.9910 5.9910 6.3738 6.3738 7.3649 7.3649 7.9236 7.9236 k = 0.0000 0.0000 0.0846 ( 8735 PWs) bands (ev): -3.1620 -3.1620 -3.1445 -3.1445 -3.1332 -3.1332 -3.1216 -3.1216 -3.1097 -3.1097 -3.0923 -3.0923 -3.0715 -3.0715 -3.0566 -3.0566 -3.0531 -3.0531 -3.0379 -3.0379 -3.0217 -3.0217 -3.0042 -3.0042 -1.7835 -1.7835 -1.4448 -1.4448 -1.4365 -1.4365 -1.3801 -1.3801 -1.3657 -1.3657 -1.3238 -1.3238 -1.3148 -1.3148 -1.2951 -1.2951 -1.2608 -1.2608 -1.2223 -1.2223 -1.2160 -1.2160 -1.1947 -1.1947 -1.1729 -1.1729 -1.1503 -1.1503 -1.1440 -1.1440 -1.0936 -1.0936 -1.0857 -1.0857 -1.0088 -1.0088 -0.9460 -0.9460 0.8521 0.8521 1.6178 1.6178 1.7073 1.7073 2.6461 2.6461 2.7296 2.7296 5.0831 5.0831 5.1835 5.1835 5.7377 5.7377 5.9852 5.9852 6.3124 6.3124 7.3955 7.3955 7.9063 7.9063 k = 0.0000 0.0000 0.1057 ( 8736 PWs) bands (ev): -3.1618 -3.1618 -3.1441 -3.1441 -3.1334 -3.1334 -3.1215 -3.1215 -3.1098 -3.1098 -3.0919 -3.0919 -3.0726 -3.0726 -3.0573 -3.0573 -3.0529 -3.0529 -3.0377 -3.0377 -3.0214 -3.0214 -3.0043 -3.0043 -1.7758 -1.7758 -1.4451 -1.4451 -1.4356 -1.4356 -1.3798 -1.3798 -1.3654 -1.3654 -1.3248 -1.3248 -1.3148 -1.3148 -1.2957 -1.2957 -1.2612 -1.2612 -1.2229 -1.2229 -1.2163 -1.2163 -1.1945 -1.1945 -1.1693 -1.1693 -1.1501 -1.1501 -1.1442 -1.1442 -1.0928 -1.0928 -1.0832 -1.0832 -1.0083 -1.0083 -0.9467 -0.9467 0.8102 0.8102 1.6321 1.6321 1.7161 1.7161 2.6368 2.6368 2.7201 2.7201 5.1044 5.1044 5.2341 5.2341 5.7112 5.7112 5.9817 5.9817 6.2434 6.2434 7.4268 7.4268 7.8888 7.8888 k = 0.0000 0.0000 0.1268 ( 8727 PWs) bands (ev): -3.1615 -3.1615 -3.1438 -3.1438 -3.1336 -3.1336 -3.1213 -3.1213 -3.1099 -3.1099 -3.0914 -3.0914 -3.0738 -3.0738 -3.0581 -3.0581 -3.0528 -3.0528 -3.0375 -3.0375 -3.0210 -3.0210 -3.0044 -3.0044 -1.7665 -1.7665 -1.4455 -1.4455 -1.4347 -1.4347 -1.3794 -1.3794 -1.3650 -1.3650 -1.3259 -1.3259 -1.3149 -1.3149 -1.2965 -1.2965 -1.2617 -1.2617 -1.2243 -1.2243 -1.2157 -1.2157 -1.1939 -1.1939 -1.1661 -1.1661 -1.1501 -1.1501 -1.1435 -1.1435 -1.0918 -1.0918 -1.0805 -1.0805 -1.0078 -1.0078 -0.9474 -0.9474 0.7616 0.7616 1.6483 1.6483 1.7268 1.7268 2.6257 2.6257 2.7087 2.7087 5.1299 5.1299 5.2934 5.2934 5.6768 5.6768 5.9805 5.9805 6.1716 6.1716 7.4564 7.4564 7.8715 7.8715 k = 0.0000 0.0000 0.1480 ( 8724 PWs) bands (ev): -3.1611 -3.1611 -3.1433 -3.1433 -3.1338 -3.1338 -3.1212 -3.1212 -3.1100 -3.1100 -3.0910 -3.0910 -3.0753 -3.0753 -3.0589 -3.0589 -3.0527 -3.0527 -3.0373 -3.0373 -3.0206 -3.0206 -3.0045 -3.0045 -1.7558 -1.7558 -1.4459 -1.4459 -1.4337 -1.4337 -1.3790 -1.3790 -1.3646 -1.3646 -1.3271 -1.3271 -1.3150 -1.3150 -1.2972 -1.2972 -1.2624 -1.2624 -1.2262 -1.2262 -1.2145 -1.2145 -1.1931 -1.1931 -1.1637 -1.1637 -1.1497 -1.1497 -1.1421 -1.1421 -1.0904 -1.0904 -1.0777 -1.0777 -1.0072 -1.0072 -0.9481 -0.9481 0.7072 0.7072 1.6662 1.6662 1.7394 1.7394 2.6129 2.6129 2.6956 2.6956 5.1593 5.1593 5.3590 5.3590 5.6360 5.6360 5.9771 5.9771 6.1044 6.1044 7.4829 7.4829 7.8551 7.8551 k = 0.0000 0.0000 0.1691 ( 8730 PWs) bands (ev): -3.1608 -3.1608 -3.1428 -3.1428 -3.1340 -3.1340 -3.1210 -3.1210 -3.1101 -3.1101 -3.0905 -3.0905 -3.0768 -3.0768 -3.0598 -3.0598 -3.0526 -3.0526 -3.0370 -3.0370 -3.0202 -3.0202 -3.0046 -3.0046 -1.7438 -1.7438 -1.4464 -1.4464 -1.4326 -1.4326 -1.3787 -1.3787 -1.3642 -1.3642 -1.3283 -1.3283 -1.3153 -1.3153 -1.2977 -1.2977 -1.2633 -1.2633 -1.2281 -1.2281 -1.2129 -1.2129 -1.1923 -1.1923 -1.1623 -1.1623 -1.1484 -1.1484 -1.1399 -1.1399 -1.0886 -1.0886 -1.0747 -1.0747 -1.0066 -1.0066 -0.9488 -0.9488 0.6478 0.6478 1.6855 1.6855 1.7537 1.7537 2.5987 2.5987 2.6808 2.6808 5.1922 5.1922 5.4261 5.4261 5.5926 5.5926 5.9565 5.9565 6.0602 6.0602 7.5050 7.5050 7.8407 7.8407 k = 0.0000 0.0000 0.1902 ( 8725 PWs) bands (ev): -3.1603 -3.1603 -3.1423 -3.1423 -3.1343 -3.1343 -3.1208 -3.1208 -3.1102 -3.1102 -3.0900 -3.0900 -3.0785 -3.0785 -3.0607 -3.0607 -3.0525 -3.0525 -3.0368 -3.0368 -3.0197 -3.0197 -3.0047 -3.0047 -1.7305 -1.7305 -1.4470 -1.4470 -1.4314 -1.4314 -1.3783 -1.3783 -1.3637 -1.3637 -1.3295 -1.3295 -1.3159 -1.3159 -1.2976 -1.2976 -1.2644 -1.2644 -1.2299 -1.2299 -1.2111 -1.2111 -1.1917 -1.1917 -1.1616 -1.1616 -1.1465 -1.1465 -1.1371 -1.1371 -1.0865 -1.0865 -1.0716 -1.0716 -1.0059 -1.0059 -0.9493 -0.9493 0.5844 0.5844 1.7059 1.7059 1.7697 1.7697 2.5831 2.5831 2.6646 2.6646 5.2279 5.2279 5.4751 5.4751 5.5622 5.5622 5.9099 5.9099 6.0527 6.0527 7.5219 7.5219 7.8298 7.8298 k = 0.0000 0.0000 0.2114 ( 8721 PWs) bands (ev): -3.1599 -3.1599 -3.1418 -3.1418 -3.1345 -3.1345 -3.1205 -3.1205 -3.1103 -3.1103 -3.0896 -3.0896 -3.0802 -3.0802 -3.0616 -3.0616 -3.0523 -3.0523 -3.0366 -3.0366 -3.0193 -3.0193 -3.0049 -3.0049 -1.7161 -1.7161 -1.4477 -1.4477 -1.4301 -1.4301 -1.3779 -1.3779 -1.3632 -1.3632 -1.3307 -1.3307 -1.3171 -1.3171 -1.2969 -1.2969 -1.2659 -1.2659 -1.2312 -1.2312 -1.2093 -1.2093 -1.1913 -1.1913 -1.1609 -1.1609 -1.1443 -1.1443 -1.1338 -1.1338 -1.0840 -1.0840 -1.0683 -1.0683 -1.0051 -1.0051 -0.9496 -0.9496 0.5176 0.5176 1.7273 1.7273 1.7874 1.7874 2.5663 2.5663 2.6471 2.6471 5.2658 5.2658 5.4581 5.4581 5.5816 5.5816 5.8667 5.8667 6.0653 6.0653 7.5328 7.5328 7.8233 7.8233 k = 0.0000 0.0000 0.2325 ( 8723 PWs) bands (ev): -3.1594 -3.1594 -3.1413 -3.1413 -3.1347 -3.1347 -3.1203 -3.1203 -3.1104 -3.1104 -3.0893 -3.0893 -3.0818 -3.0818 -3.0626 -3.0626 -3.0521 -3.0521 -3.0365 -3.0365 -3.0188 -3.0188 -3.0051 -3.0051 -1.7009 -1.7009 -1.4485 -1.4485 -1.4287 -1.4287 -1.3775 -1.3775 -1.3628 -1.3628 -1.3318 -1.3318 -1.3185 -1.3185 -1.2955 -1.2955 -1.2677 -1.2677 -1.2323 -1.2323 -1.2076 -1.2076 -1.1913 -1.1913 -1.1598 -1.1598 -1.1421 -1.1421 -1.1302 -1.1302 -1.0813 -1.0813 -1.0648 -1.0648 -1.0043 -1.0043 -0.9495 -0.9495 0.4483 0.4483 1.7497 1.7497 1.8065 1.8065 2.5485 2.5485 2.6285 2.6285 5.3039 5.3039 5.4117 5.4117 5.5917 5.5917 5.8598 5.8598 6.0896 6.0896 7.5372 7.5372 7.8213 7.8213 k = 0.0000 0.0000 0.2537 ( 8729 PWs) bands (ev): -3.1589 -3.1589 -3.1410 -3.1410 -3.1348 -3.1348 -3.1200 -3.1200 -3.1104 -3.1104 -3.0895 -3.0895 -3.0831 -3.0831 -3.0635 -3.0635 -3.0519 -3.0519 -3.0364 -3.0364 -3.0182 -3.0182 -3.0053 -3.0053 -1.6851 -1.6851 -1.4496 -1.4496 -1.4272 -1.4272 -1.3771 -1.3771 -1.3624 -1.3624 -1.3330 -1.3330 -1.3202 -1.3202 -1.2936 -1.2936 -1.2696 -1.2696 -1.2330 -1.2330 -1.2059 -1.2059 -1.1918 -1.1918 -1.1581 -1.1581 -1.1399 -1.1399 -1.1266 -1.1266 -1.0783 -1.0783 -1.0609 -1.0609 -1.0033 -1.0033 -0.9487 -0.9487 0.3769 0.3769 1.7728 1.7728 1.8271 1.8271 2.5298 2.5298 2.6088 2.6088 5.3262 5.3262 5.3772 5.3772 5.5593 5.5593 5.8942 5.8942 6.1282 6.1282 7.5357 7.5357 7.8214 7.8214 k = 0.0000 0.0000 0.2748 ( 8729 PWs) bands (ev): -3.1583 -3.1583 -3.1408 -3.1408 -3.1347 -3.1347 -3.1196 -3.1196 -3.1105 -3.1105 -3.0903 -3.0903 -3.0838 -3.0838 -3.0646 -3.0646 -3.0515 -3.0515 -3.0363 -3.0363 -3.0177 -3.0177 -3.0055 -3.0055 -1.6688 -1.6688 -1.4509 -1.4509 -1.4256 -1.4256 -1.3768 -1.3768 -1.3621 -1.3621 -1.3344 -1.3344 -1.3217 -1.3217 -1.2914 -1.2914 -1.2715 -1.2715 -1.2335 -1.2335 -1.2044 -1.2044 -1.1927 -1.1927 -1.1557 -1.1557 -1.1377 -1.1377 -1.1231 -1.1231 -1.0755 -1.0755 -1.0563 -1.0563 -1.0020 -1.0020 -0.9470 -0.9470 0.3041 0.3041 1.7967 1.7967 1.8490 1.8490 2.5104 2.5104 2.5882 2.5882 5.2897 5.2897 5.3996 5.3996 5.5061 5.5061 5.9393 5.9393 6.1880 6.1880 7.5297 7.5297 7.8197 7.8197 k = 0.0000 0.0000 0.2959 ( 8732 PWs) bands (ev): -3.1577 -3.1577 -3.1408 -3.1408 -3.1344 -3.1344 -3.1193 -3.1193 -3.1106 -3.1106 -3.0917 -3.0917 -3.0840 -3.0840 -3.0656 -3.0656 -3.0511 -3.0511 -3.0363 -3.0363 -3.0172 -3.0172 -3.0057 -3.0057 -1.6524 -1.6524 -1.4525 -1.4525 -1.4238 -1.4238 -1.3765 -1.3765 -1.3619 -1.3619 -1.3360 -1.3360 -1.3230 -1.3230 -1.2893 -1.2893 -1.2730 -1.2730 -1.2338 -1.2338 -1.2031 -1.2031 -1.1937 -1.1937 -1.1529 -1.1529 -1.1355 -1.1355 -1.1198 -1.1198 -1.0730 -1.0730 -1.0511 -1.0511 -1.0006 -1.0006 -0.9439 -0.9439 0.2304 0.2304 1.8211 1.8211 1.8720 1.8720 2.4903 2.4903 2.5669 2.5669 5.2387 5.2387 5.4115 5.4115 5.4723 5.4723 5.9744 5.9744 6.2722 6.2722 7.5208 7.5208 7.8130 7.8130 k = 0.0000 0.0000 0.3171 ( 8728 PWs) bands (ev): -3.1571 -3.1571 -3.1410 -3.1410 -3.1339 -3.1339 -3.1189 -3.1189 -3.1107 -3.1107 -3.0935 -3.0935 -3.0839 -3.0839 -3.0667 -3.0667 -3.0506 -3.0506 -3.0364 -3.0364 -3.0166 -3.0166 -3.0060 -3.0060 -1.6360 -1.6360 -1.4544 -1.4544 -1.4219 -1.4219 -1.3762 -1.3762 -1.3618 -1.3618 -1.3379 -1.3379 -1.3238 -1.3238 -1.2879 -1.2879 -1.2734 -1.2734 -1.2339 -1.2339 -1.2019 -1.2019 -1.1949 -1.1949 -1.1497 -1.1497 -1.1333 -1.1333 -1.1169 -1.1169 -1.0710 -1.0710 -1.0452 -1.0452 -0.9988 -0.9988 -0.9387 -0.9387 0.1563 0.1563 1.8461 1.8461 1.8960 1.8960 2.4698 2.4698 2.5450 2.5450 5.1880 5.1880 5.3604 5.3604 5.5029 5.5029 5.9971 5.9971 6.3756 6.3756 7.5106 7.5106 7.8016 7.8016 k = 0.0000 0.0000 0.3382 ( 8725 PWs) bands (ev): -3.1565 -3.1565 -3.1414 -3.1414 -3.1331 -3.1331 -3.1185 -3.1185 -3.1108 -3.1108 -3.0955 -3.0955 -3.0835 -3.0835 -3.0677 -3.0677 -3.0500 -3.0500 -3.0365 -3.0365 -3.0161 -3.0161 -3.0063 -3.0063 -1.6199 -1.6199 -1.4566 -1.4566 -1.4199 -1.4199 -1.3760 -1.3760 -1.3617 -1.3617 -1.3400 -1.3400 -1.3242 -1.3242 -1.2881 -1.2881 -1.2722 -1.2722 -1.2341 -1.2341 -1.2010 -1.2010 -1.1959 -1.1959 -1.1464 -1.1464 -1.1310 -1.1310 -1.1143 -1.1143 -1.0699 -1.0699 -1.0390 -1.0390 -0.9968 -0.9968 -0.9304 -0.9304 0.0821 0.0821 1.8715 1.8715 1.9207 1.9207 2.4489 2.4489 2.5225 2.5225 5.1396 5.1396 5.2987 5.2987 5.5463 5.5463 6.0107 6.0107 6.4913 6.4913 7.5004 7.5004 7.7877 7.7877 k = 0.0000 0.0000 0.3594 ( 8727 PWs) bands (ev): -3.1558 -3.1558 -3.1420 -3.1420 -3.1322 -3.1322 -3.1181 -3.1181 -3.1110 -3.1110 -3.0976 -3.0976 -3.0831 -3.0831 -3.0688 -3.0688 -3.0493 -3.0493 -3.0367 -3.0367 -3.0155 -3.0155 -3.0066 -3.0066 -1.6044 -1.6044 -1.4592 -1.4592 -1.4177 -1.4177 -1.3761 -1.3761 -1.3617 -1.3617 -1.3423 -1.3423 -1.3241 -1.3241 -1.2895 -1.2895 -1.2696 -1.2696 -1.2342 -1.2342 -1.2003 -1.2003 -1.1967 -1.1967 -1.1432 -1.1432 -1.1288 -1.1288 -1.1120 -1.1120 -1.0695 -1.0695 -1.0331 -1.0331 -0.9949 -0.9949 -0.9180 -0.9180 0.0083 0.0083 1.8971 1.8971 1.9460 1.9460 2.4278 2.4278 2.4997 2.4997 5.0946 5.0946 5.2384 5.2384 5.5912 5.5912 6.0182 6.0182 6.6142 6.6142 7.4910 7.4910 7.7733 7.7733 k = 0.0000 0.0000 0.3805 ( 8726 PWs) bands (ev): -3.1552 -3.1552 -3.1426 -3.1426 -3.1311 -3.1311 -3.1176 -3.1176 -3.1112 -3.1112 -3.0996 -3.0996 -3.0827 -3.0827 -3.0699 -3.0699 -3.0485 -3.0485 -3.0369 -3.0369 -3.0150 -3.0150 -3.0070 -3.0070 -1.5895 -1.5895 -1.4622 -1.4622 -1.4154 -1.4154 -1.3764 -1.3764 -1.3617 -1.3617 -1.3446 -1.3446 -1.3236 -1.3236 -1.2916 -1.2916 -1.2663 -1.2663 -1.2344 -1.2344 -1.2001 -1.2001 -1.1969 -1.1969 -1.1401 -1.1401 -1.1267 -1.1267 -1.1098 -1.1098 -1.0698 -1.0698 -1.0276 -1.0276 -0.9934 -0.9934 -0.9008 -0.9008 -0.0648 -0.0648 1.9228 1.9228 1.9714 1.9714 2.4068 2.4068 2.4765 2.4765 5.0537 5.0537 5.1816 5.1816 5.6357 5.6357 6.0209 6.0209 6.7407 6.7407 7.4830 7.4830 7.7601 7.7601 k = 0.0000 0.0000 0.4016 ( 8724 PWs) bands (ev): -3.1545 -3.1545 -3.1434 -3.1434 -3.1299 -3.1299 -3.1172 -3.1172 -3.1114 -3.1114 -3.1017 -3.1017 -3.0822 -3.0822 -3.0710 -3.0710 -3.0477 -3.0477 -3.0372 -3.0372 -3.0144 -3.0144 -3.0073 -3.0073 -1.5755 -1.5755 -1.4657 -1.4657 -1.4129 -1.4129 -1.3771 -1.3771 -1.3617 -1.3617 -1.3468 -1.3468 -1.3228 -1.3228 -1.2940 -1.2940 -1.2628 -1.2628 -1.2348 -1.2348 -1.2000 -1.2000 -1.1968 -1.1968 -1.1373 -1.1373 -1.1249 -1.1249 -1.1078 -1.1078 -1.0708 -1.0708 -1.0228 -1.0228 -0.9923 -0.9923 -0.8782 -0.8782 -0.1368 -0.1368 1.9485 1.9485 1.9966 1.9966 2.3861 2.3861 2.4532 2.4532 5.0172 5.0172 5.1291 5.1291 5.6792 5.6792 6.0198 6.0198 6.8677 6.8677 7.4767 7.4767 7.7500 7.7500 k = 0.0000 0.0000 0.4228 ( 8720 PWs) bands (ev): -3.1537 -3.1537 -3.1441 -3.1441 -3.1286 -3.1286 -3.1168 -3.1168 -3.1117 -3.1117 -3.1037 -3.1037 -3.0817 -3.0817 -3.0720 -3.0720 -3.0468 -3.0468 -3.0376 -3.0376 -3.0139 -3.0139 -3.0077 -3.0077 -1.5624 -1.5624 -1.4695 -1.4695 -1.4103 -1.4103 -1.3782 -1.3782 -1.3615 -1.3615 -1.3488 -1.3488 -1.3218 -1.3218 -1.2966 -1.2966 -1.2593 -1.2593 -1.2353 -1.2353 -1.2000 -1.2000 -1.1965 -1.1965 -1.1346 -1.1346 -1.1233 -1.1233 -1.1057 -1.1057 -1.0724 -1.0724 -1.0185 -1.0185 -0.9919 -0.9919 -0.8504 -0.8504 -0.2076 -0.2076 1.9739 1.9739 2.0211 2.0211 2.3661 2.3661 2.4299 2.4299 4.9858 4.9858 5.0817 5.0817 5.7211 5.7211 6.0151 6.0151 6.9920 6.9920 7.4719 7.4719 7.7454 7.7454 k = 0.0000 0.0000 0.4439 ( 8723 PWs) bands (ev): -3.1530 -3.1530 -3.1449 -3.1449 -3.1273 -3.1273 -3.1166 -3.1166 -3.1120 -3.1120 -3.1055 -3.1055 -3.0811 -3.0811 -3.0731 -3.0731 -3.0459 -3.0459 -3.0381 -3.0381 -3.0133 -3.0133 -3.0082 -3.0082 -1.5502 -1.5502 -1.4738 -1.4738 -1.4076 -1.4076 -1.3799 -1.3799 -1.3611 -1.3611 -1.3506 -1.3506 -1.3205 -1.3205 -1.2992 -1.2992 -1.2561 -1.2561 -1.2361 -1.2361 -1.1998 -1.1998 -1.1962 -1.1962 -1.1322 -1.1322 -1.1222 -1.1222 -1.1034 -1.1034 -1.0746 -1.0746 -1.0146 -1.0146 -0.9921 -0.9921 -0.8174 -0.8174 -0.2766 -0.2766 1.9988 1.9988 2.0441 2.0441 2.3473 2.3473 2.4068 2.4068 4.9598 4.9598 5.0396 5.0396 5.7611 5.7611 6.0072 6.0072 7.1091 7.1091 7.4685 7.4685 7.7497 7.7497 k = 0.0000 0.0000 0.4650 ( 8717 PWs) bands (ev): -3.1522 -3.1522 -3.1457 -3.1457 -3.1259 -3.1259 -3.1165 -3.1165 -3.1123 -3.1123 -3.1071 -3.1071 -3.0806 -3.0806 -3.0741 -3.0741 -3.0450 -3.0450 -3.0387 -3.0387 -3.0127 -3.0127 -3.0086 -3.0086 -1.5390 -1.5390 -1.4786 -1.4786 -1.4048 -1.4048 -1.3820 -1.3820 -1.3606 -1.3606 -1.3522 -1.3522 -1.3190 -1.3190 -1.3017 -1.3017 -1.2530 -1.2530 -1.2371 -1.2371 -1.1994 -1.1994 -1.1960 -1.1960 -1.1300 -1.1300 -1.1215 -1.1215 -1.1009 -1.1009 -1.0771 -1.0771 -1.0111 -1.0111 -0.9928 -0.9928 -0.7798 -0.7798 -0.3438 -0.3438 2.0226 2.0226 2.0647 2.0647 2.3306 2.3306 2.3843 2.3843 4.9395 4.9395 5.0033 5.0033 5.7986 5.7986 5.9962 5.9962 7.2130 7.2130 7.4653 7.4653 7.7679 7.7679 k = 0.0000 0.0000 0.4862 ( 8713 PWs) bands (ev): -3.1514 -3.1514 -3.1465 -3.1465 -3.1244 -3.1244 -3.1168 -3.1168 -3.1124 -3.1124 -3.1085 -3.1085 -3.0799 -3.0799 -3.0751 -3.0751 -3.0441 -3.0441 -3.0393 -3.0393 -3.0122 -3.0122 -3.0091 -3.0091 -1.5288 -1.5288 -1.4839 -1.4839 -1.4019 -1.4019 -1.3844 -1.3844 -1.3599 -1.3599 -1.3536 -1.3536 -1.3173 -1.3173 -1.3042 -1.3042 -1.2502 -1.2502 -1.2383 -1.2383 -1.1989 -1.1989 -1.1960 -1.1960 -1.1280 -1.1280 -1.1214 -1.1214 -1.0982 -1.0982 -1.0799 -1.0799 -1.0078 -1.0078 -0.9939 -0.9939 -0.7377 -0.7377 -0.4087 -0.4087 2.0449 2.0449 2.0814 2.0814 2.3175 2.3175 2.3627 2.3627 4.9252 4.9252 4.9731 4.9731 5.8336 5.8336 5.9821 5.9821 7.2975 7.2975 7.4613 7.4613 7.8046 7.8046 k = 0.0000 0.0000 0.5073 ( 8707 PWs) bands (ev): -3.1506 -3.1506 -3.1474 -3.1474 -3.1229 -3.1229 -3.1176 -3.1176 -3.1123 -3.1123 -3.1097 -3.1097 -3.0793 -3.0793 -3.0760 -3.0760 -3.0432 -3.0432 -3.0399 -3.0399 -3.0116 -3.0116 -3.0095 -3.0095 -1.5195 -1.5195 -1.4897 -1.4897 -1.3990 -1.3990 -1.3871 -1.3871 -1.3591 -1.3591 -1.3549 -1.3549 -1.3155 -1.3155 -1.3067 -1.3067 -1.2477 -1.2477 -1.2397 -1.2397 -1.1982 -1.1982 -1.1962 -1.1962 -1.1262 -1.1262 -1.1216 -1.1216 -1.0953 -1.0953 -1.0829 -1.0829 -1.0048 -1.0048 -0.9954 -0.9954 -0.6914 -0.6914 -0.4712 -0.4712 2.0648 2.0648 2.0925 2.0925 2.3094 2.3094 2.3430 2.3430 4.9171 4.9171 4.9490 4.9490 5.8659 5.8659 5.9649 5.9649 7.3590 7.3590 7.4547 7.4547 7.8606 7.8606 k = 0.0000 0.0000 0.5285 ( 8699 PWs) bands (ev): -3.1498 -3.1498 -3.1482 -3.1482 -3.1214 -3.1214 -3.1187 -3.1187 -3.1119 -3.1119 -3.1106 -3.1106 -3.0785 -3.0785 -3.0769 -3.0769 -3.0423 -3.0423 -3.0407 -3.0407 -3.0111 -3.0111 -3.0100 -3.0100 -1.5109 -1.5109 -1.4961 -1.4961 -1.3960 -1.3960 -1.3900 -1.3900 -1.3581 -1.3581 -1.3561 -1.3561 -1.3135 -1.3135 -1.3091 -1.3091 -1.2454 -1.2454 -1.2414 -1.2414 -1.1976 -1.1976 -1.1965 -1.1965 -1.1246 -1.1246 -1.1223 -1.1223 -1.0923 -1.0923 -1.0860 -1.0860 -1.0020 -1.0020 -0.9973 -0.9973 -0.6414 -0.6414 -0.5310 -0.5310 2.0811 2.0811 2.0962 2.0962 2.3081 2.3081 2.3262 2.3262 4.9153 4.9153 4.9313 4.9313 5.8951 5.8951 5.9447 5.9447 7.4001 7.4001 7.4438 7.4438 7.9282 7.9282 k = 0.0000 0.0000 0.5496 ( 8700 PWs) bands (ev): -3.1490 -3.1490 -3.1490 -3.1490 -3.1200 -3.1200 -3.1200 -3.1200 -3.1113 -3.1113 -3.1113 -3.1113 -3.0777 -3.0777 -3.0777 -3.0777 -3.0415 -3.0415 -3.0415 -3.0415 -3.0106 -3.0106 -3.0106 -3.0106 -1.5032 -1.5032 -1.5032 -1.5032 -1.3930 -1.3930 -1.3930 -1.3930 -1.3571 -1.3571 -1.3571 -1.3571 -1.3113 -1.3113 -1.3113 -1.3113 -1.2433 -1.2433 -1.2433 -1.2433 -1.1970 -1.1970 -1.1970 -1.1970 -1.1233 -1.1233 -1.1233 -1.1233 -1.0892 -1.0892 -1.0892 -1.0892 -0.9995 -0.9995 -0.9995 -0.9995 -0.5878 -0.5878 -0.5878 -0.5878 2.0921 2.0921 2.0921 2.0921 2.3141 2.3141 2.3141 2.3141 4.9201 4.9201 4.9201 4.9201 5.9214 5.9214 5.9214 5.9214 7.4266 7.4266 7.4266 7.4266 7.9946 7.9946 k = 0.0000 0.0000 0.5496 ( 8700 PWs) bands (ev): -3.1490 -3.1490 -3.1490 -3.1490 -3.1200 -3.1200 -3.1200 -3.1200 -3.1113 -3.1113 -3.1113 -3.1113 -3.0777 -3.0777 -3.0777 -3.0777 -3.0415 -3.0415 -3.0415 -3.0415 -3.0106 -3.0106 -3.0106 -3.0106 -1.5032 -1.5032 -1.5032 -1.5032 -1.3930 -1.3930 -1.3930 -1.3930 -1.3571 -1.3571 -1.3571 -1.3571 -1.3113 -1.3113 -1.3113 -1.3113 -1.2433 -1.2433 -1.2433 -1.2433 -1.1970 -1.1970 -1.1970 -1.1970 -1.1233 -1.1233 -1.1233 -1.1233 -1.0892 -1.0892 -1.0892 -1.0892 -0.9995 -0.9995 -0.9995 -0.9995 -0.5878 -0.5878 -0.5878 -0.5878 2.0921 2.0921 2.0921 2.0921 2.3141 2.3141 2.3141 2.3141 4.9201 4.9201 4.9201 4.9201 5.9214 5.9214 5.9214 5.9214 7.4266 7.4266 7.4266 7.4266 7.9946 7.9946 k = 0.0000 0.0214 0.5496 ( 8704 PWs) bands (ev): -3.1502 -3.1502 -3.1480 -3.1480 -3.1217 -3.1217 -3.1187 -3.1187 -3.1119 -3.1119 -3.1101 -3.1101 -3.0790 -3.0790 -3.0765 -3.0765 -3.0425 -3.0425 -3.0404 -3.0404 -3.0109 -3.0109 -3.0102 -3.0102 -1.5053 -1.5053 -1.5007 -1.5007 -1.3939 -1.3939 -1.3919 -1.3919 -1.3600 -1.3600 -1.3549 -1.3549 -1.3156 -1.3156 -1.3061 -1.3061 -1.2449 -1.2449 -1.2423 -1.2423 -1.2001 -1.2001 -1.1937 -1.1937 -1.1249 -1.1249 -1.1228 -1.1228 -1.0908 -1.0908 -1.0864 -1.0864 -1.0028 -1.0028 -0.9960 -0.9960 -0.5924 -0.5924 -0.5813 -0.5813 1.9974 1.9974 2.1828 2.1828 2.3126 2.3126 2.3175 2.3175 4.9138 4.9138 4.9205 4.9205 5.8298 5.8298 6.0290 6.0290 7.3394 7.3394 7.4887 7.4887 7.9144 7.9144 k = 0.0000 0.0427 0.5496 ( 8712 PWs) bands (ev): -3.1515 -3.1515 -3.1471 -3.1471 -3.1237 -3.1237 -3.1182 -3.1182 -3.1118 -3.1118 -3.1084 -3.1084 -3.0804 -3.0804 -3.0754 -3.0754 -3.0436 -3.0436 -3.0394 -3.0394 -3.0113 -3.0113 -3.0099 -3.0099 -1.5071 -1.5071 -1.4979 -1.4979 -1.3945 -1.3945 -1.3906 -1.3906 -1.3634 -1.3634 -1.3535 -1.3535 -1.3187 -1.3187 -1.2999 -1.2999 -1.2470 -1.2470 -1.2419 -1.2419 -1.2031 -1.2031 -1.1902 -1.1902 -1.1274 -1.1274 -1.1231 -1.1231 -1.0913 -1.0913 -1.0829 -1.0829 -1.0058 -1.0058 -0.9923 -0.9923 -0.5950 -0.5950 -0.5726 -0.5726 1.9000 1.9000 2.2650 2.2650 2.3131 2.3131 2.3259 2.3259 4.9024 4.9024 4.9137 4.9137 5.7589 5.7589 6.1479 6.1479 7.2413 7.2413 7.5020 7.5020 7.8674 7.8674 k = 0.0000 0.0641 0.5496 ( 8713 PWs) bands (ev): -3.1529 -3.1529 -3.1464 -3.1464 -3.1258 -3.1258 -3.1183 -3.1183 -3.1111 -3.1111 -3.1063 -3.1063 -3.0818 -3.0818 -3.0744 -3.0744 -3.0447 -3.0447 -3.0384 -3.0384 -3.0117 -3.0117 -3.0097 -3.0097 -1.5086 -1.5086 -1.4948 -1.4948 -1.3948 -1.3948 -1.3894 -1.3894 -1.3670 -1.3670 -1.3528 -1.3528 -1.3208 -1.3208 -1.2930 -1.2930 -1.2494 -1.2494 -1.2423 -1.2423 -1.2059 -1.2059 -1.1867 -1.1867 -1.1306 -1.1306 -1.1239 -1.1239 -1.0908 -1.0908 -1.0788 -1.0788 -1.0085 -1.0085 -0.9883 -0.9883 -0.5956 -0.5956 -0.5620 -0.5620 1.8007 1.8007 2.3059 2.3059 2.3181 2.3181 2.3686 2.3686 4.8799 4.8799 4.9044 4.9044 5.7134 5.7134 6.2740 6.2740 7.1395 7.1395 7.4557 7.4557 7.8573 7.8573 k = 0.0000 0.0855 0.5496 ( 8705 PWs) bands (ev): -3.1544 -3.1544 -3.1458 -3.1458 -3.1278 -3.1278 -3.1186 -3.1186 -3.1101 -3.1101 -3.1040 -3.1040 -3.0832 -3.0832 -3.0735 -3.0735 -3.0458 -3.0458 -3.0375 -3.0375 -3.0121 -3.0121 -3.0094 -3.0094 -1.5096 -1.5096 -1.4915 -1.4915 -1.3949 -1.3949 -1.3886 -1.3886 -1.3704 -1.3704 -1.3527 -1.3527 -1.3220 -1.3220 -1.2857 -1.2857 -1.2520 -1.2520 -1.2433 -1.2433 -1.2086 -1.2086 -1.1831 -1.1831 -1.1345 -1.1345 -1.1250 -1.1250 -1.0897 -1.0897 -1.0746 -1.0746 -1.0108 -1.0108 -0.9842 -0.9842 -0.5942 -0.5942 -0.5492 -0.5492 1.7002 1.7002 2.3115 2.3115 2.3253 2.3253 2.4410 2.4410 4.8415 4.8415 4.8979 4.8979 5.6950 5.6950 6.4030 6.4030 7.0391 7.0391 7.3727 7.3727 7.8542 7.8542 k = 0.0000 0.1068 0.5496 ( 8703 PWs) bands (ev): -3.1560 -3.1560 -3.1454 -3.1454 -3.1296 -3.1296 -3.1191 -3.1191 -3.1090 -3.1090 -3.1017 -3.1017 -3.0845 -3.0845 -3.0727 -3.0727 -3.0468 -3.0468 -3.0367 -3.0367 -3.0125 -3.0125 -3.0092 -3.0092 -1.5103 -1.5103 -1.4880 -1.4880 -1.3947 -1.3947 -1.3885 -1.3885 -1.3731 -1.3731 -1.3530 -1.3530 -1.3225 -1.3225 -1.2784 -1.2784 -1.2545 -1.2545 -1.2447 -1.2447 -1.2113 -1.2113 -1.1795 -1.1795 -1.1385 -1.1385 -1.1261 -1.1261 -1.0883 -1.0883 -1.0702 -1.0702 -1.0127 -1.0127 -0.9800 -0.9800 -0.5908 -0.5908 -0.5342 -0.5342 1.5991 1.5991 2.3150 2.3150 2.3322 2.3322 2.5109 2.5109 4.7897 4.7897 4.8945 4.8945 5.7022 5.7022 6.5272 6.5272 6.9466 6.9466 7.2771 7.2771 7.8351 7.8351 k = 0.0000 0.1282 0.5496 ( 8707 PWs) bands (ev): -3.1576 -3.1576 -3.1451 -3.1451 -3.1312 -3.1312 -3.1196 -3.1196 -3.1078 -3.1078 -3.0995 -3.0995 -3.0858 -3.0858 -3.0721 -3.0721 -3.0479 -3.0479 -3.0360 -3.0360 -3.0129 -3.0129 -3.0090 -3.0090 -1.5107 -1.5107 -1.4843 -1.4843 -1.3945 -1.3945 -1.3894 -1.3894 -1.3746 -1.3746 -1.3535 -1.3535 -1.3224 -1.3224 -1.2721 -1.2721 -1.2563 -1.2563 -1.2460 -1.2460 -1.2139 -1.2139 -1.1761 -1.1761 -1.1425 -1.1425 -1.1272 -1.1272 -1.0868 -1.0868 -1.0660 -1.0660 -1.0143 -1.0143 -0.9757 -0.9757 -0.5855 -0.5855 -0.5170 -0.5170 1.4979 1.4979 2.3190 2.3190 2.3394 2.3394 2.5740 2.5740 4.7296 4.7296 4.8947 4.8947 5.7304 5.7304 6.6243 6.6243 6.8790 6.8790 7.1847 7.1847 7.7982 7.7982 k = 0.0000 0.1496 0.5496 ( 8716 PWs) bands (ev): -3.1593 -3.1593 -3.1451 -3.1451 -3.1325 -3.1325 -3.1201 -3.1201 -3.1066 -3.1066 -3.0974 -3.0974 -3.0870 -3.0870 -3.0716 -3.0716 -3.0489 -3.0489 -3.0354 -3.0354 -3.0133 -3.0133 -3.0088 -3.0088 -1.5107 -1.5107 -1.4806 -1.4806 -1.3950 -1.3950 -1.3906 -1.3906 -1.3749 -1.3749 -1.3539 -1.3539 -1.3219 -1.3219 -1.2693 -1.2693 -1.2561 -1.2561 -1.2463 -1.2463 -1.2164 -1.2164 -1.1732 -1.1732 -1.1462 -1.1462 -1.1282 -1.1282 -1.0854 -1.0854 -1.0621 -1.0621 -1.0153 -1.0153 -0.9714 -0.9714 -0.5783 -0.5783 -0.4975 -0.4975 1.3973 1.3973 2.3238 2.3238 2.3472 2.3472 2.6285 2.6285 4.6667 4.6667 4.8985 4.8985 5.7740 5.7740 6.6402 6.6402 6.8690 6.8690 7.1220 7.1220 7.7495 7.7495 k = 0.0000 0.1709 0.5496 ( 8720 PWs) bands (ev): -3.1609 -3.1609 -3.1453 -3.1453 -3.1336 -3.1336 -3.1205 -3.1205 -3.1054 -3.1054 -3.0959 -3.0959 -3.0876 -3.0876 -3.0712 -3.0712 -3.0498 -3.0498 -3.0349 -3.0349 -3.0137 -3.0137 -3.0085 -3.0085 -1.5104 -1.5104 -1.4768 -1.4768 -1.3973 -1.3973 -1.3904 -1.3904 -1.3749 -1.3749 -1.3541 -1.3541 -1.3211 -1.3211 -1.2706 -1.2706 -1.2555 -1.2555 -1.2432 -1.2432 -1.2186 -1.2186 -1.1710 -1.1710 -1.1493 -1.1493 -1.1289 -1.1289 -1.0841 -1.0841 -1.0584 -1.0584 -1.0158 -1.0158 -0.9672 -0.9672 -0.5692 -0.5692 -0.4756 -0.4756 1.2978 1.2978 2.3294 2.3294 2.3554 2.3554 2.6729 2.6729 4.6059 4.6059 4.9062 4.9062 5.8268 5.8268 6.5866 6.5866 6.8501 6.8501 7.1473 7.1473 7.6951 7.6951 k = 0.0000 0.1923 0.5496 ( 8716 PWs) bands (ev): -3.1625 -3.1625 -3.1457 -3.1457 -3.1343 -3.1343 -3.1209 -3.1209 -3.1043 -3.1043 -3.0952 -3.0952 -3.0876 -3.0876 -3.0709 -3.0709 -3.0507 -3.0507 -3.0346 -3.0346 -3.0141 -3.0141 -3.0083 -3.0083 -1.5098 -1.5098 -1.4731 -1.4731 -1.4005 -1.4005 -1.3895 -1.3895 -1.3750 -1.3750 -1.3538 -1.3538 -1.3201 -1.3201 -1.2738 -1.2738 -1.2565 -1.2565 -1.2378 -1.2378 -1.2200 -1.2200 -1.1699 -1.1699 -1.1516 -1.1516 -1.1294 -1.1294 -1.0832 -1.0832 -1.0552 -1.0552 -1.0157 -1.0157 -0.9632 -0.9632 -0.5583 -0.5583 -0.4513 -0.4513 1.1999 1.1999 2.3357 2.3357 2.3639 2.3639 2.7060 2.7060 4.5512 4.5512 4.9176 4.9176 5.8816 5.8816 6.5211 6.5211 6.7787 6.7787 7.2495 7.2495 7.6403 7.6403 k = 0.0000 0.2137 0.5496 ( 8712 PWs) bands (ev): -3.1641 -3.1641 -3.1462 -3.1462 -3.1349 -3.1349 -3.1213 -3.1213 -3.1031 -3.1031 -3.0954 -3.0954 -3.0867 -3.0867 -3.0708 -3.0708 -3.0516 -3.0516 -3.0345 -3.0345 -3.0144 -3.0144 -3.0081 -3.0081 -1.5090 -1.5090 -1.4695 -1.4695 -1.4039 -1.4039 -1.3883 -1.3883 -1.3752 -1.3752 -1.3531 -1.3531 -1.3188 -1.3188 -1.2776 -1.2776 -1.2581 -1.2581 -1.2334 -1.2334 -1.2191 -1.2191 -1.1698 -1.1698 -1.1528 -1.1528 -1.1295 -1.1295 -1.0825 -1.0825 -1.0524 -1.0524 -1.0151 -1.0151 -0.9595 -0.9595 -0.5458 -0.5458 -0.4246 -0.4246 1.1043 1.1043 2.3427 2.3427 2.3726 2.3726 2.7266 2.7266 4.5057 4.5057 4.9327 4.9327 5.9290 5.9290 6.4650 6.4650 6.6936 6.6936 7.3690 7.3690 7.5937 7.5937 k = 0.0000 0.2350 0.5496 ( 8714 PWs) bands (ev): -3.1655 -3.1655 -3.1469 -3.1469 -3.1352 -3.1352 -3.1217 -3.1217 -3.1021 -3.1021 -3.0962 -3.0962 -3.0853 -3.0853 -3.0707 -3.0707 -3.0523 -3.0523 -3.0345 -3.0345 -3.0147 -3.0147 -3.0078 -3.0078 -1.5079 -1.5079 -1.4661 -1.4661 -1.4071 -1.4071 -1.3873 -1.3873 -1.3755 -1.3755 -1.3521 -1.3521 -1.3174 -1.3174 -1.2817 -1.2817 -1.2600 -1.2600 -1.2320 -1.2320 -1.2151 -1.2151 -1.1704 -1.1704 -1.1535 -1.1535 -1.1292 -1.1292 -1.0822 -1.0822 -1.0499 -1.0499 -1.0140 -1.0140 -0.9561 -0.9561 -0.5320 -0.5320 -0.3954 -0.3954 1.0115 1.0115 2.3500 2.3500 2.3813 2.3813 2.7340 2.7340 4.4716 4.4716 4.9514 4.9514 5.9570 5.9570 6.4256 6.4256 6.6152 6.6152 7.4506 7.4506 7.5933 7.5933 k = 0.0000 0.2564 0.5496 ( 8714 PWs) bands (ev): -3.1668 -3.1668 -3.1476 -3.1476 -3.1353 -3.1353 -3.1220 -3.1220 -3.1012 -3.1012 -3.0971 -3.0971 -3.0837 -3.0837 -3.0708 -3.0708 -3.0531 -3.0531 -3.0348 -3.0348 -3.0150 -3.0150 -3.0076 -3.0076 -1.5067 -1.5067 -1.4629 -1.4629 -1.4101 -1.4101 -1.3866 -1.3866 -1.3757 -1.3757 -1.3509 -1.3509 -1.3160 -1.3160 -1.2859 -1.2859 -1.2622 -1.2622 -1.2324 -1.2324 -1.2096 -1.2096 -1.1708 -1.1708 -1.1539 -1.1539 -1.1285 -1.1285 -1.0821 -1.0821 -1.0478 -1.0478 -1.0126 -1.0126 -0.9530 -0.9530 -0.5172 -0.5172 -0.3636 -0.3636 0.9224 0.9224 2.3577 2.3577 2.3898 2.3898 2.7279 2.7279 4.4503 4.4503 4.9735 4.9735 5.9568 5.9568 6.3917 6.3917 6.5661 6.5661 7.4420 7.4420 7.6861 7.6861 k = 0.0000 0.2778 0.5496 ( 8713 PWs) bands (ev): -3.1679 -3.1679 -3.1482 -3.1482 -3.1354 -3.1354 -3.1224 -3.1224 -3.1009 -3.1009 -3.0976 -3.0976 -3.0822 -3.0822 -3.0708 -3.0708 -3.0538 -3.0538 -3.0352 -3.0352 -3.0152 -3.0152 -3.0073 -3.0073 -1.5052 -1.5052 -1.4601 -1.4601 -1.4127 -1.4127 -1.3866 -1.3866 -1.3754 -1.3754 -1.3495 -1.3495 -1.3148 -1.3148 -1.2899 -1.2899 -1.2646 -1.2646 -1.2330 -1.2330 -1.2045 -1.2045 -1.1704 -1.1704 -1.1543 -1.1543 -1.1277 -1.1277 -1.0823 -1.0823 -1.0458 -1.0458 -1.0108 -1.0108 -0.9504 -0.9504 -0.5021 -0.5021 -0.3293 -0.3293 0.8378 0.8378 2.3654 2.3654 2.3978 2.3978 2.7090 2.7090 4.4421 4.4421 4.9985 4.9985 5.9310 5.9310 6.3369 6.3369 6.5686 6.5686 7.4133 7.4133 7.8003 7.8003 k = 0.0000 0.2991 0.5496 ( 8715 PWs) bands (ev): -3.1689 -3.1689 -3.1488 -3.1488 -3.1354 -3.1354 -3.1227 -3.1227 -3.1013 -3.1013 -3.0975 -3.0975 -3.0807 -3.0807 -3.0709 -3.0709 -3.0544 -3.0544 -3.0357 -3.0357 -3.0154 -3.0154 -3.0070 -3.0070 -1.5036 -1.5036 -1.4577 -1.4577 -1.4150 -1.4150 -1.3871 -1.3871 -1.3746 -1.3746 -1.3480 -1.3480 -1.3140 -1.3140 -1.2935 -1.2935 -1.2673 -1.2673 -1.2333 -1.2333 -1.2007 -1.2007 -1.1687 -1.1687 -1.1546 -1.1546 -1.1268 -1.1268 -1.0826 -1.0826 -1.0440 -1.0440 -1.0090 -1.0090 -0.9483 -0.9483 -0.4873 -0.4873 -0.2924 -0.2924 0.7587 0.7587 2.3728 2.3728 2.4051 2.4051 2.6785 2.6785 4.4469 4.4469 5.0263 5.0263 5.8897 5.8897 6.2646 6.2646 6.6042 6.6042 7.3954 7.3954 7.9039 7.9039 k = 0.0000 0.3205 0.5496 ( 8705 PWs) bands (ev): -3.1696 -3.1696 -3.1494 -3.1494 -3.1354 -3.1354 -3.1230 -3.1230 -3.1023 -3.1023 -3.0969 -3.0969 -3.0794 -3.0794 -3.0709 -3.0709 -3.0551 -3.0551 -3.0365 -3.0365 -3.0156 -3.0156 -3.0067 -3.0067 -1.5018 -1.5018 -1.4559 -1.4559 -1.4168 -1.4168 -1.3880 -1.3880 -1.3736 -1.3736 -1.3465 -1.3465 -1.3139 -1.3139 -1.2964 -1.2964 -1.2704 -1.2704 -1.2333 -1.2333 -1.1982 -1.1982 -1.1661 -1.1661 -1.1545 -1.1545 -1.1261 -1.1261 -1.0829 -1.0829 -1.0423 -1.0423 -1.0071 -1.0071 -0.9467 -0.9467 -0.4739 -0.4739 -0.2529 -0.2529 0.6863 0.6863 2.3793 2.3793 2.4114 2.4114 2.6384 2.6384 4.4636 4.4636 5.0563 5.0563 5.8421 5.8421 6.1882 6.1882 6.6441 6.6441 7.3991 7.3991 7.9856 7.9856 k = 0.0000 0.3419 0.5496 ( 8704 PWs) bands (ev): -3.1702 -3.1702 -3.1498 -3.1498 -3.1354 -3.1354 -3.1233 -3.1233 -3.1035 -3.1035 -3.0962 -3.0962 -3.0783 -3.0783 -3.0708 -3.0708 -3.0557 -3.0557 -3.0373 -3.0373 -3.0158 -3.0158 -3.0064 -3.0064 -1.5000 -1.5000 -1.4548 -1.4548 -1.4181 -1.4181 -1.3891 -1.3891 -1.3725 -1.3725 -1.3449 -1.3449 -1.3148 -1.3148 -1.2984 -1.2984 -1.2737 -1.2737 -1.2331 -1.2331 -1.1966 -1.1966 -1.1637 -1.1637 -1.1532 -1.1532 -1.1256 -1.1256 -1.0832 -1.0832 -1.0406 -1.0406 -1.0053 -1.0053 -0.9457 -0.9457 -0.4630 -0.4630 -0.2109 -0.2109 0.6220 0.6220 2.3839 2.3839 2.4160 2.4160 2.5918 2.5918 4.4909 4.4909 5.0879 5.0879 5.7942 5.7942 6.1135 6.1135 6.6710 6.6710 7.4311 7.4311 8.0379 8.0379 k = 0.0000 0.3632 0.5496 ( 8708 PWs) bands (ev): -3.1705 -3.1705 -3.1500 -3.1500 -3.1354 -3.1354 -3.1235 -3.1235 -3.1046 -3.1046 -3.0955 -3.0955 -3.0773 -3.0773 -3.0705 -3.0705 -3.0564 -3.0564 -3.0383 -3.0383 -3.0159 -3.0159 -3.0061 -3.0061 -1.4980 -1.4980 -1.4543 -1.4543 -1.4188 -1.4188 -1.3901 -1.3901 -1.3716 -1.3716 -1.3432 -1.3432 -1.3166 -1.3166 -1.2995 -1.2995 -1.2771 -1.2771 -1.2330 -1.2330 -1.1952 -1.1952 -1.1623 -1.1623 -1.1502 -1.1502 -1.1253 -1.1253 -1.0834 -1.0834 -1.0390 -1.0390 -1.0037 -1.0037 -0.9451 -0.9451 -0.4560 -0.4560 -0.1664 -0.1664 0.5674 0.5674 2.3835 2.3835 2.4184 2.4184 2.5435 2.5435 4.5274 4.5274 5.1205 5.1205 5.7492 5.7492 6.0429 6.0429 6.6785 6.6785 7.4920 7.4920 8.0591 8.0591 k = 0.0000 0.3846 0.5496 ( 8704 PWs) bands (ev): -3.1705 -3.1705 -3.1502 -3.1502 -3.1354 -3.1354 -3.1238 -3.1238 -3.1058 -3.1058 -3.0949 -3.0949 -3.0765 -3.0765 -3.0701 -3.0701 -3.0570 -3.0570 -3.0394 -3.0394 -3.0160 -3.0160 -3.0058 -3.0058 -1.4959 -1.4959 -1.4546 -1.4546 -1.4191 -1.4191 -1.3911 -1.3911 -1.3707 -1.3707 -1.3417 -1.3417 -1.3189 -1.3189 -1.3001 -1.3001 -1.2803 -1.2803 -1.2332 -1.2332 -1.1939 -1.1939 -1.1617 -1.1617 -1.1463 -1.1463 -1.1254 -1.1254 -1.0834 -1.0834 -1.0374 -1.0374 -1.0022 -1.0022 -0.9451 -0.9451 -0.4546 -0.4546 -0.1194 -0.1194 0.5241 0.5241 2.3702 2.3702 2.4186 2.4186 2.5031 2.5031 4.5718 4.5718 5.1531 5.1531 5.7091 5.7091 5.9780 5.9780 6.6680 6.6680 7.5749 7.5749 8.0551 8.0551 k = 0.0000 0.4060 0.5496 ( 8700 PWs) bands (ev): -3.1704 -3.1704 -3.1502 -3.1502 -3.1355 -3.1355 -3.1241 -3.1241 -3.1069 -3.1069 -3.0944 -3.0944 -3.0759 -3.0759 -3.0696 -3.0696 -3.0577 -3.0577 -3.0406 -3.0406 -3.0161 -3.0161 -3.0056 -3.0056 -1.4937 -1.4937 -1.4555 -1.4555 -1.4191 -1.4191 -1.3918 -1.3918 -1.3701 -1.3701 -1.3403 -1.3403 -1.3213 -1.3213 -1.3007 -1.3007 -1.2833 -1.2833 -1.2339 -1.2339 -1.1926 -1.1926 -1.1609 -1.1609 -1.1424 -1.1424 -1.1255 -1.1255 -1.0830 -1.0830 -1.0358 -1.0358 -1.0010 -1.0010 -0.9457 -0.9457 -0.4600 -0.4600 -0.0699 -0.0699 0.4936 0.4936 2.3331 2.3331 2.4182 2.4182 2.4809 2.4809 4.6228 4.6228 5.1848 5.1848 5.6750 5.6750 5.9200 5.9200 6.6448 6.6448 7.6657 7.6657 8.0391 8.0391 k = 0.0000 0.4060 0.5496 ( 8700 PWs) bands (ev): -3.1704 -3.1704 -3.1502 -3.1502 -3.1355 -3.1355 -3.1241 -3.1241 -3.1069 -3.1069 -3.0944 -3.0944 -3.0759 -3.0759 -3.0696 -3.0696 -3.0577 -3.0577 -3.0406 -3.0406 -3.0161 -3.0161 -3.0056 -3.0056 -1.4937 -1.4937 -1.4555 -1.4555 -1.4191 -1.4191 -1.3918 -1.3918 -1.3701 -1.3701 -1.3403 -1.3403 -1.3213 -1.3213 -1.3007 -1.3007 -1.2833 -1.2833 -1.2339 -1.2339 -1.1926 -1.1926 -1.1609 -1.1609 -1.1424 -1.1424 -1.1255 -1.1255 -1.0830 -1.0830 -1.0358 -1.0358 -1.0010 -1.0010 -0.9457 -0.9457 -0.4600 -0.4600 -0.0699 -0.0699 0.4936 0.4936 2.3331 2.3331 2.4182 2.4182 2.4809 2.4809 4.6228 4.6228 5.1848 5.1848 5.6750 5.6750 5.9200 5.9200 6.6448 6.6448 7.6657 7.6657 8.0391 8.0391 k = 0.0000 0.4166 0.5306 ( 8700 PWs) bands (ev): -3.1703 -3.1703 -3.1500 -3.1500 -3.1357 -3.1357 -3.1241 -3.1241 -3.1071 -3.1071 -3.0951 -3.0951 -3.0758 -3.0758 -3.0690 -3.0690 -3.0579 -3.0579 -3.0412 -3.0412 -3.0159 -3.0159 -3.0059 -3.0059 -1.4931 -1.4931 -1.4546 -1.4546 -1.4185 -1.4185 -1.3925 -1.3925 -1.3709 -1.3709 -1.3392 -1.3392 -1.3223 -1.3223 -1.3011 -1.3011 -1.2862 -1.2862 -1.2369 -1.2369 -1.1882 -1.1882 -1.1583 -1.1583 -1.1382 -1.1382 -1.1255 -1.1255 -1.0817 -1.0817 -1.0353 -1.0353 -1.0015 -1.0015 -0.9463 -0.9463 -0.4327 -0.4327 -0.1001 -0.1001 0.5092 0.5092 2.3014 2.3014 2.4130 2.4130 2.4532 2.4532 4.6563 4.6563 5.1784 5.1784 5.6927 5.6927 5.9627 5.9627 6.6450 6.6450 7.6810 7.6810 7.9731 7.9731 k = 0.0000 0.4271 0.5117 ( 8701 PWs) bands (ev): -3.1699 -3.1699 -3.1499 -3.1499 -3.1359 -3.1359 -3.1241 -3.1241 -3.1072 -3.1072 -3.0959 -3.0959 -3.0758 -3.0758 -3.0685 -3.0685 -3.0581 -3.0581 -3.0419 -3.0419 -3.0156 -3.0156 -3.0062 -3.0062 -1.4924 -1.4924 -1.4539 -1.4539 -1.4178 -1.4178 -1.3934 -1.3934 -1.3713 -1.3713 -1.3385 -1.3385 -1.3232 -1.3232 -1.3016 -1.3016 -1.2890 -1.2890 -1.2404 -1.2404 -1.1832 -1.1832 -1.1559 -1.1559 -1.1349 -1.1349 -1.1251 -1.1251 -1.0798 -1.0798 -1.0349 -1.0349 -1.0024 -1.0024 -0.9473 -0.9473 -0.4100 -0.4100 -0.1284 -0.1284 0.5351 0.5351 2.2501 2.2501 2.4043 2.4043 2.4410 2.4410 4.6970 4.6970 5.1708 5.1708 5.7118 5.7118 6.0033 6.0033 6.6607 6.6607 7.6518 7.6518 7.9393 7.9393 k = 0.0000 0.4377 0.4927 ( 8693 PWs) bands (ev): -3.1694 -3.1694 -3.1497 -3.1497 -3.1361 -3.1361 -3.1241 -3.1241 -3.1073 -3.1073 -3.0966 -3.0966 -3.0758 -3.0758 -3.0680 -3.0680 -3.0583 -3.0583 -3.0427 -3.0427 -3.0153 -3.0153 -3.0066 -3.0066 -1.4915 -1.4915 -1.4536 -1.4536 -1.4172 -1.4172 -1.3943 -1.3943 -1.3715 -1.3715 -1.3384 -1.3384 -1.3239 -1.3239 -1.3022 -1.3022 -1.2914 -1.2914 -1.2440 -1.2440 -1.1780 -1.1780 -1.1535 -1.1535 -1.1331 -1.1331 -1.1236 -1.1236 -1.0773 -1.0773 -1.0344 -1.0344 -1.0035 -1.0035 -0.9488 -0.9488 -0.3920 -0.3920 -0.1550 -0.1550 0.5710 0.5710 2.1838 2.1838 2.3972 2.3972 2.4357 2.4357 4.7430 4.7430 5.1626 5.1626 5.7316 5.7316 6.0417 6.0417 6.6928 6.6928 7.5758 7.5758 7.9358 7.9358 k = 0.0000 0.4483 0.4737 ( 8696 PWs) bands (ev): -3.1687 -3.1687 -3.1496 -3.1496 -3.1361 -3.1361 -3.1242 -3.1242 -3.1074 -3.1074 -3.0974 -3.0974 -3.0757 -3.0757 -3.0677 -3.0677 -3.0584 -3.0584 -3.0436 -3.0436 -3.0150 -3.0150 -3.0069 -3.0069 -1.4904 -1.4904 -1.4536 -1.4536 -1.4165 -1.4165 -1.3954 -1.3954 -1.3712 -1.3712 -1.3390 -1.3390 -1.3243 -1.3243 -1.3028 -1.3028 -1.2932 -1.2932 -1.2478 -1.2478 -1.1728 -1.1728 -1.1513 -1.1513 -1.1326 -1.1326 -1.1213 -1.1213 -1.0744 -1.0744 -1.0339 -1.0339 -1.0047 -1.0047 -0.9509 -0.9509 -0.3781 -0.3781 -0.1798 -0.1798 0.6163 0.6163 2.1081 2.1081 2.3925 2.3925 2.4320 2.4320 4.7925 4.7925 5.1543 5.1543 5.7510 5.7510 6.0796 6.0796 6.7405 6.7405 7.4766 7.4766 7.9274 7.9274 k = 0.0000 0.4589 0.4548 ( 8691 PWs) bands (ev): -3.1678 -3.1678 -3.1496 -3.1496 -3.1360 -3.1360 -3.1244 -3.1244 -3.1073 -3.1073 -3.0982 -3.0982 -3.0756 -3.0756 -3.0675 -3.0675 -3.0584 -3.0584 -3.0445 -3.0445 -3.0147 -3.0147 -3.0074 -3.0074 -1.4890 -1.4890 -1.4540 -1.4540 -1.4158 -1.4158 -1.3967 -1.3967 -1.3707 -1.3707 -1.3404 -1.3404 -1.3243 -1.3243 -1.3035 -1.3035 -1.2944 -1.2944 -1.2515 -1.2515 -1.1679 -1.1679 -1.1490 -1.1490 -1.1326 -1.1326 -1.1186 -1.1186 -1.0714 -1.0714 -1.0334 -1.0334 -1.0059 -1.0059 -0.9533 -0.9533 -0.3676 -0.3676 -0.2026 -0.2026 0.6702 0.6702 2.0262 2.0262 2.3896 2.3896 2.4284 2.4284 4.8436 4.8436 5.1463 5.1463 5.7700 5.7700 6.1187 6.1187 6.8012 6.8012 7.3715 7.3715 7.8873 7.8873 k = 0.0000 0.4694 0.4358 ( 8693 PWs) bands (ev): -3.1667 -3.1667 -3.1499 -3.1499 -3.1357 -3.1357 -3.1247 -3.1247 -3.1073 -3.1073 -3.0990 -3.0990 -3.0755 -3.0755 -3.0675 -3.0675 -3.0583 -3.0583 -3.0455 -3.0455 -3.0143 -3.0143 -3.0078 -3.0078 -1.4873 -1.4873 -1.4548 -1.4548 -1.4151 -1.4151 -1.3980 -1.3980 -1.3699 -1.3699 -1.3424 -1.3424 -1.3239 -1.3239 -1.3045 -1.3045 -1.2946 -1.2946 -1.2553 -1.2553 -1.1636 -1.1636 -1.1469 -1.1469 -1.1325 -1.1325 -1.1162 -1.1162 -1.0683 -1.0683 -1.0330 -1.0330 -1.0067 -1.0067 -0.9563 -0.9563 -0.3598 -0.3598 -0.2237 -0.2237 0.7316 0.7316 1.9401 1.9401 2.3879 2.3879 2.4246 2.4246 4.8939 4.8939 5.1389 5.1389 5.7899 5.7899 6.1588 6.1588 6.8713 6.8713 7.2702 7.2702 7.8142 7.8142 k = 0.0000 0.4800 0.4169 ( 8694 PWs) bands (ev): -3.1655 -3.1655 -3.1503 -3.1503 -3.1352 -3.1352 -3.1251 -3.1251 -3.1071 -3.1071 -3.0998 -3.0998 -3.0752 -3.0752 -3.0678 -3.0678 -3.0579 -3.0579 -3.0465 -3.0465 -3.0139 -3.0139 -3.0082 -3.0082 -1.4854 -1.4854 -1.4560 -1.4560 -1.4143 -1.4143 -1.3995 -1.3995 -1.3689 -1.3689 -1.3448 -1.3448 -1.3233 -1.3233 -1.3058 -1.3058 -1.2940 -1.2940 -1.2590 -1.2590 -1.1599 -1.1599 -1.1452 -1.1452 -1.1317 -1.1317 -1.1141 -1.1141 -1.0654 -1.0654 -1.0331 -1.0331 -1.0067 -1.0067 -0.9597 -0.9597 -0.3537 -0.3537 -0.2428 -0.2428 0.7996 0.7996 1.8511 1.8511 2.3871 2.3871 2.4207 2.4207 4.9413 4.9413 5.1324 5.1324 5.8133 5.8133 6.1974 6.1974 6.9443 6.9443 7.1832 7.1832 7.7218 7.7218 k = 0.0000 0.4906 0.3979 ( 8686 PWs) bands (ev): -3.1643 -3.1643 -3.1510 -3.1510 -3.1345 -3.1345 -3.1256 -3.1256 -3.1069 -3.1069 -3.1007 -3.1007 -3.0749 -3.0749 -3.0682 -3.0682 -3.0574 -3.0574 -3.0476 -3.0476 -3.0134 -3.0134 -3.0087 -3.0087 -1.4832 -1.4832 -1.4576 -1.4576 -1.4135 -1.4135 -1.4009 -1.4009 -1.3677 -1.3677 -1.3474 -1.3474 -1.3225 -1.3225 -1.3072 -1.3072 -1.2927 -1.2927 -1.2627 -1.2627 -1.1569 -1.1569 -1.1443 -1.1443 -1.1299 -1.1299 -1.1126 -1.1126 -1.0625 -1.0625 -1.0340 -1.0340 -1.0057 -1.0057 -0.9634 -0.9634 -0.3487 -0.3487 -0.2601 -0.2601 0.8732 0.8732 1.7600 1.7600 2.3871 2.3871 2.4165 2.4165 4.9838 4.9838 5.1268 5.1268 5.8428 5.8428 6.2294 6.2294 6.9985 6.9985 7.1366 7.1366 7.6217 7.6217 k = 0.0000 0.5012 0.3789 ( 8691 PWs) bands (ev): -3.1629 -3.1629 -3.1520 -3.1520 -3.1337 -3.1337 -3.1262 -3.1262 -3.1066 -3.1066 -3.1015 -3.1015 -3.0745 -3.0745 -3.0689 -3.0689 -3.0567 -3.0567 -3.0487 -3.0487 -3.0130 -3.0130 -3.0092 -3.0092 -1.4807 -1.4807 -1.4595 -1.4595 -1.4126 -1.4126 -1.4024 -1.4024 -1.3664 -1.3664 -1.3501 -1.3501 -1.3215 -1.3215 -1.3089 -1.3089 -1.2908 -1.2908 -1.2663 -1.2663 -1.1545 -1.1545 -1.1442 -1.1442 -1.1272 -1.1272 -1.1116 -1.1116 -1.0597 -1.0597 -1.0357 -1.0357 -1.0034 -1.0034 -0.9676 -0.9676 -0.3441 -0.3441 -0.2756 -0.2756 0.9514 0.9514 1.6676 1.6676 2.3878 2.3878 2.4122 2.4122 5.0198 5.0198 5.1218 5.1218 5.8805 5.8805 6.2470 6.2470 6.9951 6.9951 7.1735 7.1735 7.5229 7.5229 k = 0.0000 0.5117 0.3600 ( 8685 PWs) bands (ev): -3.1614 -3.1614 -3.1530 -3.1530 -3.1327 -3.1327 -3.1269 -3.1269 -3.1061 -3.1061 -3.1023 -3.1023 -3.0740 -3.0740 -3.0696 -3.0696 -3.0559 -3.0559 -3.0498 -3.0498 -3.0125 -3.0125 -3.0097 -3.0097 -1.4781 -1.4781 -1.4617 -1.4617 -1.4116 -1.4116 -1.4039 -1.4039 -1.3649 -1.3649 -1.3527 -1.3527 -1.3203 -1.3203 -1.3106 -1.3106 -1.2885 -1.2885 -1.2699 -1.2699 -1.1525 -1.1525 -1.1447 -1.1447 -1.1241 -1.1241 -1.1114 -1.1114 -1.0569 -1.0569 -1.0381 -1.0381 -1.0001 -1.0001 -0.9721 -0.9721 -0.3393 -0.3393 -0.2892 -0.2892 1.0336 1.0336 1.5746 1.5746 2.3892 2.3892 2.4080 2.4080 5.0487 5.0487 5.1171 5.1171 5.9273 5.9273 6.2430 6.2430 6.9834 6.9834 7.2393 7.2393 7.4413 7.4413 k = 0.0000 0.5223 0.3410 ( 8684 PWs) bands (ev): -3.1600 -3.1600 -3.1543 -3.1543 -3.1317 -3.1317 -3.1277 -3.1277 -3.1057 -3.1057 -3.1031 -3.1031 -3.0734 -3.0734 -3.0704 -3.0704 -3.0550 -3.0550 -3.0509 -3.0509 -3.0121 -3.0121 -3.0101 -3.0101 -1.4753 -1.4753 -1.4641 -1.4641 -1.4105 -1.4105 -1.4053 -1.4053 -1.3633 -1.3633 -1.3552 -1.3552 -1.3189 -1.3189 -1.3123 -1.3123 -1.2859 -1.2859 -1.2733 -1.2733 -1.1507 -1.1507 -1.1455 -1.1455 -1.1208 -1.1208 -1.1120 -1.1120 -1.0539 -1.0539 -1.0410 -1.0410 -0.9960 -0.9960 -0.9768 -0.9768 -0.3340 -0.3340 -0.3012 -0.3012 1.1191 1.1191 1.4815 1.4815 2.3912 2.3912 2.4040 2.4040 5.0706 5.0706 5.1122 5.1122 5.9826 5.9826 6.2148 6.2148 6.9981 6.9981 7.2450 7.2450 7.4359 7.4359 k = 0.0000 0.5329 0.3220 ( 8697 PWs) bands (ev): -3.1585 -3.1585 -3.1556 -3.1556 -3.1306 -3.1306 -3.1286 -3.1286 -3.1051 -3.1051 -3.1038 -3.1038 -3.0727 -3.0727 -3.0712 -3.0712 -3.0540 -3.0540 -3.0520 -3.0520 -3.0116 -3.0116 -3.0106 -3.0106 -1.4725 -1.4725 -1.4668 -1.4668 -1.4093 -1.4093 -1.4067 -1.4067 -1.3615 -1.3615 -1.3575 -1.3575 -1.3174 -1.3174 -1.3141 -1.3141 -1.2830 -1.2830 -1.2767 -1.2767 -1.1492 -1.1492 -1.1466 -1.1466 -1.1178 -1.1178 -1.1132 -1.1132 -1.0508 -1.0508 -1.0442 -1.0442 -0.9914 -0.9914 -0.9816 -0.9816 -0.3277 -0.3277 -0.3115 -0.3115 1.2072 1.2072 1.3889 1.3889 2.3937 2.3937 2.4002 2.4002 5.0867 5.0867 5.1062 5.1062 6.0439 6.0439 6.1668 6.1668 7.0407 7.0407 7.1788 7.1788 7.5151 7.5151 k = 0.0000 0.5435 0.3031 ( 8692 PWs) bands (ev): -3.1570 -3.1570 -3.1570 -3.1570 -3.1296 -3.1296 -3.1296 -3.1296 -3.1045 -3.1045 -3.1045 -3.1045 -3.0720 -3.0720 -3.0720 -3.0720 -3.0530 -3.0530 -3.0530 -3.0530 -3.0111 -3.0111 -3.0111 -3.0111 -1.4696 -1.4696 -1.4696 -1.4696 -1.4081 -1.4081 -1.4081 -1.4081 -1.3596 -1.3596 -1.3596 -1.3596 -1.3158 -1.3158 -1.3158 -1.3158 -1.2799 -1.2799 -1.2799 -1.2799 -1.1478 -1.1478 -1.1478 -1.1478 -1.1152 -1.1152 -1.1152 -1.1152 -1.0475 -1.0475 -1.0475 -1.0475 -0.9866 -0.9866 -0.9866 -0.9866 -0.3203 -0.3203 -0.3203 -0.3203 1.2973 1.2973 1.2973 1.2973 2.3967 2.3967 2.3967 2.3967 5.0981 5.0981 5.0981 5.0981 6.1072 6.1072 6.1072 6.1072 7.1041 7.1041 7.1041 7.1041 7.6171 7.6171 k = 0.0000 0.5435 0.3031 ( 8692 PWs) bands (ev): -3.1570 -3.1570 -3.1570 -3.1570 -3.1296 -3.1296 -3.1296 -3.1296 -3.1045 -3.1045 -3.1045 -3.1045 -3.0720 -3.0720 -3.0720 -3.0720 -3.0530 -3.0530 -3.0530 -3.0530 -3.0111 -3.0111 -3.0111 -3.0111 -1.4696 -1.4696 -1.4696 -1.4696 -1.4081 -1.4081 -1.4081 -1.4081 -1.3596 -1.3596 -1.3596 -1.3596 -1.3158 -1.3158 -1.3158 -1.3158 -1.2799 -1.2799 -1.2799 -1.2799 -1.1478 -1.1478 -1.1478 -1.1478 -1.1152 -1.1152 -1.1152 -1.1152 -1.0475 -1.0475 -1.0475 -1.0475 -0.9866 -0.9866 -0.9866 -0.9866 -0.3203 -0.3203 -0.3203 -0.3203 1.2973 1.2973 1.2973 1.2973 2.3967 2.3967 2.3967 2.3967 5.0981 5.0981 5.0981 5.0981 6.1072 6.1072 6.1072 6.1072 7.1041 7.1041 7.1041 7.1041 7.6171 7.6171 k = 0.0217 0.5435 0.3031 ( 8690 PWs) bands (ev): -3.1577 -3.1577 -3.1563 -3.1563 -3.1303 -3.1303 -3.1290 -3.1290 -3.1045 -3.1045 -3.1044 -3.1044 -3.0723 -3.0723 -3.0716 -3.0716 -3.0532 -3.0532 -3.0528 -3.0528 -3.0114 -3.0114 -3.0109 -3.0109 -1.4711 -1.4711 -1.4683 -1.4683 -1.4081 -1.4081 -1.4074 -1.4074 -1.3600 -1.3600 -1.3593 -1.3593 -1.3175 -1.3175 -1.3138 -1.3138 -1.2798 -1.2798 -1.2796 -1.2796 -1.1485 -1.1485 -1.1476 -1.1476 -1.1154 -1.1154 -1.1153 -1.1153 -1.0482 -1.0482 -1.0473 -1.0473 -0.9885 -0.9885 -0.9842 -0.9842 -0.3197 -0.3197 -0.3184 -0.3184 1.2941 1.2941 1.2972 1.2972 2.3914 2.3914 2.3950 2.3950 5.1041 5.1041 5.1078 5.1078 6.0847 6.0847 6.1059 6.1059 7.1038 7.1038 7.1298 7.1298 7.6188 7.6211 k = 0.0435 0.5435 0.3031 ( 8690 PWs) bands (ev): -3.1582 -3.1582 -3.1556 -3.1556 -3.1310 -3.1310 -3.1286 -3.1286 -3.1043 -3.1043 -3.1042 -3.1042 -3.0727 -3.0727 -3.0711 -3.0711 -3.0534 -3.0534 -3.0526 -3.0526 -3.0117 -3.0117 -3.0106 -3.0106 -1.4729 -1.4729 -1.4673 -1.4673 -1.4076 -1.4076 -1.4063 -1.4063 -1.3605 -1.3605 -1.3591 -1.3591 -1.3188 -1.3188 -1.3117 -1.3117 -1.2791 -1.2791 -1.2790 -1.2790 -1.1496 -1.1496 -1.1479 -1.1479 -1.1160 -1.1160 -1.1156 -1.1156 -1.0491 -1.0491 -1.0475 -1.0475 -0.9901 -0.9901 -0.9814 -0.9814 -0.3166 -0.3166 -0.3139 -0.3139 1.2877 1.2877 1.2938 1.2938 2.3794 2.3794 2.3865 2.3865 5.1257 5.1257 5.1330 5.1330 6.0415 6.0415 6.0813 6.0813 7.1283 7.1283 7.1767 7.1767 7.6267 7.6267 k = 0.0652 0.5435 0.3031 ( 8698 PWs) bands (ev): -3.1587 -3.1587 -3.1548 -3.1548 -3.1319 -3.1319 -3.1283 -3.1283 -3.1041 -3.1041 -3.1040 -3.1040 -3.0730 -3.0730 -3.0707 -3.0707 -3.0536 -3.0536 -3.0523 -3.0523 -3.0120 -3.0120 -3.0104 -3.0104 -1.4748 -1.4748 -1.4664 -1.4664 -1.4065 -1.4065 -1.4047 -1.4047 -1.3610 -1.3610 -1.3591 -1.3591 -1.3196 -1.3196 -1.3095 -1.3095 -1.2780 -1.2780 -1.2779 -1.2779 -1.1511 -1.1511 -1.1486 -1.1486 -1.1170 -1.1170 -1.1160 -1.1160 -1.0501 -1.0501 -1.0481 -1.0481 -0.9915 -0.9915 -0.9781 -0.9781 -0.3110 -0.3110 -0.3070 -0.3070 1.2780 1.2780 1.2868 1.2868 2.3614 2.3614 2.3719 2.3719 5.1622 5.1622 5.1725 5.1725 5.9831 5.9831 6.0378 6.0378 7.1728 7.1728 7.2381 7.2381 7.6427 7.6427 k = 0.0870 0.5435 0.3031 ( 8692 PWs) bands (ev): -3.1591 -3.1591 -3.1540 -3.1540 -3.1328 -3.1328 -3.1281 -3.1281 -3.1038 -3.1038 -3.1037 -3.1037 -3.0733 -3.0733 -3.0702 -3.0702 -3.0537 -3.0537 -3.0521 -3.0521 -3.0123 -3.0123 -3.0102 -3.0102 -1.4768 -1.4768 -1.4657 -1.4657 -1.4050 -1.4050 -1.4027 -1.4027 -1.3614 -1.3614 -1.3594 -1.3594 -1.3199 -1.3199 -1.3072 -1.3072 -1.2769 -1.2769 -1.2760 -1.2760 -1.1530 -1.1530 -1.1496 -1.1496 -1.1184 -1.1184 -1.1166 -1.1166 -1.0512 -1.0512 -1.0492 -1.0492 -0.9927 -0.9927 -0.9745 -0.9745 -0.3029 -0.3029 -0.2975 -0.2975 1.2646 1.2646 1.2761 1.2761 2.3386 2.3386 2.3523 2.3523 5.2125 5.2125 5.2248 5.2248 5.9146 5.9146 5.9816 5.9816 7.2301 7.2301 7.3053 7.3053 7.6697 7.6697 k = 0.1087 0.5435 0.3031 ( 8688 PWs) bands (ev): -3.1595 -3.1595 -3.1532 -3.1532 -3.1336 -3.1336 -3.1280 -3.1280 -3.1034 -3.1034 -3.1033 -3.1033 -3.0736 -3.0736 -3.0696 -3.0696 -3.0538 -3.0538 -3.0519 -3.0519 -3.0126 -3.0126 -3.0100 -3.0100 -1.4788 -1.4788 -1.4650 -1.4650 -1.4033 -1.4033 -1.4007 -1.4007 -1.3617 -1.3617 -1.3601 -1.3601 -1.3195 -1.3195 -1.3048 -1.3048 -1.2756 -1.2756 -1.2735 -1.2735 -1.1552 -1.1552 -1.1511 -1.1511 -1.1203 -1.1203 -1.1172 -1.1172 -1.0523 -1.0523 -1.0508 -1.0508 -0.9938 -0.9938 -0.9706 -0.9706 -0.2922 -0.2922 -0.2855 -0.2855 1.2473 1.2473 1.2612 1.2612 2.3125 2.3125 2.3292 2.3292 5.2750 5.2750 5.2874 5.2874 5.8406 5.8406 5.9191 5.9191 7.2929 7.2929 7.3698 7.3698 7.7061 7.7061 k = 0.1304 0.5435 0.3031 ( 8692 PWs) bands (ev): -3.1597 -3.1597 -3.1525 -3.1525 -3.1344 -3.1344 -3.1280 -3.1280 -3.1031 -3.1031 -3.1028 -3.1028 -3.0739 -3.0739 -3.0691 -3.0691 -3.0538 -3.0538 -3.0517 -3.0517 -3.0130 -3.0130 -3.0099 -3.0099 -1.4807 -1.4807 -1.4643 -1.4643 -1.4013 -1.4013 -1.3986 -1.3986 -1.3620 -1.3620 -1.3611 -1.3611 -1.3186 -1.3186 -1.3022 -1.3022 -1.2743 -1.2743 -1.2705 -1.2705 -1.1576 -1.1576 -1.1529 -1.1529 -1.1226 -1.1226 -1.1179 -1.1179 -1.0532 -1.0532 -1.0526 -1.0526 -0.9949 -0.9949 -0.9665 -0.9665 -0.2790 -0.2790 -0.2710 -0.2710 1.2258 1.2258 1.2417 1.2417 2.2845 2.2845 2.3039 2.3039 5.3472 5.3472 5.3558 5.3558 5.7651 5.7651 5.8573 5.8573 7.3543 7.3543 7.4242 7.4242 7.7530 7.7530 k = 0.1522 0.5435 0.3031 ( 8690 PWs) bands (ev): -3.1598 -3.1598 -3.1519 -3.1519 -3.1350 -3.1350 -3.1280 -3.1280 -3.1027 -3.1027 -3.1022 -3.1022 -3.0742 -3.0742 -3.0685 -3.0685 -3.0538 -3.0538 -3.0515 -3.0515 -3.0133 -3.0133 -3.0097 -3.0097 -1.4824 -1.4824 -1.4634 -1.4634 -1.3991 -1.3991 -1.3969 -1.3969 -1.3625 -1.3625 -1.3620 -1.3620 -1.3172 -1.3172 -1.2995 -1.2995 -1.2729 -1.2729 -1.2670 -1.2670 -1.1601 -1.1601 -1.1550 -1.1550 -1.1253 -1.1253 -1.1186 -1.1186 -1.0547 -1.0547 -1.0540 -1.0540 -0.9961 -0.9961 -0.9622 -0.9622 -0.2632 -0.2632 -0.2539 -0.2539 1.1999 1.1999 1.2174 1.2174 2.2563 2.2563 2.2779 2.2779 5.4212 5.4212 5.4242 5.4242 5.6938 5.6938 5.8064 5.8064 7.4096 7.4096 7.4658 7.4658 7.8139 7.8139 k = 0.1739 0.5435 0.3031 ( 8682 PWs) bands (ev): -3.1599 -3.1599 -3.1515 -3.1515 -3.1355 -3.1355 -3.1280 -3.1280 -3.1025 -3.1025 -3.1016 -3.1016 -3.0745 -3.0745 -3.0679 -3.0679 -3.0538 -3.0538 -3.0513 -3.0513 -3.0136 -3.0136 -3.0096 -3.0096 -1.4839 -1.4839 -1.4625 -1.4625 -1.3970 -1.3970 -1.3956 -1.3956 -1.3640 -1.3640 -1.3619 -1.3619 -1.3156 -1.3156 -1.2963 -1.2963 -1.2716 -1.2716 -1.2630 -1.2630 -1.1626 -1.1626 -1.1573 -1.1573 -1.1282 -1.1282 -1.1193 -1.1193 -1.0569 -1.0569 -1.0548 -1.0548 -0.9974 -0.9974 -0.9580 -0.9580 -0.2448 -0.2448 -0.2344 -0.2344 1.1693 1.1693 1.1878 1.1878 2.2291 2.2291 2.2526 2.2526 5.4645 5.4645 5.4863 5.4863 5.6464 5.6464 5.7862 5.7862 7.4567 7.4567 7.4966 7.4966 7.8886 7.8886 k = 0.1957 0.5435 0.3031 ( 8682 PWs) bands (ev): -3.1599 -3.1599 -3.1513 -3.1513 -3.1358 -3.1358 -3.1281 -3.1281 -3.1022 -3.1022 -3.1010 -3.1010 -3.0748 -3.0748 -3.0673 -3.0673 -3.0537 -3.0537 -3.0511 -3.0511 -3.0140 -3.0140 -3.0095 -3.0095 -1.4851 -1.4851 -1.4613 -1.4613 -1.3949 -1.3949 -1.3948 -1.3948 -1.3657 -1.3657 -1.3614 -1.3614 -1.3138 -1.3138 -1.2928 -1.2928 -1.2703 -1.2703 -1.2588 -1.2588 -1.1649 -1.1649 -1.1598 -1.1598 -1.1314 -1.1314 -1.1200 -1.1200 -1.0593 -1.0593 -1.0554 -1.0554 -0.9988 -0.9988 -0.9537 -0.9537 -0.2237 -0.2237 -0.2123 -0.2123 1.1341 1.1341 1.1530 1.1530 2.2041 2.2041 2.2289 2.2289 5.4635 5.4635 5.4761 5.4761 5.6801 5.6801 5.8189 5.8189 7.4960 7.4960 7.5200 7.5200 7.9745 7.9745 k = 0.2174 0.5435 0.3031 ( 8684 PWs) bands (ev): -3.1599 -3.1599 -3.1512 -3.1512 -3.1358 -3.1358 -3.1280 -3.1280 -3.1020 -3.1020 -3.1005 -3.1005 -3.0751 -3.0751 -3.0667 -3.0667 -3.0536 -3.0536 -3.0510 -3.0510 -3.0143 -3.0143 -3.0095 -3.0095 -1.4860 -1.4860 -1.4598 -1.4598 -1.3950 -1.3950 -1.3927 -1.3927 -1.3674 -1.3674 -1.3607 -1.3607 -1.3120 -1.3120 -1.2889 -1.2889 -1.2692 -1.2692 -1.2543 -1.2543 -1.1669 -1.1669 -1.1625 -1.1625 -1.1348 -1.1348 -1.1207 -1.1207 -1.0618 -1.0618 -1.0561 -1.0561 -1.0003 -1.0003 -0.9495 -0.9495 -0.2001 -0.2001 -0.1876 -0.1876 1.0941 1.0941 1.1129 1.1129 2.1821 2.1821 2.2076 2.2076 5.4168 5.4168 5.4253 5.4253 5.7713 5.7713 5.8973 5.8973 7.5292 7.5292 7.5383 7.5383 8.0679 8.0679 k = 0.2391 0.5435 0.3031 ( 8682 PWs) bands (ev): -3.1598 -3.1598 -3.1514 -3.1514 -3.1356 -3.1356 -3.1279 -3.1279 -3.1018 -3.1018 -3.1000 -3.1000 -3.0755 -3.0755 -3.0661 -3.0661 -3.0536 -3.0536 -3.0509 -3.0509 -3.0147 -3.0147 -3.0094 -3.0094 -1.4865 -1.4865 -1.4582 -1.4582 -1.3958 -1.3958 -1.3908 -1.3908 -1.3692 -1.3692 -1.3597 -1.3597 -1.3104 -1.3104 -1.2847 -1.2847 -1.2683 -1.2683 -1.2496 -1.2496 -1.1685 -1.1685 -1.1652 -1.1652 -1.1382 -1.1382 -1.1214 -1.1214 -1.0643 -1.0643 -1.0569 -1.0569 -1.0019 -1.0019 -0.9455 -0.9455 -0.1737 -0.1737 -0.1604 -0.1604 1.0498 1.0498 1.0679 1.0679 2.1635 2.1635 2.1892 2.1892 5.3496 5.3496 5.3708 5.3708 5.8782 5.8782 5.9998 5.9998 7.5531 7.5531 7.5582 7.5582 8.1654 8.1654 k = 0.2609 0.5435 0.3031 ( 8666 PWs) bands (ev): -3.1598 -3.1598 -3.1518 -3.1518 -3.1351 -3.1351 -3.1277 -3.1277 -3.1017 -3.1017 -3.0995 -3.0995 -3.0758 -3.0758 -3.0654 -3.0654 -3.0535 -3.0535 -3.0508 -3.0508 -3.0150 -3.0150 -3.0094 -3.0094 -1.4867 -1.4867 -1.4563 -1.4563 -1.3973 -1.3973 -1.3891 -1.3891 -1.3708 -1.3708 -1.3585 -1.3585 -1.3090 -1.3090 -1.2800 -1.2800 -1.2676 -1.2676 -1.2449 -1.2449 -1.1696 -1.1696 -1.1678 -1.1678 -1.1417 -1.1417 -1.1221 -1.1221 -1.0668 -1.0668 -1.0578 -1.0578 -1.0034 -1.0034 -0.9417 -0.9417 -0.1447 -0.1447 -0.1307 -0.1307 1.0014 1.0014 1.0183 1.0183 2.1484 2.1484 2.1739 2.1739 5.2829 5.2829 5.3117 5.3117 5.9915 5.9915 6.1143 6.1143 7.5647 7.5647 7.5842 7.5842 8.2638 8.2638 k = 0.2826 0.5435 0.3031 ( 8674 PWs) bands (ev): -3.1597 -3.1597 -3.1523 -3.1523 -3.1345 -3.1345 -3.1273 -3.1273 -3.1017 -3.1017 -3.0993 -3.0993 -3.0761 -3.0761 -3.0647 -3.0647 -3.0534 -3.0534 -3.0508 -3.0508 -3.0154 -3.0154 -3.0094 -3.0094 -1.4865 -1.4865 -1.4542 -1.4542 -1.3993 -1.3993 -1.3878 -1.3878 -1.3722 -1.3722 -1.3572 -1.3572 -1.3078 -1.3078 -1.2752 -1.2752 -1.2672 -1.2672 -1.2402 -1.2402 -1.1703 -1.1703 -1.1702 -1.1702 -1.1452 -1.1452 -1.1228 -1.1228 -1.0692 -1.0692 -1.0589 -1.0589 -1.0049 -1.0049 -0.9381 -0.9381 -0.1130 -0.1130 -0.0985 -0.0985 0.9496 0.9496 0.9649 0.9649 2.1368 2.1368 2.1617 2.1617 5.2193 5.2193 5.2528 5.2528 6.1082 6.1082 6.2352 6.2352 7.5732 7.5732 7.6079 7.6079 8.3604 8.3604 k = 0.3043 0.5435 0.3031 ( 8666 PWs) bands (ev): -3.1596 -3.1596 -3.1528 -3.1528 -3.1337 -3.1337 -3.1269 -3.1269 -3.1018 -3.1018 -3.0991 -3.0991 -3.0763 -3.0763 -3.0639 -3.0639 -3.0534 -3.0534 -3.0508 -3.0508 -3.0157 -3.0157 -3.0094 -3.0094 -1.4859 -1.4859 -1.4519 -1.4519 -1.4017 -1.4017 -1.3870 -1.3870 -1.3733 -1.3733 -1.3560 -1.3560 -1.3069 -1.3069 -1.2701 -1.2701 -1.2671 -1.2671 -1.2357 -1.2357 -1.1725 -1.1725 -1.1704 -1.1704 -1.1488 -1.1488 -1.1234 -1.1234 -1.0716 -1.0716 -1.0602 -1.0602 -1.0062 -1.0062 -0.9347 -0.9347 -0.0786 -0.0786 -0.0638 -0.0638 0.8949 0.8949 0.9083 0.9083 2.1283 2.1283 2.1523 2.1523 5.1599 5.1599 5.1965 5.1965 6.2263 6.2263 6.3593 6.3593 7.5783 7.5783 7.6296 7.6296 8.4521 8.4521 k = 0.3261 0.5435 0.3031 ( 8672 PWs) bands (ev): -3.1595 -3.1595 -3.1534 -3.1534 -3.1329 -3.1329 -3.1263 -3.1263 -3.1019 -3.1019 -3.0991 -3.0991 -3.0765 -3.0765 -3.0631 -3.0631 -3.0534 -3.0534 -3.0508 -3.0508 -3.0159 -3.0159 -3.0095 -3.0095 -1.4851 -1.4851 -1.4494 -1.4494 -1.4045 -1.4045 -1.3868 -1.3868 -1.3740 -1.3740 -1.3548 -1.3548 -1.3063 -1.3063 -1.2671 -1.2671 -1.2649 -1.2649 -1.2314 -1.2314 -1.1743 -1.1743 -1.1701 -1.1701 -1.1522 -1.1522 -1.1238 -1.1238 -1.0739 -1.0739 -1.0618 -1.0618 -1.0075 -1.0075 -0.9317 -0.9317 -0.0415 -0.0415 -0.0266 -0.0266 0.8379 0.8379 0.8492 0.8492 2.1224 2.1224 2.1455 2.1455 5.1052 5.1052 5.1440 5.1440 6.3442 6.3442 6.4841 6.4841 7.5794 7.5794 7.6495 7.6495 8.5353 8.5353 k = 0.3478 0.5435 0.3031 ( 8662 PWs) bands (ev): -3.1595 -3.1595 -3.1540 -3.1540 -3.1321 -3.1321 -3.1256 -3.1256 -3.1020 -3.1020 -3.0993 -3.0993 -3.0766 -3.0766 -3.0623 -3.0623 -3.0535 -3.0535 -3.0508 -3.0508 -3.0162 -3.0162 -3.0095 -3.0095 -1.4840 -1.4840 -1.4469 -1.4469 -1.4075 -1.4075 -1.3872 -1.3872 -1.3743 -1.3743 -1.3537 -1.3537 -1.3058 -1.3058 -1.2674 -1.2674 -1.2598 -1.2598 -1.2276 -1.2276 -1.1757 -1.1757 -1.1695 -1.1695 -1.1556 -1.1556 -1.1242 -1.1242 -1.0761 -1.0761 -1.0636 -1.0636 -1.0086 -1.0086 -0.9289 -0.9289 -0.0019 -0.0019 0.0130 0.0130 0.7794 0.7794 0.7885 0.7885 2.1187 2.1187 2.1408 2.1408 5.0558 5.0558 5.0962 5.0962 6.4604 6.4604 6.6074 6.6074 7.5761 7.5761 7.6674 7.6674 8.6048 8.6048 k = 0.3696 0.5435 0.3031 ( 8670 PWs) bands (ev): -3.1594 -3.1594 -3.1546 -3.1546 -3.1313 -3.1313 -3.1248 -3.1248 -3.1022 -3.1022 -3.0996 -3.0996 -3.0767 -3.0767 -3.0615 -3.0615 -3.0537 -3.0537 -3.0509 -3.0509 -3.0164 -3.0164 -3.0096 -3.0096 -1.4827 -1.4827 -1.4443 -1.4443 -1.4105 -1.4105 -1.3881 -1.3881 -1.3742 -1.3742 -1.3528 -1.3528 -1.3054 -1.3054 -1.2677 -1.2677 -1.2548 -1.2548 -1.2243 -1.2243 -1.1765 -1.1765 -1.1688 -1.1688 -1.1588 -1.1588 -1.1244 -1.1244 -1.0782 -1.0782 -1.0655 -1.0655 -1.0095 -1.0095 -0.9265 -0.9265 0.0403 0.0403 0.0550 0.0550 0.7199 0.7199 0.7267 0.7267 2.1167 2.1167 2.1377 2.1377 5.0122 5.0122 5.0538 5.0538 6.5731 6.5731 6.7268 6.7268 7.5675 7.5675 7.6829 7.6829 8.6535 8.6535 k = 0.3913 0.5435 0.3031 ( 8676 PWs) bands (ev): -3.1594 -3.1594 -3.1551 -3.1551 -3.1305 -3.1305 -3.1240 -3.1240 -3.1024 -3.1024 -3.1001 -3.1001 -3.0767 -3.0767 -3.0606 -3.0606 -3.0540 -3.0540 -3.0510 -3.0510 -3.0166 -3.0166 -3.0096 -3.0096 -1.4813 -1.4813 -1.4418 -1.4418 -1.4134 -1.4134 -1.3893 -1.3893 -1.3740 -1.3740 -1.3520 -1.3520 -1.3052 -1.3052 -1.2682 -1.2682 -1.2500 -1.2500 -1.2218 -1.2218 -1.1769 -1.1769 -1.1679 -1.1679 -1.1618 -1.1618 -1.1245 -1.1245 -1.0801 -1.0801 -1.0675 -1.0675 -1.0102 -1.0102 -0.9244 -0.9244 0.0849 0.0849 0.0991 0.0991 0.6600 0.6600 0.6647 0.6647 2.1159 2.1159 2.1360 2.1360 4.9747 4.9747 5.0171 5.0171 6.6804 6.6804 6.8395 6.8395 7.5535 7.5535 7.6958 7.6958 8.6747 8.6747 k = 0.4130 0.5435 0.3031 ( 8674 PWs) bands (ev): -3.1594 -3.1594 -3.1555 -3.1555 -3.1299 -3.1299 -3.1232 -3.1232 -3.1026 -3.1026 -3.1006 -3.1006 -3.0766 -3.0766 -3.0598 -3.0598 -3.0543 -3.0543 -3.0511 -3.0511 -3.0168 -3.0168 -3.0096 -3.0096 -1.4798 -1.4798 -1.4394 -1.4394 -1.4161 -1.4161 -1.3907 -1.3907 -1.3738 -1.3738 -1.3514 -1.3514 -1.3050 -1.3050 -1.2686 -1.2686 -1.2457 -1.2457 -1.2200 -1.2200 -1.1768 -1.1768 -1.1671 -1.1671 -1.1645 -1.1645 -1.1245 -1.1245 -1.0817 -1.0817 -1.0695 -1.0695 -1.0107 -1.0107 -0.9227 -0.9227 0.1315 0.1315 0.1452 0.1452 0.6004 0.6004 0.6030 0.6030 2.1158 2.1158 2.1351 2.1351 4.9435 4.9435 4.9866 4.9866 6.7798 6.7798 6.9422 6.9422 7.5341 7.5341 7.7058 7.7058 8.6692 8.6692 k = 0.4348 0.5435 0.3031 ( 8662 PWs) bands (ev): -3.1594 -3.1594 -3.1558 -3.1558 -3.1293 -3.1293 -3.1224 -3.1224 -3.1028 -3.1028 -3.1011 -3.1011 -3.0766 -3.0766 -3.0589 -3.0589 -3.0548 -3.0548 -3.0511 -3.0511 -3.0169 -3.0169 -3.0097 -3.0097 -1.4785 -1.4785 -1.4373 -1.4373 -1.4185 -1.4185 -1.3920 -1.3920 -1.3737 -1.3737 -1.3509 -1.3509 -1.3049 -1.3049 -1.2691 -1.2691 -1.2419 -1.2419 -1.2189 -1.2189 -1.1765 -1.1765 -1.1666 -1.1666 -1.1664 -1.1664 -1.1244 -1.1244 -1.0831 -1.0831 -1.0712 -1.0712 -1.0111 -1.0111 -0.9214 -0.9214 0.1799 0.1799 0.1930 0.1930 0.5418 0.5418 0.5427 0.5427 2.1162 2.1162 2.1348 2.1348 4.9190 4.9190 4.9626 4.9626 6.8679 6.8679 7.0306 7.0306 7.5107 7.5107 7.7126 7.7126 8.6477 8.6477 k = 0.4565 0.5435 0.3031 ( 8658 PWs) bands (ev): -3.1594 -3.1594 -3.1561 -3.1561 -3.1289 -3.1289 -3.1218 -3.1218 -3.1030 -3.1030 -3.1015 -3.1015 -3.0765 -3.0765 -3.0581 -3.0581 -3.0553 -3.0553 -3.0512 -3.0512 -3.0170 -3.0170 -3.0097 -3.0097 -1.4774 -1.4774 -1.4356 -1.4356 -1.4204 -1.4204 -1.3931 -1.3931 -1.3735 -1.3735 -1.3506 -1.3506 -1.3048 -1.3048 -1.2694 -1.2694 -1.2388 -1.2388 -1.2184 -1.2184 -1.1761 -1.1761 -1.1682 -1.1682 -1.1658 -1.1658 -1.1243 -1.1243 -1.0841 -1.0841 -1.0726 -1.0726 -1.0114 -1.0114 -0.9204 -0.9204 0.2286 0.2286 0.2413 0.2413 0.4852 0.4852 0.4856 0.4856 2.1167 2.1167 2.1347 2.1347 4.9014 4.9014 4.9453 4.9453 6.9399 6.9399 7.0998 7.0998 7.4862 7.4862 7.7165 7.7165 8.6226 8.6226 k = 0.4783 0.5435 0.3031 ( 8670 PWs) bands (ev): -3.1594 -3.1594 -3.1562 -3.1562 -3.1287 -3.1287 -3.1214 -3.1214 -3.1031 -3.1031 -3.1019 -3.1019 -3.0765 -3.0765 -3.0573 -3.0573 -3.0559 -3.0559 -3.0512 -3.0512 -3.0171 -3.0171 -3.0097 -3.0097 -1.4767 -1.4767 -1.4345 -1.4345 -1.4215 -1.4215 -1.3938 -1.3938 -1.3735 -1.3735 -1.3504 -1.3504 -1.3047 -1.3047 -1.2696 -1.2696 -1.2368 -1.2368 -1.2183 -1.2183 -1.1758 -1.1758 -1.1691 -1.1691 -1.1655 -1.1655 -1.1242 -1.1242 -1.0847 -1.0847 -1.0735 -1.0735 -1.0115 -1.0115 -0.9198 -0.9198 0.2738 0.2738 0.2868 0.2868 0.4346 0.4346 0.4353 0.4353 2.1171 2.1171 2.1348 2.1348 4.8907 4.8907 4.9348 4.9348 6.9888 6.9888 7.1444 7.1444 7.4665 7.4665 7.7181 7.7181 8.6037 8.6037 k = 0.5000 0.5435 0.3031 ( 8676 PWs) bands (ev): -3.1594 -3.1594 -3.1563 -3.1563 -3.1286 -3.1286 -3.1213 -3.1213 -3.1031 -3.1031 -3.1020 -3.1020 -3.0765 -3.0765 -3.0567 -3.0567 -3.0564 -3.0564 -3.0512 -3.0512 -3.0171 -3.0171 -3.0097 -3.0097 -1.4764 -1.4764 -1.4342 -1.4342 -1.4219 -1.4219 -1.3941 -1.3941 -1.3735 -1.3735 -1.3503 -1.3503 -1.3047 -1.3047 -1.2697 -1.2697 -1.2361 -1.2361 -1.2183 -1.2183 -1.1758 -1.1758 -1.1694 -1.1694 -1.1654 -1.1654 -1.1241 -1.1241 -1.0850 -1.0850 -1.0738 -1.0738 -1.0116 -1.0116 -0.9196 -0.9196 0.2975 0.2975 0.3116 0.3116 0.4088 0.4088 0.4091 0.4091 2.1172 2.1172 2.1348 2.1348 4.8872 4.8872 4.9314 4.9314 7.0065 7.0065 7.1599 7.1599 7.4587 7.4587 7.7185 7.7185 8.5967 8.5967 k = 0.5000 0.5435 0.3031 ( 8676 PWs) bands (ev): -3.1594 -3.1594 -3.1563 -3.1563 -3.1286 -3.1286 -3.1213 -3.1213 -3.1031 -3.1031 -3.1020 -3.1020 -3.0765 -3.0765 -3.0567 -3.0567 -3.0564 -3.0564 -3.0512 -3.0512 -3.0171 -3.0171 -3.0097 -3.0097 -1.4764 -1.4764 -1.4342 -1.4342 -1.4219 -1.4219 -1.3941 -1.3941 -1.3735 -1.3735 -1.3503 -1.3503 -1.3047 -1.3047 -1.2697 -1.2697 -1.2361 -1.2361 -1.2183 -1.2183 -1.1758 -1.1758 -1.1694 -1.1694 -1.1654 -1.1654 -1.1241 -1.1241 -1.0850 -1.0850 -1.0738 -1.0738 -1.0116 -1.0116 -0.9196 -0.9196 0.2975 0.2975 0.3116 0.3116 0.4088 0.4088 0.4091 0.4091 2.1172 2.1172 2.1348 2.1348 4.8872 4.8872 4.9314 4.9314 7.0065 7.0065 7.1599 7.1599 7.4587 7.4587 7.7185 7.7185 8.5967 8.5967 k = 0.5000 0.5540 0.2841 ( 8670 PWs) bands (ev): -3.1593 -3.1593 -3.1562 -3.1562 -3.1286 -3.1286 -3.1213 -3.1213 -3.1031 -3.1031 -3.1019 -3.1019 -3.0766 -3.0766 -3.0566 -3.0566 -3.0566 -3.0566 -3.0512 -3.0512 -3.0171 -3.0171 -3.0097 -3.0097 -1.4765 -1.4765 -1.4350 -1.4350 -1.4211 -1.4211 -1.3940 -1.3940 -1.3733 -1.3733 -1.3503 -1.3503 -1.3046 -1.3046 -1.2704 -1.2704 -1.2363 -1.2363 -1.2181 -1.2181 -1.1760 -1.1760 -1.1727 -1.1727 -1.1620 -1.1620 -1.1237 -1.1237 -1.0850 -1.0850 -1.0736 -1.0736 -1.0116 -1.0116 -0.9198 -0.9198 0.2964 0.2964 0.3103 0.3103 0.4109 0.4109 0.4115 0.4115 2.1145 2.1145 2.1320 2.1320 4.8943 4.8943 4.9384 4.9384 7.0009 7.0009 7.1481 7.1481 7.4662 7.4662 7.7193 7.7193 8.5932 8.5932 k = 0.5000 0.5646 0.2651 ( 8682 PWs) bands (ev): -3.1591 -3.1591 -3.1559 -3.1559 -3.1288 -3.1288 -3.1215 -3.1215 -3.1030 -3.1030 -3.1019 -3.1019 -3.0769 -3.0769 -3.0570 -3.0570 -3.0564 -3.0564 -3.0510 -3.0510 -3.0171 -3.0171 -3.0097 -3.0097 -1.4767 -1.4767 -1.4369 -1.4369 -1.4191 -1.4191 -1.3938 -1.3938 -1.3730 -1.3730 -1.3501 -1.3501 -1.3046 -1.3046 -1.2723 -1.2723 -1.2367 -1.2367 -1.2176 -1.2176 -1.1773 -1.1773 -1.1766 -1.1766 -1.1573 -1.1573 -1.1226 -1.1226 -1.0849 -1.0849 -1.0732 -1.0732 -1.0117 -1.0117 -0.9204 -0.9204 0.2930 0.2930 0.3064 0.3064 0.4171 0.4171 0.4183 0.4183 2.1064 2.1064 2.1238 2.1238 4.9153 4.9153 4.9593 4.9593 6.9846 6.9846 7.1162 7.1162 7.4854 7.4854 7.7213 7.7213 8.5826 8.5826 k = 0.5000 0.5752 0.2462 ( 8670 PWs) bands (ev): -3.1586 -3.1586 -3.1554 -3.1554 -3.1290 -3.1290 -3.1217 -3.1217 -3.1029 -3.1029 -3.1018 -3.1018 -3.0774 -3.0774 -3.0576 -3.0576 -3.0562 -3.0562 -3.0507 -3.0507 -3.0171 -3.0171 -3.0098 -3.0098 -1.4769 -1.4769 -1.4394 -1.4394 -1.4166 -1.4166 -1.3935 -1.3935 -1.3724 -1.3724 -1.3499 -1.3499 -1.3046 -1.3046 -1.2753 -1.2753 -1.2375 -1.2375 -1.2171 -1.2171 -1.1818 -1.1818 -1.1775 -1.1775 -1.1526 -1.1526 -1.1209 -1.1209 -1.0849 -1.0849 -1.0725 -1.0725 -1.0118 -1.0118 -0.9214 -0.9214 0.2877 0.2877 0.3006 0.3006 0.4270 0.4270 0.4289 0.4289 2.0934 2.0934 2.1105 2.1105 4.9498 4.9498 4.9937 4.9937 6.9585 6.9585 7.0707 7.0707 7.5094 7.5094 7.7232 7.7232 8.5643 8.5643 k = 0.5000 0.5858 0.2272 ( 8660 PWs) bands (ev): -3.1581 -3.1581 -3.1548 -3.1548 -3.1294 -3.1294 -3.1220 -3.1220 -3.1028 -3.1028 -3.1017 -3.1017 -3.0781 -3.0781 -3.0583 -3.0583 -3.0558 -3.0558 -3.0504 -3.0504 -3.0170 -3.0170 -3.0098 -3.0098 -1.4773 -1.4773 -1.4421 -1.4421 -1.4138 -1.4138 -1.3931 -1.3931 -1.3716 -1.3716 -1.3497 -1.3497 -1.3045 -1.3045 -1.2791 -1.2791 -1.2386 -1.2386 -1.2168 -1.2168 -1.1861 -1.1861 -1.1782 -1.1782 -1.1480 -1.1480 -1.1188 -1.1188 -1.0848 -1.0848 -1.0715 -1.0715 -1.0120 -1.0120 -0.9228 -0.9228 0.2808 0.2808 0.2933 0.2933 0.4400 0.4400 0.4429 0.4429 2.0763 2.0763 2.0931 2.0931 4.9971 4.9971 5.0408 5.0408 6.9240 6.9240 7.0167 7.0167 7.5326 7.5326 7.7232 7.7232 8.5382 8.5382 k = 0.5000 0.5963 0.2083 ( 8664 PWs) bands (ev): -3.1573 -3.1573 -3.1539 -3.1539 -3.1298 -3.1298 -3.1225 -3.1225 -3.1027 -3.1027 -3.1015 -3.1015 -3.0789 -3.0789 -3.0591 -3.0591 -3.0554 -3.0554 -3.0502 -3.0502 -3.0170 -3.0170 -3.0098 -3.0098 -1.4777 -1.4777 -1.4448 -1.4448 -1.4109 -1.4109 -1.3925 -1.3925 -1.3706 -1.3706 -1.3494 -1.3494 -1.3044 -1.3044 -1.2834 -1.2834 -1.2400 -1.2400 -1.2170 -1.2170 -1.1900 -1.1900 -1.1787 -1.1787 -1.1437 -1.1437 -1.1166 -1.1166 -1.0846 -1.0846 -1.0703 -1.0703 -1.0121 -1.0121 -0.9246 -0.9246 0.2726 0.2726 0.2846 0.2846 0.4559 0.4559 0.4597 0.4597 2.0559 2.0559 2.0723 2.0723 5.0561 5.0561 5.0997 5.0997 6.8827 6.8827 6.9575 6.9575 7.5510 7.5510 7.7190 7.7190 8.5051 8.5051 k = 0.5000 0.6069 0.1893 ( 8676 PWs) bands (ev): -3.1564 -3.1564 -3.1529 -3.1529 -3.1303 -3.1303 -3.1230 -3.1230 -3.1025 -3.1025 -3.1014 -3.1014 -3.0798 -3.0798 -3.0600 -3.0600 -3.0549 -3.0549 -3.0499 -3.0499 -3.0169 -3.0169 -3.0098 -3.0098 -1.4782 -1.4782 -1.4475 -1.4475 -1.4081 -1.4081 -1.3918 -1.3918 -1.3694 -1.3694 -1.3492 -1.3492 -1.3043 -1.3043 -1.2882 -1.2882 -1.2417 -1.2417 -1.2178 -1.2178 -1.1935 -1.1935 -1.1786 -1.1786 -1.1397 -1.1397 -1.1144 -1.1144 -1.0844 -1.0844 -1.0689 -1.0689 -1.0122 -1.0122 -0.9267 -0.9267 0.2629 0.2629 0.2746 0.2746 0.4745 0.4745 0.4791 0.4791 2.0334 2.0334 2.0493 2.0493 5.1259 5.1259 5.1694 5.1694 6.8359 6.8359 6.8953 6.8953 7.5613 7.5613 7.7081 7.7081 8.4674 8.4674 k = 0.5000 0.6175 0.1703 ( 8682 PWs) bands (ev): -3.1554 -3.1554 -3.1518 -3.1518 -3.1308 -3.1308 -3.1235 -3.1235 -3.1024 -3.1024 -3.1012 -3.1012 -3.0808 -3.0808 -3.0609 -3.0609 -3.0544 -3.0544 -3.0498 -3.0498 -3.0168 -3.0168 -3.0099 -3.0099 -1.4787 -1.4787 -1.4501 -1.4501 -1.4052 -1.4052 -1.3909 -1.3909 -1.3681 -1.3681 -1.3490 -1.3490 -1.3043 -1.3043 -1.2931 -1.2931 -1.2438 -1.2438 -1.2194 -1.2194 -1.1965 -1.1965 -1.1781 -1.1781 -1.1362 -1.1362 -1.1124 -1.1124 -1.0840 -1.0840 -1.0673 -1.0673 -1.0121 -1.0121 -0.9292 -0.9292 0.2518 0.2518 0.2632 0.2632 0.4956 0.4956 0.5009 0.5009 2.0097 2.0097 2.0253 2.0253 5.2050 5.2050 5.2485 5.2485 6.7853 6.7853 6.8314 6.8314 7.5611 7.5611 7.6882 7.6882 8.4289 8.4289 k = 0.5000 0.6281 0.1514 ( 8684 PWs) bands (ev): -3.1543 -3.1543 -3.1506 -3.1506 -3.1314 -3.1314 -3.1241 -3.1241 -3.1023 -3.1023 -3.1011 -3.1011 -3.0817 -3.0817 -3.0618 -3.0618 -3.0539 -3.0539 -3.0496 -3.0496 -3.0167 -3.0167 -3.0099 -3.0099 -1.4791 -1.4791 -1.4526 -1.4526 -1.4025 -1.4025 -1.3900 -1.3900 -1.3666 -1.3666 -1.3490 -1.3490 -1.3042 -1.3042 -1.2980 -1.2980 -1.2461 -1.2461 -1.2215 -1.2215 -1.1990 -1.1990 -1.1773 -1.1773 -1.1331 -1.1331 -1.1105 -1.1105 -1.0834 -1.0834 -1.0657 -1.0657 -1.0118 -1.0118 -0.9319 -0.9319 0.2390 0.2390 0.2502 0.2502 0.5190 0.5190 0.5252 0.5252 1.9862 1.9862 2.0013 2.0013 5.2921 5.2921 5.3359 5.3359 6.7321 6.7321 6.7670 6.7670 7.5480 7.5480 7.6574 7.6574 8.3938 8.3938 k = 0.5000 0.6386 0.1324 ( 8680 PWs) bands (ev): -3.1531 -3.1531 -3.1494 -3.1494 -3.1320 -3.1320 -3.1247 -3.1247 -3.1023 -3.1023 -3.1010 -3.1010 -3.0825 -3.0825 -3.0627 -3.0627 -3.0534 -3.0534 -3.0496 -3.0496 -3.0166 -3.0166 -3.0100 -3.0100 -1.4796 -1.4796 -1.4550 -1.4550 -1.3999 -1.3999 -1.3891 -1.3891 -1.3650 -1.3650 -1.3492 -1.3492 -1.3041 -1.3041 -1.3028 -1.3028 -1.2487 -1.2487 -1.2241 -1.2241 -1.2009 -1.2009 -1.1762 -1.1762 -1.1306 -1.1306 -1.1089 -1.1089 -1.0827 -1.0827 -1.0642 -1.0642 -1.0113 -1.0113 -0.9350 -0.9350 0.2243 0.2243 0.2353 0.2353 0.5448 0.5448 0.5518 0.5518 1.9637 1.9637 1.9784 1.9784 5.3857 5.3857 5.4299 5.4299 6.6777 6.6777 6.7033 6.7033 7.5208 7.5208 7.6151 7.6151 8.3655 8.3655 k = 0.5000 0.6492 0.1134 ( 8672 PWs) bands (ev): -3.1519 -3.1519 -3.1481 -3.1481 -3.1326 -3.1326 -3.1253 -3.1253 -3.1023 -3.1023 -3.1010 -3.1010 -3.0833 -3.0833 -3.0636 -3.0636 -3.0528 -3.0528 -3.0496 -3.0496 -3.0165 -3.0165 -3.0100 -3.0100 -1.4799 -1.4799 -1.4572 -1.4572 -1.3973 -1.3973 -1.3881 -1.3881 -1.3633 -1.3633 -1.3496 -1.3496 -1.3073 -1.3073 -1.3039 -1.3039 -1.2515 -1.2515 -1.2270 -1.2270 -1.2024 -1.2024 -1.1750 -1.1750 -1.1287 -1.1287 -1.1075 -1.1075 -1.0817 -1.0817 -1.0629 -1.0629 -1.0104 -1.0104 -0.9383 -0.9383 0.2075 0.2075 0.2183 0.2183 0.5729 0.5729 0.5807 0.5807 1.9432 1.9432 1.9576 1.9576 5.4840 5.4840 5.5288 5.5288 6.6236 6.6236 6.6414 6.6414 7.4795 7.4795 7.5617 7.5617 8.3458 8.3458 k = 0.5000 0.6598 0.0945 ( 8674 PWs) bands (ev): -3.1506 -3.1506 -3.1469 -3.1469 -3.1333 -3.1333 -3.1258 -3.1258 -3.1024 -3.1024 -3.1009 -3.1009 -3.0839 -3.0839 -3.0644 -3.0644 -3.0523 -3.0523 -3.0497 -3.0497 -3.0163 -3.0163 -3.0101 -3.0101 -1.4802 -1.4802 -1.4592 -1.4592 -1.3950 -1.3950 -1.3871 -1.3871 -1.3615 -1.3615 -1.3503 -1.3503 -1.3115 -1.3115 -1.3038 -1.3038 -1.2543 -1.2543 -1.2301 -1.2301 -1.2035 -1.2035 -1.1739 -1.1739 -1.1273 -1.1273 -1.1064 -1.1064 -1.0805 -1.0805 -1.0618 -1.0618 -1.0093 -1.0093 -0.9419 -0.9419 0.1884 0.1884 0.1990 0.1990 0.6033 0.6033 0.6119 0.6119 1.9257 1.9257 1.9397 1.9397 5.5846 5.5846 5.6304 5.6304 6.5713 6.5713 6.5830 6.5830 7.4255 7.4255 7.4994 7.4994 8.3349 8.3349 k = 0.5000 0.6704 0.0755 ( 8676 PWs) bands (ev): -3.1493 -3.1493 -3.1458 -3.1458 -3.1339 -3.1339 -3.1262 -3.1262 -3.1026 -3.1026 -3.1009 -3.1009 -3.0844 -3.0844 -3.0651 -3.0651 -3.0518 -3.0518 -3.0498 -3.0498 -3.0160 -3.0160 -3.0101 -3.0101 -1.4803 -1.4803 -1.4611 -1.4611 -1.3927 -1.3927 -1.3862 -1.3862 -1.3597 -1.3597 -1.3513 -1.3513 -1.3151 -1.3151 -1.3036 -1.3036 -1.2572 -1.2572 -1.2333 -1.2333 -1.2041 -1.2041 -1.1729 -1.1729 -1.1265 -1.1265 -1.1055 -1.1055 -1.0792 -1.0792 -1.0610 -1.0610 -1.0079 -1.0079 -0.9457 -0.9457 0.1669 0.1669 0.1772 0.1772 0.6359 0.6359 0.6453 0.6453 1.9117 1.9117 1.9255 1.9255 5.6845 5.6845 5.7313 5.7313 6.5231 6.5231 6.5304 6.5304 7.3615 7.3615 7.4307 7.4307 8.3313 8.3313 k = 0.5000 0.6809 0.0565 ( 8690 PWs) bands (ev): -3.1481 -3.1481 -3.1450 -3.1450 -3.1344 -3.1344 -3.1264 -3.1264 -3.1028 -3.1028 -3.1010 -3.1010 -3.0847 -3.0847 -3.0657 -3.0657 -3.0514 -3.0514 -3.0500 -3.0500 -3.0158 -3.0158 -3.0102 -3.0102 -1.4803 -1.4803 -1.4629 -1.4629 -1.3907 -1.3907 -1.3856 -1.3856 -1.3580 -1.3580 -1.3525 -1.3525 -1.3181 -1.3181 -1.3033 -1.3033 -1.2600 -1.2600 -1.2365 -1.2365 -1.2044 -1.2044 -1.1721 -1.1721 -1.1262 -1.1262 -1.1048 -1.1048 -1.0777 -1.0777 -1.0604 -1.0604 -1.0062 -1.0062 -0.9497 -0.9497 0.1429 0.1429 0.1529 0.1529 0.6707 0.6707 0.6809 0.6809 1.9020 1.9020 1.9154 1.9154 5.7790 5.7790 5.8264 5.8264 6.4823 6.4823 6.4874 6.4874 7.2907 7.2907 7.3589 7.3589 8.3329 8.3329 k = 0.5000 0.6809 0.0565 ( 8690 PWs) bands (ev): -3.1481 -3.1481 -3.1450 -3.1450 -3.1344 -3.1344 -3.1264 -3.1264 -3.1028 -3.1028 -3.1010 -3.1010 -3.0847 -3.0847 -3.0657 -3.0657 -3.0514 -3.0514 -3.0500 -3.0500 -3.0158 -3.0158 -3.0102 -3.0102 -1.4803 -1.4803 -1.4629 -1.4629 -1.3907 -1.3907 -1.3856 -1.3856 -1.3580 -1.3580 -1.3525 -1.3525 -1.3181 -1.3181 -1.3033 -1.3033 -1.2600 -1.2600 -1.2365 -1.2365 -1.2044 -1.2044 -1.1721 -1.1721 -1.1262 -1.1262 -1.1048 -1.1048 -1.0777 -1.0777 -1.0604 -1.0604 -1.0062 -1.0062 -0.9497 -0.9497 0.1429 0.1429 0.1529 0.1529 0.6707 0.6707 0.6809 0.6809 1.9020 1.9020 1.9154 1.9154 5.7790 5.7790 5.8264 5.8264 6.4823 6.4823 6.4874 6.4874 7.2907 7.2907 7.3589 7.3589 8.3329 8.3329 k = 0.5000 0.6723 0.0376 ( 8700 PWs) bands (ev): -3.1482 -3.1482 -3.1451 -3.1451 -3.1342 -3.1342 -3.1265 -3.1265 -3.1026 -3.1026 -3.1013 -3.1013 -3.0844 -3.0844 -3.0657 -3.0657 -3.0515 -3.0515 -3.0503 -3.0503 -3.0155 -3.0155 -3.0102 -3.0102 -1.4795 -1.4795 -1.4629 -1.4629 -1.3891 -1.3891 -1.3845 -1.3845 -1.3584 -1.3584 -1.3523 -1.3523 -1.3198 -1.3198 -1.3026 -1.3026 -1.2611 -1.2611 -1.2364 -1.2364 -1.2052 -1.2052 -1.1746 -1.1746 -1.1284 -1.1284 -1.1066 -1.1066 -1.0750 -1.0750 -1.0588 -1.0588 -1.0056 -1.0056 -0.9513 -0.9513 0.1335 0.1335 0.1439 0.1439 0.6870 0.6870 0.6964 0.6964 1.9035 1.9035 1.9165 1.9165 5.7971 5.7971 5.8457 5.8457 6.3942 6.3942 6.3950 6.3950 7.3373 7.3373 7.4016 7.4016 8.3635 8.3636 k = 0.5000 0.6638 0.0187 ( 8704 PWs) bands (ev): -3.1483 -3.1483 -3.1453 -3.1453 -3.1340 -3.1340 -3.1267 -3.1267 -3.1024 -3.1024 -3.1015 -3.1015 -3.0841 -3.0841 -3.0657 -3.0657 -3.0516 -3.0516 -3.0505 -3.0505 -3.0152 -3.0152 -3.0102 -3.0102 -1.4785 -1.4785 -1.4629 -1.4629 -1.3875 -1.3875 -1.3837 -1.3837 -1.3589 -1.3589 -1.3518 -1.3518 -1.3213 -1.3213 -1.3021 -1.3021 -1.2620 -1.2620 -1.2365 -1.2365 -1.2063 -1.2063 -1.1775 -1.1775 -1.1303 -1.1303 -1.1082 -1.1082 -1.0722 -1.0722 -1.0569 -1.0569 -1.0053 -1.0053 -0.9532 -0.9532 0.1198 0.1198 0.1303 0.1303 0.7075 0.7075 0.7162 0.7162 1.9092 1.9092 1.9217 1.9217 5.7949 5.7949 5.8423 5.8423 6.3271 6.3271 6.3300 6.3300 7.3791 7.3791 7.4407 7.4407 8.3925 8.3925 k = 0.5000 0.6552-0.0003 ( 8706 PWs) bands (ev): -3.1483 -3.1483 -3.1455 -3.1455 -3.1338 -3.1338 -3.1268 -3.1268 -3.1021 -3.1021 -3.1017 -3.1017 -3.0838 -3.0838 -3.0659 -3.0659 -3.0516 -3.0516 -3.0507 -3.0507 -3.0148 -3.0148 -3.0101 -3.0101 -1.4774 -1.4774 -1.4630 -1.4630 -1.3857 -1.3857 -1.3834 -1.3834 -1.3593 -1.3593 -1.3509 -1.3509 -1.3226 -1.3226 -1.3019 -1.3019 -1.2625 -1.2625 -1.2369 -1.2369 -1.2075 -1.2075 -1.1809 -1.1809 -1.1321 -1.1321 -1.1096 -1.1096 -1.0694 -1.0694 -1.0548 -1.0548 -1.0052 -1.0052 -0.9553 -0.9553 0.1034 0.1034 0.1138 0.1138 0.7301 0.7301 0.7381 0.7381 1.9193 1.9193 1.9312 1.9312 5.7643 5.7643 5.8066 5.8066 6.2967 6.2967 6.2971 6.2971 7.4147 7.4147 7.4741 7.4741 8.4199 8.4247 k = 0.5000 0.6466-0.0192 ( 8696 PWs) bands (ev): -3.1483 -3.1483 -3.1456 -3.1456 -3.1335 -3.1335 -3.1270 -3.1270 -3.1020 -3.1020 -3.1019 -3.1019 -3.0835 -3.0835 -3.0661 -3.0661 -3.0516 -3.0516 -3.0509 -3.0509 -3.0145 -3.0145 -3.0101 -3.0101 -1.4763 -1.4763 -1.4631 -1.4631 -1.3840 -1.3840 -1.3834 -1.3834 -1.3597 -1.3597 -1.3498 -1.3498 -1.3234 -1.3234 -1.3020 -1.3020 -1.2627 -1.2627 -1.2375 -1.2375 -1.2090 -1.2090 -1.1848 -1.1848 -1.1335 -1.1335 -1.1108 -1.1108 -1.0665 -1.0665 -1.0526 -1.0526 -1.0053 -1.0053 -0.9578 -0.9578 0.0858 0.0858 0.0959 0.0959 0.7531 0.7531 0.7606 0.7606 1.9336 1.9336 1.9449 1.9449 5.7056 5.7056 5.7405 5.7405 6.2968 6.2968 6.3021 6.3021 7.4431 7.4431 7.5004 7.5004 8.4443 8.4443 k = 0.5000 0.6380-0.0382 ( 8692 PWs) bands (ev): -3.1483 -3.1483 -3.1458 -3.1458 -3.1333 -3.1333 -3.1272 -3.1272 -3.1021 -3.1021 -3.1018 -3.1018 -3.0831 -3.0831 -3.0665 -3.0665 -3.0516 -3.0516 -3.0510 -3.0510 -3.0142 -3.0142 -3.0101 -3.0101 -1.4750 -1.4750 -1.4631 -1.4631 -1.3838 -1.3838 -1.3823 -1.3823 -1.3600 -1.3600 -1.3486 -1.3486 -1.3238 -1.3238 -1.3024 -1.3024 -1.2625 -1.2625 -1.2384 -1.2384 -1.2107 -1.2107 -1.1889 -1.1889 -1.1345 -1.1345 -1.1119 -1.1119 -1.0637 -1.0637 -1.0502 -1.0502 -1.0056 -1.0056 -0.9605 -0.9605 0.0678 0.0678 0.0775 0.0775 0.7753 0.7753 0.7822 0.7822 1.9520 1.9520 1.9625 1.9625 5.6276 5.6276 5.6555 5.6555 6.3212 6.3212 6.3318 6.3318 7.4633 7.4633 7.5186 7.5186 8.4622 8.4623 k = 0.5000 0.6294-0.0571 ( 8698 PWs) bands (ev): -3.1482 -3.1482 -3.1459 -3.1459 -3.1330 -3.1330 -3.1273 -3.1273 -3.1023 -3.1023 -3.1017 -3.1017 -3.0827 -3.0827 -3.0669 -3.0669 -3.0515 -3.0515 -3.0510 -3.0510 -3.0139 -3.0139 -3.0102 -3.0102 -1.4737 -1.4737 -1.4632 -1.4632 -1.3844 -1.3844 -1.3808 -1.3808 -1.3602 -1.3602 -1.3476 -1.3476 -1.3236 -1.3236 -1.3029 -1.3029 -1.2620 -1.2620 -1.2395 -1.2395 -1.2127 -1.2127 -1.1932 -1.1932 -1.1352 -1.1352 -1.1129 -1.1129 -1.0608 -1.0608 -1.0477 -1.0477 -1.0061 -1.0061 -0.9634 -0.9634 0.0502 0.0502 0.0594 0.0594 0.7959 0.7959 0.8022 0.8022 1.9740 1.9740 1.9838 1.9838 5.5402 5.5402 5.5626 5.5626 6.3609 6.3609 6.3758 6.3758 7.4751 7.4751 7.5281 7.5281 8.4776 8.4777 k = 0.5000 0.6208-0.0760 ( 8694 PWs) bands (ev): -3.1482 -3.1482 -3.1460 -3.1460 -3.1327 -3.1327 -3.1275 -3.1275 -3.1024 -3.1024 -3.1016 -3.1016 -3.0822 -3.0822 -3.0675 -3.0675 -3.0514 -3.0514 -3.0510 -3.0510 -3.0135 -3.0135 -3.0102 -3.0102 -1.4724 -1.4724 -1.4632 -1.4632 -1.3851 -1.3851 -1.3797 -1.3797 -1.3602 -1.3602 -1.3468 -1.3468 -1.3227 -1.3227 -1.3035 -1.3035 -1.2613 -1.2613 -1.2408 -1.2408 -1.2150 -1.2150 -1.1976 -1.1976 -1.1354 -1.1354 -1.1138 -1.1138 -1.0580 -1.0580 -1.0451 -1.0451 -1.0066 -1.0066 -0.9665 -0.9665 0.0336 0.0336 0.0421 0.0421 0.8144 0.8144 0.8201 0.8201 1.9991 1.9991 2.0080 2.0080 5.4503 5.4503 5.4685 5.4685 6.4096 6.4096 6.4276 6.4276 7.4786 7.4786 7.5291 7.5291 8.4896 8.4896 k = 0.5000 0.6122-0.0950 ( 8702 PWs) bands (ev): -3.1481 -3.1481 -3.1461 -3.1461 -3.1324 -3.1324 -3.1277 -3.1277 -3.1025 -3.1025 -3.1015 -3.1015 -3.0816 -3.0816 -3.0681 -3.0681 -3.0513 -3.0513 -3.0510 -3.0510 -3.0132 -3.0132 -3.0102 -3.0102 -1.4711 -1.4711 -1.4633 -1.4633 -1.3859 -1.3859 -1.3789 -1.3789 -1.3598 -1.3598 -1.3464 -1.3464 -1.3211 -1.3211 -1.3041 -1.3041 -1.2604 -1.2604 -1.2425 -1.2425 -1.2174 -1.2174 -1.2020 -1.2020 -1.1353 -1.1353 -1.1147 -1.1147 -1.0552 -1.0552 -1.0426 -1.0426 -1.0073 -1.0073 -0.9698 -0.9698 0.0183 0.0183 0.0260 0.0260 0.8305 0.8305 0.8355 0.8355 2.0263 2.0263 2.0343 2.0343 5.3622 5.3622 5.3771 5.3771 6.4635 6.4635 6.4835 6.4835 7.4742 7.4742 7.5219 7.5219 8.4971 8.4974 k = 0.5000 0.6036-0.1139 ( 8704 PWs) bands (ev): -3.1479 -3.1479 -3.1462 -3.1462 -3.1321 -3.1321 -3.1279 -3.1279 -3.1025 -3.1025 -3.1015 -3.1015 -3.0810 -3.0810 -3.0688 -3.0688 -3.0512 -3.0512 -3.0510 -3.0510 -3.0129 -3.0129 -3.0103 -3.0103 -1.4698 -1.4698 -1.4633 -1.4633 -1.3866 -1.3866 -1.3787 -1.3787 -1.3592 -1.3592 -1.3463 -1.3463 -1.3190 -1.3190 -1.3045 -1.3045 -1.2595 -1.2595 -1.2443 -1.2443 -1.2198 -1.2198 -1.2062 -1.2062 -1.1347 -1.1347 -1.1157 -1.1157 -1.0525 -1.0525 -1.0401 -1.0401 -1.0078 -1.0078 -0.9733 -0.9733 0.0045 0.0045 0.0114 0.0114 0.8442 0.8442 0.8486 0.8486 2.0546 2.0546 2.0617 2.0617 5.2788 5.2788 5.2911 5.2911 6.5199 6.5199 6.5413 6.5413 7.4628 7.4628 7.5075 7.5075 8.5000 8.5002 k = 0.5000 0.5950-0.1329 ( 8706 PWs) bands (ev): -3.1478 -3.1478 -3.1463 -3.1463 -3.1318 -3.1318 -3.1282 -3.1282 -3.1026 -3.1026 -3.1016 -3.1016 -3.0803 -3.0803 -3.0696 -3.0696 -3.0511 -3.0511 -3.0509 -3.0509 -3.0126 -3.0126 -3.0104 -3.0104 -1.4686 -1.4686 -1.4633 -1.4633 -1.3872 -1.3872 -1.3790 -1.3790 -1.3582 -1.3582 -1.3466 -1.3466 -1.3165 -1.3165 -1.3048 -1.3048 -1.2586 -1.2586 -1.2464 -1.2464 -1.2221 -1.2221 -1.2101 -1.2101 -1.1339 -1.1339 -1.1168 -1.1168 -1.0499 -1.0499 -1.0378 -1.0378 -1.0081 -1.0081 -0.9768 -0.9768 -0.0077 -0.0077 -0.0016 -0.0016 0.8555 0.8555 0.8593 0.8593 2.0828 2.0828 2.0890 2.0890 5.2024 5.2024 5.2124 5.2124 6.5769 6.5769 6.5989 6.5989 7.4456 7.4456 7.4869 7.4869 8.4965 8.4990 k = 0.5000 0.5864-0.1518 ( 8708 PWs) bands (ev): -3.1476 -3.1476 -3.1464 -3.1464 -3.1315 -3.1315 -3.1284 -3.1284 -3.1026 -3.1026 -3.1016 -3.1016 -3.0796 -3.0796 -3.0705 -3.0705 -3.0510 -3.0510 -3.0509 -3.0509 -3.0124 -3.0124 -3.0105 -3.0105 -1.4675 -1.4675 -1.4634 -1.4634 -1.3875 -1.3875 -1.3796 -1.3796 -1.3570 -1.3570 -1.3470 -1.3470 -1.3138 -1.3138 -1.3048 -1.3048 -1.2579 -1.2579 -1.2486 -1.2486 -1.2241 -1.2241 -1.2138 -1.2138 -1.1328 -1.1328 -1.1180 -1.1180 -1.0473 -1.0473 -1.0360 -1.0360 -1.0081 -1.0081 -0.9805 -0.9805 -0.0180 -0.0180 -0.0128 -0.0128 0.8647 0.8647 0.8678 0.8678 2.1097 2.1097 2.1150 2.1150 5.1347 5.1347 5.1427 5.1427 6.6327 6.6327 6.6545 6.6545 7.4242 7.4242 7.4617 7.4617 8.4904 8.4954 k = 0.5000 0.5778-0.1708 ( 8710 PWs) bands (ev): -3.1475 -3.1475 -3.1465 -3.1465 -3.1312 -3.1312 -3.1287 -3.1287 -3.1025 -3.1025 -3.1017 -3.1017 -3.0788 -3.0788 -3.0714 -3.0714 -3.0509 -3.0509 -3.0508 -3.0508 -3.0121 -3.0121 -3.0106 -3.0106 -1.4666 -1.4666 -1.4634 -1.4634 -1.3877 -1.3877 -1.3806 -1.3806 -1.3557 -1.3557 -1.3476 -1.3476 -1.3112 -1.3112 -1.3046 -1.3046 -1.2574 -1.2574 -1.2507 -1.2507 -1.2257 -1.2257 -1.2170 -1.2170 -1.1315 -1.1315 -1.1192 -1.1192 -1.0448 -1.0448 -1.0347 -1.0347 -1.0075 -1.0075 -0.9842 -0.9842 -0.0264 -0.0264 -0.0222 -0.0222 0.8719 0.8719 0.8744 0.8744 2.1341 2.1341 2.1383 2.1383 5.0771 5.0771 5.0834 5.0834 6.6854 6.6854 6.7060 6.7060 7.4007 7.4007 7.4336 7.4336 8.4845 8.4894 k = 0.5000 0.5692-0.1897 ( 8704 PWs) bands (ev): -3.1473 -3.1473 -3.1466 -3.1466 -3.1309 -3.1309 -3.1290 -3.1290 -3.1025 -3.1025 -3.1018 -3.1018 -3.0779 -3.0779 -3.0723 -3.0723 -3.0509 -3.0509 -3.0508 -3.0508 -3.0119 -3.0119 -3.0107 -3.0107 -1.4657 -1.4657 -1.4635 -1.4635 -1.3875 -1.3875 -1.3818 -1.3818 -1.3544 -1.3544 -1.3483 -1.3483 -1.3088 -1.3088 -1.3043 -1.3043 -1.2571 -1.2571 -1.2527 -1.2527 -1.2268 -1.2268 -1.2199 -1.2199 -1.1300 -1.1300 -1.1206 -1.1206 -1.0424 -1.0424 -1.0342 -1.0342 -1.0062 -1.0062 -0.9880 -0.9880 -0.0328 -0.0328 -0.0296 -0.0296 0.8773 0.8773 0.8791 0.8791 2.1547 2.1547 2.1579 2.1579 5.0310 5.0310 5.0356 5.0356 6.7328 6.7328 6.7508 6.7508 7.3779 7.3779 7.4050 7.4050 8.4792 8.4800 k = 0.5000 0.5606-0.2086 ( 8700 PWs) bands (ev): -3.1472 -3.1472 -3.1467 -3.1467 -3.1306 -3.1306 -3.1293 -3.1293 -3.1024 -3.1024 -3.1019 -3.1019 -3.0770 -3.0770 -3.0732 -3.0732 -3.0508 -3.0508 -3.0507 -3.0507 -3.0116 -3.0116 -3.0109 -3.0109 -1.4650 -1.4650 -1.4636 -1.4636 -1.3871 -1.3871 -1.3831 -1.3831 -1.3532 -1.3532 -1.3491 -1.3491 -1.3068 -1.3068 -1.3041 -1.3041 -1.2570 -1.2570 -1.2544 -1.2544 -1.2271 -1.2271 -1.2223 -1.2223 -1.1285 -1.1285 -1.1221 -1.1221 -1.0402 -1.0402 -1.0343 -1.0343 -1.0043 -1.0043 -0.9917 -0.9917 -0.0373 -0.0373 -0.0352 -0.0352 0.8811 0.8811 0.8823 0.8823 2.1704 2.1704 2.1725 2.1725 4.9974 4.9974 5.0004 5.0004 6.7718 6.7718 6.7856 6.7856 7.3591 7.3591 7.3788 7.3788 8.4756 8.4765 k = 0.5000 0.5521-0.2276 ( 8712 PWs) bands (ev): -3.1470 -3.1470 -3.1468 -3.1468 -3.1302 -3.1302 -3.1296 -3.1296 -3.1023 -3.1023 -3.1021 -3.1021 -3.0761 -3.0761 -3.0742 -3.0742 -3.0508 -3.0508 -3.0507 -3.0507 -3.0114 -3.0114 -3.0110 -3.0110 -1.4645 -1.4645 -1.4638 -1.4638 -1.3864 -1.3864 -1.3843 -1.3843 -1.3521 -1.3521 -1.3500 -1.3500 -1.3053 -1.3053 -1.3040 -1.3040 -1.2568 -1.2568 -1.2557 -1.2557 -1.2268 -1.2268 -1.2243 -1.2243 -1.1269 -1.1269 -1.1236 -1.1236 -1.0382 -1.0382 -1.0352 -1.0352 -1.0017 -1.0017 -0.9953 -0.9953 -0.0398 -0.0398 -0.0387 -0.0387 0.8835 0.8835 0.8841 0.8841 2.1804 2.1804 2.1815 2.1815 4.9772 4.9772 4.9787 4.9787 6.7992 6.7992 6.8067 6.8067 7.3481 7.3481 7.3586 7.3586 8.4738 8.4742 k = 0.5000 0.5435-0.2465 ( 8716 PWs) bands (ev): -3.1469 -3.1469 -3.1469 -3.1469 -3.1299 -3.1299 -3.1299 -3.1299 -3.1022 -3.1022 -3.1022 -3.1022 -3.0752 -3.0752 -3.0752 -3.0752 -3.0507 -3.0507 -3.0507 -3.0507 -3.0112 -3.0112 -3.0112 -3.0112 -1.4641 -1.4641 -1.4641 -1.4641 -1.3854 -1.3854 -1.3854 -1.3854 -1.3510 -1.3510 -1.3510 -1.3510 -1.3044 -1.3044 -1.3044 -1.3044 -1.2564 -1.2564 -1.2564 -1.2564 -1.2258 -1.2258 -1.2258 -1.2258 -1.1252 -1.1252 -1.1252 -1.1252 -1.0365 -1.0365 -1.0365 -1.0365 -0.9986 -0.9986 -0.9986 -0.9986 -0.0402 -0.0402 -0.0402 -0.0402 0.8844 0.8844 0.8844 0.8844 2.1842 2.1842 2.1842 2.1842 4.9709 4.9709 4.9709 4.9709 6.8115 6.8115 6.8115 6.8115 7.3477 7.3477 7.3477 7.3477 8.4732 8.4732 k = 0.5000 0.5435-0.2465 ( 8716 PWs) bands (ev): -3.1469 -3.1469 -3.1469 -3.1469 -3.1299 -3.1299 -3.1299 -3.1299 -3.1022 -3.1022 -3.1022 -3.1022 -3.0752 -3.0752 -3.0752 -3.0752 -3.0507 -3.0507 -3.0507 -3.0507 -3.0112 -3.0112 -3.0112 -3.0112 -1.4641 -1.4641 -1.4641 -1.4641 -1.3854 -1.3854 -1.3854 -1.3854 -1.3510 -1.3510 -1.3510 -1.3510 -1.3044 -1.3044 -1.3044 -1.3044 -1.2564 -1.2564 -1.2564 -1.2564 -1.2258 -1.2258 -1.2258 -1.2258 -1.1252 -1.1252 -1.1252 -1.1252 -1.0365 -1.0365 -1.0365 -1.0365 -0.9986 -0.9986 -0.9986 -0.9986 -0.0402 -0.0402 -0.0402 -0.0402 0.8844 0.8844 0.8844 0.8844 2.1842 2.1842 2.1842 2.1842 4.9709 4.9709 4.9709 4.9709 6.8115 6.8115 6.8115 6.8115 7.3477 7.3477 7.3477 7.3477 8.4732 8.4732 k = 0.4783 0.5435-0.2465 ( 8716 PWs) bands (ev): -3.1485 -3.1485 -3.1455 -3.1455 -3.1312 -3.1312 -3.1286 -3.1286 -3.1035 -3.1035 -3.1008 -3.1008 -3.0761 -3.0761 -3.0743 -3.0743 -3.0516 -3.0516 -3.0499 -3.0499 -3.0117 -3.0117 -3.0107 -3.0107 -1.4657 -1.4657 -1.4626 -1.4626 -1.3871 -1.3871 -1.3840 -1.3840 -1.3516 -1.3516 -1.3501 -1.3501 -1.3058 -1.3058 -1.3032 -1.3032 -1.2613 -1.2613 -1.2517 -1.2517 -1.2266 -1.2266 -1.2245 -1.2245 -1.1283 -1.1283 -1.1225 -1.1225 -1.0412 -1.0412 -1.0320 -1.0320 -1.0004 -1.0004 -0.9966 -0.9966 -0.0995 -0.0995 0.0198 0.0198 0.8696 0.8696 0.8994 0.8994 2.1803 2.1803 2.1928 2.1928 4.9003 4.9003 5.0451 5.0451 6.7326 6.7326 6.8849 6.8849 7.2792 7.2792 7.4128 7.4128 8.3086 8.3086 k = 0.4565 0.5435-0.2465 ( 8716 PWs) bands (ev): -3.1501 -3.1501 -3.1442 -3.1442 -3.1324 -3.1324 -3.1273 -3.1273 -3.1047 -3.1047 -3.0994 -3.0994 -3.0770 -3.0770 -3.0734 -3.0734 -3.0525 -3.0525 -3.0491 -3.0491 -3.0122 -3.0122 -3.0102 -3.0102 -1.4674 -1.4674 -1.4612 -1.4612 -1.3889 -1.3889 -1.3829 -1.3829 -1.3520 -1.3520 -1.3490 -1.3490 -1.3074 -1.3074 -1.3023 -1.3023 -1.2661 -1.2661 -1.2476 -1.2476 -1.2266 -1.2266 -1.2229 -1.2229 -1.1316 -1.1316 -1.1201 -1.1201 -1.0461 -1.0461 -1.0279 -1.0279 -1.0018 -1.0018 -0.9945 -0.9945 -0.1572 -0.1572 0.0796 0.0796 0.8560 0.8560 0.9134 0.9134 2.1814 2.1814 2.2058 2.2058 4.8337 4.8337 5.1225 5.1225 6.6520 6.6520 6.9417 6.9417 7.2207 7.2207 7.4658 7.4658 8.1606 8.1606 k = 0.4348 0.5435-0.2465 ( 8700 PWs) bands (ev): -3.1518 -3.1518 -3.1432 -3.1432 -3.1334 -3.1334 -3.1261 -3.1261 -3.1058 -3.1058 -3.0979 -3.0979 -3.0779 -3.0779 -3.0725 -3.0725 -3.0534 -3.0534 -3.0483 -3.0483 -3.0127 -3.0127 -3.0096 -3.0096 -1.4691 -1.4691 -1.4600 -1.4600 -1.3905 -1.3905 -1.3824 -1.3824 -1.3522 -1.3522 -1.3477 -1.3477 -1.3091 -1.3091 -1.3017 -1.3017 -1.2707 -1.2707 -1.2445 -1.2445 -1.2254 -1.2254 -1.2207 -1.2207 -1.1352 -1.1352 -1.1182 -1.1182 -1.0508 -1.0508 -1.0246 -1.0246 -1.0025 -1.0025 -0.9923 -0.9923 -0.2130 -0.2130 0.1378 0.1378 0.8453 0.8453 0.9261 0.9261 2.1878 2.1878 2.2225 2.2225 4.7714 4.7714 5.2028 5.2028 6.5711 6.5711 6.9525 6.9525 7.2020 7.2020 7.4947 7.4947 8.0408 8.0408 k = 0.4130 0.5435-0.2465 ( 8704 PWs) bands (ev): -3.1534 -3.1534 -3.1426 -3.1426 -3.1341 -3.1341 -3.1249 -3.1249 -3.1069 -3.1069 -3.0964 -3.0964 -3.0788 -3.0788 -3.0717 -3.0717 -3.0542 -3.0542 -3.0476 -3.0476 -3.0132 -3.0132 -3.0091 -3.0091 -1.4708 -1.4708 -1.4590 -1.4590 -1.3920 -1.3920 -1.3825 -1.3825 -1.3523 -1.3523 -1.3461 -1.3461 -1.3108 -1.3108 -1.3014 -1.3014 -1.2752 -1.2752 -1.2426 -1.2426 -1.2236 -1.2236 -1.2177 -1.2177 -1.1388 -1.1388 -1.1167 -1.1167 -1.0554 -1.0554 -1.0226 -1.0226 -1.0022 -1.0022 -0.9900 -0.9900 -0.2665 -0.2665 0.1927 0.1927 0.8394 0.8394 0.9369 0.9369 2.1995 2.1995 2.2424 2.2424 4.7137 4.7137 5.2852 5.2852 6.4909 6.4909 6.9005 6.9005 7.2386 7.2386 7.4842 7.4842 7.9638 7.9638 k = 0.3913 0.5435-0.2465 ( 8704 PWs) bands (ev): -3.1550 -3.1550 -3.1425 -3.1425 -3.1345 -3.1345 -3.1239 -3.1239 -3.1079 -3.1079 -3.0949 -3.0949 -3.0796 -3.0796 -3.0709 -3.0709 -3.0551 -3.0551 -3.0470 -3.0470 -3.0136 -3.0136 -3.0085 -3.0085 -1.4725 -1.4725 -1.4584 -1.4584 -1.3931 -1.3931 -1.3833 -1.3833 -1.3523 -1.3523 -1.3443 -1.3443 -1.3122 -1.3122 -1.3015 -1.3015 -1.2794 -1.2794 -1.2416 -1.2416 -1.2220 -1.2220 -1.2132 -1.2132 -1.1425 -1.1425 -1.1157 -1.1157 -1.0599 -1.0599 -1.0219 -1.0219 -1.0008 -1.0008 -0.9876 -0.9876 -0.3174 -0.3174 0.2418 0.2418 0.8411 0.8411 0.9456 0.9456 2.2163 2.2163 2.2647 2.2647 4.6611 4.6611 5.3692 5.3692 6.4118 6.4118 6.8136 6.8136 7.2950 7.2950 7.4371 7.4371 7.9303 7.9303 k = 0.3696 0.5435-0.2465 ( 8708 PWs) bands (ev): -3.1566 -3.1566 -3.1429 -3.1429 -3.1345 -3.1345 -3.1229 -3.1229 -3.1088 -3.1088 -3.0934 -3.0934 -3.0804 -3.0804 -3.0701 -3.0701 -3.0559 -3.0559 -3.0464 -3.0464 -3.0140 -3.0140 -3.0080 -3.0080 -1.4742 -1.4742 -1.4582 -1.4582 -1.3939 -1.3939 -1.3846 -1.3846 -1.3524 -1.3524 -1.3425 -1.3425 -1.3134 -1.3134 -1.3017 -1.3017 -1.2834 -1.2834 -1.2409 -1.2409 -1.2208 -1.2208 -1.2077 -1.2077 -1.1461 -1.1461 -1.1151 -1.1151 -1.0642 -1.0642 -1.0223 -1.0223 -0.9987 -0.9987 -0.9850 -0.9850 -0.3654 -0.3654 0.2826 0.2826 0.8529 0.8529 0.9523 0.9523 2.2381 2.2381 2.2888 2.2888 4.6137 4.6137 5.4536 5.4536 6.3345 6.3345 6.7112 6.7112 7.2952 7.2952 7.4271 7.4271 7.9153 7.9153 k = 0.3478 0.5435-0.2465 ( 8708 PWs) bands (ev): -3.1581 -3.1581 -3.1436 -3.1436 -3.1343 -3.1343 -3.1220 -3.1220 -3.1097 -3.1097 -3.0920 -3.0920 -3.0810 -3.0810 -3.0694 -3.0694 -3.0566 -3.0566 -3.0460 -3.0460 -3.0144 -3.0144 -3.0074 -3.0074 -1.4759 -1.4759 -1.4584 -1.4584 -1.3943 -1.3943 -1.3865 -1.3865 -1.3525 -1.3525 -1.3409 -1.3409 -1.3140 -1.3140 -1.3022 -1.3022 -1.2872 -1.2872 -1.2402 -1.2402 -1.2202 -1.2202 -1.2016 -1.2016 -1.1495 -1.1495 -1.1151 -1.1151 -1.0682 -1.0682 -1.0234 -1.0234 -0.9964 -0.9964 -0.9822 -0.9822 -0.4105 -0.4105 0.3129 0.3129 0.8773 0.8773 0.9571 0.9571 2.2643 2.2643 2.3139 2.3139 4.5721 4.5721 5.5367 5.5367 6.2597 6.2597 6.6009 6.6009 7.2135 7.2135 7.4923 7.4923 7.8901 7.8901 k = 0.3261 0.5435-0.2465 ( 8702 PWs) bands (ev): -3.1595 -3.1595 -3.1445 -3.1445 -3.1340 -3.1340 -3.1213 -3.1213 -3.1105 -3.1105 -3.0906 -3.0906 -3.0816 -3.0816 -3.0687 -3.0687 -3.0573 -3.0573 -3.0456 -3.0456 -3.0148 -3.0148 -3.0069 -3.0069 -1.4776 -1.4776 -1.4590 -1.4590 -1.3942 -1.3942 -1.3888 -1.3888 -1.3527 -1.3527 -1.3397 -1.3397 -1.3141 -1.3141 -1.3028 -1.3028 -1.2907 -1.2907 -1.2393 -1.2393 -1.2199 -1.2199 -1.1953 -1.1953 -1.1526 -1.1526 -1.1155 -1.1155 -1.0721 -1.0721 -1.0247 -1.0247 -0.9943 -0.9943 -0.9790 -0.9790 -0.4527 -0.4527 0.3318 0.3318 0.9147 0.9147 0.9607 0.9607 2.2944 2.2944 2.3392 2.3392 4.5363 4.5363 5.6154 5.6154 6.1884 6.1884 6.4879 6.4879 7.1190 7.1190 7.5706 7.5706 7.8403 7.8403 k = 0.3043 0.5435-0.2465 ( 8696 PWs) bands (ev): -3.1608 -3.1608 -3.1454 -3.1454 -3.1336 -3.1336 -3.1207 -3.1207 -3.1113 -3.1113 -3.0893 -3.0893 -3.0819 -3.0819 -3.0680 -3.0680 -3.0579 -3.0579 -3.0453 -3.0453 -3.0152 -3.0152 -3.0063 -3.0063 -1.4794 -1.4794 -1.4600 -1.4600 -1.3939 -1.3939 -1.3915 -1.3915 -1.3530 -1.3530 -1.3389 -1.3389 -1.3138 -1.3138 -1.3035 -1.3035 -1.2935 -1.2935 -1.2383 -1.2383 -1.2200 -1.2200 -1.1888 -1.1888 -1.1553 -1.1553 -1.1164 -1.1164 -1.0758 -1.0758 -1.0262 -1.0262 -0.9925 -0.9925 -0.9756 -0.9756 -0.4917 -0.4917 0.3401 0.3401 0.9538 0.9538 0.9736 0.9736 2.3276 2.3276 2.3641 2.3641 4.5068 4.5068 5.6838 5.6838 6.1218 6.1218 6.3793 6.3793 7.0261 7.0261 7.6457 7.6457 7.7723 7.7723 k = 0.2826 0.5435-0.2465 ( 8690 PWs) bands (ev): -3.1619 -3.1619 -3.1464 -3.1464 -3.1334 -3.1334 -3.1202 -3.1202 -3.1121 -3.1121 -3.0882 -3.0882 -3.0821 -3.0821 -3.0674 -3.0674 -3.0585 -3.0585 -3.0451 -3.0451 -3.0155 -3.0155 -3.0058 -3.0058 -1.4812 -1.4812 -1.4614 -1.4614 -1.3945 -1.3945 -1.3930 -1.3930 -1.3534 -1.3534 -1.3386 -1.3386 -1.3139 -1.3139 -1.3038 -1.3038 -1.2955 -1.2955 -1.2371 -1.2371 -1.2204 -1.2204 -1.1824 -1.1824 -1.1577 -1.1577 -1.1177 -1.1177 -1.0793 -1.0793 -1.0276 -1.0276 -0.9911 -0.9911 -0.9721 -0.9721 -0.5278 -0.5278 0.3400 0.3400 0.9583 0.9583 1.0304 1.0304 2.3627 2.3627 2.3883 2.3883 4.4838 4.4838 5.7313 5.7313 6.0589 6.0589 6.2886 6.2886 6.9379 6.9379 7.6543 7.6543 7.7557 7.7557 k = 0.2609 0.5435-0.2465 ( 8690 PWs) bands (ev): -3.1630 -3.1630 -3.1473 -3.1473 -3.1332 -3.1332 -3.1199 -3.1199 -3.1129 -3.1129 -3.0872 -3.0872 -3.0820 -3.0820 -3.0668 -3.0668 -3.0590 -3.0590 -3.0449 -3.0449 -3.0158 -3.0158 -3.0053 -3.0053 -1.4830 -1.4830 -1.4631 -1.4631 -1.3976 -1.3976 -1.3921 -1.3921 -1.3539 -1.3539 -1.3386 -1.3386 -1.3152 -1.3152 -1.3033 -1.3033 -1.2963 -1.2963 -1.2357 -1.2357 -1.2211 -1.2211 -1.1761 -1.1761 -1.1596 -1.1596 -1.1194 -1.1194 -1.0827 -1.0827 -1.0290 -1.0290 -0.9900 -0.9900 -0.9685 -0.9685 -0.5608 -0.5608 0.3338 0.3338 0.9575 0.9575 1.0996 1.0996 2.3960 2.3960 2.4140 2.4140 4.4673 4.4673 5.7439 5.7439 5.9909 5.9909 6.2397 6.2397 6.8556 6.8556 7.5712 7.5712 7.8228 7.8228 k = 0.2391 0.5435-0.2465 ( 8694 PWs) bands (ev): -3.1639 -3.1639 -3.1481 -3.1481 -3.1331 -3.1331 -3.1196 -3.1196 -3.1137 -3.1137 -3.0864 -3.0864 -3.0817 -3.0817 -3.0663 -3.0663 -3.0594 -3.0594 -3.0448 -3.0448 -3.0161 -3.0161 -3.0048 -3.0048 -1.4849 -1.4849 -1.4649 -1.4649 -1.4007 -1.4007 -1.3911 -1.3911 -1.3544 -1.3544 -1.3389 -1.3389 -1.3175 -1.3175 -1.3024 -1.3024 -1.2958 -1.2958 -1.2342 -1.2342 -1.2219 -1.2219 -1.1702 -1.1702 -1.1612 -1.1612 -1.1213 -1.1213 -1.0858 -1.0858 -1.0303 -1.0303 -0.9892 -0.9892 -0.9650 -0.9650 -0.5908 -0.5908 0.3236 0.3236 0.9554 0.9554 1.1749 1.1749 2.4193 2.4193 2.4479 2.4479 4.4572 4.4572 5.7171 5.7171 5.9104 5.9104 6.2439 6.2439 6.7813 6.7813 7.4804 7.4804 7.8934 7.8934 k = 0.2174 0.5435-0.2465 ( 8700 PWs) bands (ev): -3.1647 -3.1647 -3.1488 -3.1488 -3.1332 -3.1332 -3.1195 -3.1195 -3.1145 -3.1145 -3.0858 -3.0858 -3.0812 -3.0812 -3.0658 -3.0658 -3.0598 -3.0598 -3.0448 -3.0448 -3.0164 -3.0164 -3.0043 -3.0043 -1.4869 -1.4869 -1.4670 -1.4670 -1.4039 -1.4039 -1.3899 -1.3899 -1.3550 -1.3550 -1.3392 -1.3392 -1.3202 -1.3202 -1.3020 -1.3020 -1.2938 -1.2938 -1.2328 -1.2328 -1.2225 -1.2225 -1.1648 -1.1648 -1.1623 -1.1623 -1.1234 -1.1234 -1.0886 -1.0886 -1.0315 -1.0315 -0.9886 -0.9886 -0.9615 -0.9615 -0.6180 -0.6180 0.3112 0.3112 0.9527 0.9527 1.2541 1.2541 2.4344 2.4344 2.4866 2.4866 4.4535 4.4535 5.6604 5.6604 5.8271 5.8271 6.2780 6.2780 6.7205 6.7205 7.3934 7.3934 7.9573 7.9573 k = 0.1957 0.5435-0.2465 ( 8696 PWs) bands (ev): -3.1654 -3.1654 -3.1494 -3.1494 -3.1333 -3.1333 -3.1195 -3.1195 -3.1154 -3.1154 -3.0853 -3.0853 -3.0807 -3.0807 -3.0655 -3.0655 -3.0599 -3.0599 -3.0449 -3.0449 -3.0167 -3.0167 -3.0039 -3.0039 -1.4890 -1.4890 -1.4691 -1.4691 -1.4069 -1.4069 -1.3887 -1.3887 -1.3558 -1.3558 -1.3396 -1.3396 -1.3227 -1.3227 -1.3022 -1.3022 -1.2909 -1.2909 -1.2318 -1.2318 -1.2227 -1.2227 -1.1638 -1.1638 -1.1595 -1.1595 -1.1254 -1.1254 -1.0912 -1.0912 -1.0327 -1.0327 -0.9882 -0.9882 -0.9583 -0.9583 -0.6423 -0.6423 0.2977 0.2977 0.9495 0.9495 1.3355 1.3355 2.4441 2.4441 2.5260 2.5260 4.4555 4.4555 5.5855 5.5855 5.7514 5.7514 6.3087 6.3087 6.6855 6.6855 7.3141 7.3141 8.0100 8.0100 k = 0.1739 0.5435-0.2465 ( 8686 PWs) bands (ev): -3.1659 -3.1659 -3.1499 -3.1499 -3.1336 -3.1336 -3.1195 -3.1195 -3.1161 -3.1161 -3.0848 -3.0848 -3.0801 -3.0801 -3.0654 -3.0654 -3.0599 -3.0599 -3.0449 -3.0449 -3.0169 -3.0169 -3.0035 -3.0035 -1.4911 -1.4911 -1.4713 -1.4713 -1.4098 -1.4098 -1.3874 -1.3874 -1.3567 -1.3567 -1.3401 -1.3401 -1.3247 -1.3247 -1.3027 -1.3027 -1.2875 -1.2875 -1.2314 -1.2314 -1.2217 -1.2217 -1.1648 -1.1648 -1.1557 -1.1557 -1.1270 -1.1270 -1.0934 -1.0934 -1.0337 -1.0337 -0.9879 -0.9879 -0.9552 -0.9552 -0.6639 -0.6639 0.2840 0.2840 0.9463 0.9463 1.4176 1.4176 2.4486 2.4486 2.5645 2.5645 4.4624 4.4624 5.5029 5.5029 5.6859 5.6859 6.3085 6.3085 6.6924 6.6924 7.2452 7.2452 8.0467 8.0467 k = 0.1522 0.5435-0.2465 ( 8686 PWs) bands (ev): -3.1664 -3.1664 -3.1502 -3.1502 -3.1339 -3.1339 -3.1196 -3.1196 -3.1169 -3.1169 -3.0844 -3.0844 -3.0795 -3.0795 -3.0654 -3.0654 -3.0598 -3.0598 -3.0451 -3.0451 -3.0171 -3.0171 -3.0031 -3.0031 -1.4933 -1.4933 -1.4734 -1.4734 -1.4124 -1.4124 -1.3861 -1.3861 -1.3580 -1.3580 -1.3406 -1.3406 -1.3260 -1.3260 -1.3036 -1.3036 -1.2840 -1.2840 -1.2319 -1.2319 -1.2196 -1.2196 -1.1659 -1.1659 -1.1535 -1.1535 -1.1276 -1.1276 -1.0953 -1.0953 -1.0347 -1.0347 -0.9877 -0.9877 -0.9523 -0.9523 -0.6829 -0.6829 0.2709 0.2709 0.9430 0.9430 1.4988 1.4988 2.4479 2.4479 2.6012 2.6012 4.4732 4.4732 5.4214 5.4214 5.6289 5.6289 6.2732 6.2732 6.7391 6.7391 7.1896 7.1896 8.0620 8.0620 k = 0.1304 0.5435-0.2465 ( 8690 PWs) bands (ev): -3.1668 -3.1668 -3.1503 -3.1503 -3.1343 -3.1343 -3.1197 -3.1197 -3.1175 -3.1175 -3.0839 -3.0839 -3.0789 -3.0789 -3.0656 -3.0656 -3.0595 -3.0595 -3.0452 -3.0452 -3.0173 -3.0173 -3.0028 -3.0028 -1.4953 -1.4953 -1.4753 -1.4753 -1.4147 -1.4147 -1.3847 -1.3847 -1.3595 -1.3595 -1.3412 -1.3412 -1.3265 -1.3265 -1.3048 -1.3048 -1.2805 -1.2805 -1.2329 -1.2329 -1.2166 -1.2166 -1.1672 -1.1672 -1.1531 -1.1531 -1.1268 -1.1268 -1.0968 -1.0968 -1.0357 -1.0357 -0.9876 -0.9876 -0.9497 -0.9497 -0.6993 -0.6993 0.2588 0.2588 0.9399 0.9399 1.5777 1.5777 2.4420 2.4420 2.6352 2.6352 4.4864 4.4864 5.3466 5.3466 5.5793 5.5793 6.2179 6.2179 6.8042 6.8042 7.1525 7.1525 8.0517 8.0517 k = 0.1087 0.5435-0.2465 ( 8696 PWs) bands (ev): -3.1671 -3.1671 -3.1504 -3.1504 -3.1347 -3.1347 -3.1200 -3.1200 -3.1181 -3.1181 -3.0835 -3.0835 -3.0785 -3.0785 -3.0658 -3.0658 -3.0591 -3.0591 -3.0454 -3.0454 -3.0174 -3.0174 -3.0025 -3.0025 -1.4973 -1.4973 -1.4770 -1.4770 -1.4166 -1.4166 -1.3833 -1.3833 -1.3613 -1.3613 -1.3417 -1.3417 -1.3263 -1.3263 -1.3062 -1.3062 -1.2772 -1.2772 -1.2341 -1.2341 -1.2128 -1.2128 -1.1690 -1.1690 -1.1542 -1.1542 -1.1248 -1.1248 -1.0981 -1.0981 -1.0366 -1.0366 -0.9876 -0.9876 -0.9475 -0.9475 -0.7131 -0.7131 0.2480 0.2480 0.9371 0.9371 1.6524 1.6524 2.4314 2.4314 2.6656 2.6656 4.5004 4.5004 5.2823 5.2823 5.5367 5.5367 6.1563 6.1563 6.8641 6.8641 7.1441 7.1441 8.0145 8.0145 k = 0.0870 0.5435-0.2465 ( 8696 PWs) bands (ev): -3.1674 -3.1674 -3.1503 -3.1503 -3.1352 -3.1352 -3.1202 -3.1202 -3.1185 -3.1185 -3.0831 -3.0831 -3.0780 -3.0780 -3.0662 -3.0662 -3.0587 -3.0587 -3.0455 -3.0455 -3.0176 -3.0176 -3.0023 -3.0023 -1.4991 -1.4991 -1.4785 -1.4785 -1.4182 -1.4182 -1.3818 -1.3818 -1.3633 -1.3633 -1.3422 -1.3422 -1.3255 -1.3255 -1.3079 -1.3079 -1.2741 -1.2741 -1.2354 -1.2354 -1.2086 -1.2086 -1.1714 -1.1714 -1.1559 -1.1559 -1.1222 -1.1222 -1.0992 -1.0992 -1.0374 -1.0374 -0.9875 -0.9875 -0.9455 -0.9455 -0.7244 -0.7244 0.2389 0.2389 0.9347 0.9347 1.7211 1.7211 2.4170 2.4170 2.6918 2.6918 4.5133 4.5133 5.2305 5.2305 5.5013 5.5013 6.0965 6.0965 6.8980 6.8980 7.1780 7.1780 7.9535 7.9535 k = 0.0652 0.5435-0.2465 ( 8698 PWs) bands (ev): -3.1676 -3.1676 -3.1502 -3.1502 -3.1356 -3.1356 -3.1204 -3.1204 -3.1188 -3.1188 -3.0828 -3.0828 -3.0777 -3.0777 -3.0665 -3.0665 -3.0583 -3.0583 -3.0457 -3.0457 -3.0177 -3.0177 -3.0021 -3.0021 -1.5006 -1.5006 -1.4797 -1.4797 -1.4194 -1.4194 -1.3803 -1.3803 -1.3654 -1.3654 -1.3426 -1.3426 -1.3244 -1.3244 -1.3096 -1.3096 -1.2715 -1.2715 -1.2366 -1.2366 -1.2039 -1.2039 -1.1747 -1.1747 -1.1576 -1.1576 -1.1196 -1.1196 -1.1001 -1.1001 -1.0381 -1.0381 -0.9875 -0.9875 -0.9440 -0.9440 -0.7332 -0.7332 0.2316 0.2316 0.9327 0.9327 1.7808 1.7808 2.4006 2.4006 2.7129 2.7129 4.5240 4.5240 5.1919 5.1919 5.4734 5.4734 6.0439 6.0439 6.9057 6.9057 7.2499 7.2499 7.8745 7.8745 k = 0.0435 0.5435-0.2465 ( 8706 PWs) bands (ev): -3.1678 -3.1678 -3.1500 -3.1500 -3.1360 -3.1360 -3.1206 -3.1206 -3.1190 -3.1190 -3.0826 -3.0826 -3.0774 -3.0774 -3.0667 -3.0667 -3.0580 -3.0580 -3.0458 -3.0458 -3.0177 -3.0177 -3.0019 -3.0019 -1.5017 -1.5017 -1.4806 -1.4806 -1.4203 -1.4203 -1.3788 -1.3788 -1.3673 -1.3673 -1.3429 -1.3429 -1.3231 -1.3231 -1.3112 -1.3112 -1.2694 -1.2694 -1.2377 -1.2377 -1.1989 -1.1989 -1.1787 -1.1787 -1.1588 -1.1588 -1.1173 -1.1173 -1.1009 -1.1009 -1.0386 -1.0386 -0.9875 -0.9875 -0.9428 -0.9428 -0.7395 -0.7395 0.2263 0.2263 0.9313 0.9313 1.8282 1.8282 2.3848 2.3848 2.7285 2.7285 4.5315 4.5315 5.1661 5.1661 5.4532 5.4532 6.0028 6.0028 6.9024 6.9024 7.3411 7.3411 7.7845 7.7845 k = 0.0217 0.5435-0.2465 ( 8722 PWs) bands (ev): -3.1679 -3.1679 -3.1499 -3.1499 -3.1362 -3.1362 -3.1207 -3.1207 -3.1191 -3.1191 -3.0825 -3.0825 -3.0773 -3.0773 -3.0669 -3.0669 -3.0578 -3.0578 -3.0459 -3.0459 -3.0178 -3.0178 -3.0019 -3.0019 -1.5024 -1.5024 -1.4811 -1.4811 -1.4208 -1.4208 -1.3776 -1.3776 -1.3689 -1.3689 -1.3431 -1.3431 -1.3220 -1.3220 -1.3125 -1.3125 -1.2681 -1.2681 -1.2384 -1.2384 -1.1939 -1.1939 -1.1833 -1.1833 -1.1595 -1.1595 -1.1158 -1.1158 -1.1015 -1.1015 -1.0389 -1.0389 -0.9875 -0.9875 -0.9421 -0.9421 -0.7433 -0.7433 0.2231 0.2231 0.9304 0.9304 1.8592 1.8592 2.3730 2.3730 2.7380 2.7380 4.5359 4.5359 5.1516 5.1516 5.4410 5.4410 5.9765 5.9765 6.8979 6.8979 7.4350 7.4350 7.6928 7.6928 k = 0.0000 0.5435-0.2465 ( 8710 PWs) bands (ev): -3.1679 -3.1679 -3.1499 -3.1499 -3.1363 -3.1363 -3.1208 -3.1208 -3.1191 -3.1191 -3.0824 -3.0824 -3.0772 -3.0772 -3.0670 -3.0670 -3.0577 -3.0577 -3.0459 -3.0459 -3.0178 -3.0178 -3.0018 -3.0018 -1.5027 -1.5027 -1.4813 -1.4813 -1.4210 -1.4210 -1.3771 -1.3771 -1.3695 -1.3695 -1.3432 -1.3432 -1.3215 -1.3215 -1.3131 -1.3131 -1.2676 -1.2676 -1.2386 -1.2386 -1.1899 -1.1899 -1.1872 -1.1872 -1.1597 -1.1597 -1.1153 -1.1153 -1.1017 -1.1017 -1.0390 -1.0390 -0.9875 -0.9875 -0.9419 -0.9419 -0.7446 -0.7446 0.2220 0.2220 0.9301 0.9301 1.8701 1.8701 2.3686 2.3686 2.7412 2.7412 4.5373 4.5373 5.1470 5.1470 5.4370 5.4370 5.9675 5.9675 6.8961 6.8961 7.4918 7.4918 7.6368 7.6368 k = 0.0000 0.5435-0.2465 ( 8710 PWs) bands (ev): -3.1679 -3.1679 -3.1499 -3.1499 -3.1363 -3.1363 -3.1208 -3.1208 -3.1191 -3.1191 -3.0824 -3.0824 -3.0772 -3.0772 -3.0670 -3.0670 -3.0577 -3.0577 -3.0459 -3.0459 -3.0178 -3.0178 -3.0018 -3.0018 -1.5027 -1.5027 -1.4813 -1.4813 -1.4210 -1.4210 -1.3771 -1.3771 -1.3695 -1.3695 -1.3432 -1.3432 -1.3215 -1.3215 -1.3131 -1.3131 -1.2676 -1.2676 -1.2386 -1.2386 -1.1899 -1.1899 -1.1872 -1.1872 -1.1597 -1.1597 -1.1153 -1.1153 -1.1017 -1.1017 -1.0390 -1.0390 -0.9875 -0.9875 -0.9419 -0.9419 -0.7446 -0.7446 0.2220 0.2220 0.9301 0.9301 1.8701 1.8701 2.3686 2.3686 2.7412 2.7412 4.5373 4.5373 5.1470 5.1470 5.4370 5.4370 5.9675 5.9675 6.8961 6.8961 7.4918 7.4918 7.6368 7.6368 k = 0.0000 0.5521-0.2276 ( 8708 PWs) bands (ev): -3.1679 -3.1679 -3.1499 -3.1499 -3.1362 -3.1362 -3.1210 -3.1210 -3.1189 -3.1189 -3.0825 -3.0825 -3.0771 -3.0771 -3.0670 -3.0670 -3.0578 -3.0578 -3.0459 -3.0459 -3.0178 -3.0178 -3.0019 -3.0019 -1.5024 -1.5024 -1.4812 -1.4812 -1.4209 -1.4209 -1.3776 -1.3776 -1.3691 -1.3691 -1.3431 -1.3431 -1.3218 -1.3218 -1.3127 -1.3127 -1.2678 -1.2678 -1.2384 -1.2384 -1.1906 -1.1906 -1.1865 -1.1865 -1.1598 -1.1598 -1.1153 -1.1153 -1.1014 -1.1014 -1.0390 -1.0390 -0.9876 -0.9876 -0.9420 -0.9420 -0.7435 -0.7435 0.2231 0.2231 0.9224 0.9224 1.8750 1.8750 2.3689 2.3689 2.7398 2.7398 4.5442 4.5442 5.1426 5.1426 5.4379 5.4379 5.9599 5.9599 6.8936 6.8936 7.4996 7.4996 7.6459 7.6459 k = 0.0000 0.5606-0.2086 ( 8702 PWs) bands (ev): -3.1679 -3.1679 -3.1499 -3.1499 -3.1362 -3.1362 -3.1215 -3.1215 -3.1183 -3.1183 -3.0829 -3.0829 -3.0768 -3.0768 -3.0670 -3.0670 -3.0579 -3.0579 -3.0458 -3.0458 -3.0178 -3.0178 -3.0019 -3.0019 -1.5017 -1.5017 -1.4811 -1.4811 -1.4209 -1.4209 -1.3790 -1.3790 -1.3680 -1.3680 -1.3430 -1.3430 -1.3226 -1.3226 -1.3117 -1.3117 -1.2683 -1.2683 -1.2377 -1.2377 -1.1920 -1.1920 -1.1851 -1.1851 -1.1599 -1.1599 -1.1155 -1.1155 -1.1008 -1.1008 -1.0389 -1.0389 -0.9878 -0.9878 -0.9422 -0.9422 -0.7404 -0.7404 0.2265 0.2265 0.8998 0.8998 1.8894 1.8894 2.3701 2.3701 2.7357 2.7357 4.5649 4.5649 5.1295 5.1295 5.4409 5.4409 5.9378 5.9378 6.8860 6.8860 7.5231 7.5231 7.6725 7.6725 k = 0.0000 0.5692-0.1897 ( 8688 PWs) bands (ev): -3.1680 -3.1680 -3.1500 -3.1500 -3.1360 -3.1360 -3.1221 -3.1221 -3.1176 -3.1176 -3.0834 -3.0834 -3.0764 -3.0764 -3.0671 -3.0671 -3.0581 -3.0581 -3.0457 -3.0457 -3.0178 -3.0178 -3.0020 -3.0020 -1.5006 -1.5006 -1.4807 -1.4807 -1.4207 -1.4207 -1.3808 -1.3808 -1.3668 -1.3668 -1.3429 -1.3429 -1.3236 -1.3236 -1.3104 -1.3104 -1.2691 -1.2691 -1.2366 -1.2366 -1.1936 -1.1936 -1.1836 -1.1836 -1.1600 -1.1600 -1.1157 -1.1157 -1.0997 -1.0997 -1.0387 -1.0387 -0.9881 -0.9881 -0.9425 -0.9425 -0.7352 -0.7352 0.2321 0.2321 0.8640 0.8640 1.9118 1.9118 2.3720 2.3720 2.7289 2.7289 4.5988 4.5988 5.1084 5.1084 5.4459 5.4459 5.9031 5.9031 6.8734 6.8734 7.5611 7.5611 7.7146 7.7146 k = 0.0000 0.5778-0.1708 ( 8680 PWs) bands (ev): -3.1681 -3.1681 -3.1500 -3.1500 -3.1358 -3.1358 -3.1226 -3.1226 -3.1168 -3.1168 -3.0840 -3.0840 -3.0760 -3.0760 -3.0671 -3.0671 -3.0584 -3.0584 -3.0455 -3.0455 -3.0177 -3.0177 -3.0021 -3.0021 -1.4991 -1.4991 -1.4803 -1.4803 -1.4206 -1.4206 -1.3827 -1.3827 -1.3656 -1.3656 -1.3429 -1.3429 -1.3246 -1.3246 -1.3090 -1.3090 -1.2701 -1.2701 -1.2351 -1.2351 -1.1954 -1.1954 -1.1821 -1.1821 -1.1601 -1.1601 -1.1160 -1.1160 -1.0984 -1.0984 -1.0384 -1.0384 -0.9885 -0.9885 -0.9429 -0.9429 -0.7278 -0.7278 0.2399 0.2399 0.8170 0.8170 1.9403 1.9403 2.3745 2.3745 2.7197 2.7197 4.6455 4.6455 5.0800 5.0800 5.4532 5.4532 5.8586 5.8586 6.8561 6.8561 7.6119 7.6119 7.7693 7.7693 k = 0.0000 0.5864-0.1518 ( 8689 PWs) bands (ev): -3.1682 -3.1682 -3.1501 -3.1501 -3.1356 -3.1356 -3.1232 -3.1232 -3.1160 -3.1160 -3.0847 -3.0847 -3.0755 -3.0755 -3.0673 -3.0673 -3.0587 -3.0587 -3.0453 -3.0453 -3.0177 -3.0177 -3.0022 -3.0022 -1.4974 -1.4974 -1.4796 -1.4796 -1.4204 -1.4204 -1.3847 -1.3847 -1.3645 -1.3645 -1.3429 -1.3429 -1.3253 -1.3253 -1.3076 -1.3076 -1.2712 -1.2712 -1.2334 -1.2334 -1.1972 -1.1972 -1.1804 -1.1804 -1.1601 -1.1601 -1.1165 -1.1165 -1.0969 -1.0969 -1.0381 -1.0381 -0.9890 -0.9890 -0.9434 -0.9434 -0.7184 -0.7184 0.2499 0.2499 0.7609 0.7609 1.9731 1.9731 2.3777 2.3777 2.7083 2.7083 4.7041 4.7041 5.0455 5.0455 5.4627 5.4627 5.8069 5.8069 6.8349 6.8349 7.6722 7.6722 7.8335 7.8335 k = 0.0000 0.5950-0.1329 ( 8695 PWs) bands (ev): -3.1683 -3.1683 -3.1502 -3.1502 -3.1354 -3.1354 -3.1237 -3.1237 -3.1152 -3.1152 -3.0855 -3.0855 -3.0751 -3.0751 -3.0674 -3.0674 -3.0590 -3.0590 -3.0450 -3.0450 -3.0177 -3.0177 -3.0023 -3.0023 -1.4956 -1.4956 -1.4786 -1.4786 -1.4202 -1.4202 -1.3865 -1.3865 -1.3634 -1.3634 -1.3432 -1.3432 -1.3257 -1.3257 -1.3064 -1.3064 -1.2724 -1.2724 -1.2315 -1.2315 -1.1991 -1.1991 -1.1787 -1.1787 -1.1598 -1.1598 -1.1170 -1.1170 -1.0953 -1.0953 -1.0377 -1.0377 -0.9896 -0.9896 -0.9440 -0.9440 -0.7068 -0.7068 0.2620 0.2620 0.6977 0.6977 2.0086 2.0086 2.3815 2.3815 2.6948 2.6948 4.7734 4.7734 5.0065 5.0065 5.4741 5.4741 5.7511 5.7511 6.8106 6.8106 7.7381 7.7381 7.9033 7.9033 k = 0.0000 0.6036-0.1139 ( 8695 PWs) bands (ev): -3.1684 -3.1684 -3.1503 -3.1503 -3.1352 -3.1352 -3.1241 -3.1241 -3.1144 -3.1144 -3.0862 -3.0862 -3.0748 -3.0748 -3.0677 -3.0677 -3.0592 -3.0592 -3.0447 -3.0447 -3.0176 -3.0176 -3.0025 -3.0025 -1.4939 -1.4939 -1.4773 -1.4773 -1.4200 -1.4200 -1.3882 -1.3882 -1.3626 -1.3626 -1.3435 -1.3435 -1.3259 -1.3259 -1.3054 -1.3054 -1.2737 -1.2737 -1.2295 -1.2295 -1.2009 -1.2009 -1.1769 -1.1769 -1.1592 -1.1592 -1.1176 -1.1176 -1.0936 -1.0936 -1.0372 -1.0372 -0.9903 -0.9903 -0.9446 -0.9446 -0.6930 -0.6930 0.2763 0.2763 0.6291 0.6291 2.0455 2.0455 2.3857 2.3857 2.6795 2.6795 4.8514 4.8514 4.9654 4.9654 5.4865 5.4865 5.6943 5.6943 6.7843 6.7843 7.8039 7.8039 7.9740 7.9740 k = 0.0000 0.6122-0.0950 ( 8696 PWs) bands (ev): -3.1686 -3.1686 -3.1503 -3.1503 -3.1350 -3.1350 -3.1245 -3.1245 -3.1135 -3.1135 -3.0870 -3.0870 -3.0745 -3.0745 -3.0679 -3.0679 -3.0594 -3.0594 -3.0443 -3.0443 -3.0175 -3.0175 -3.0027 -3.0027 -1.4925 -1.4925 -1.4756 -1.4756 -1.4198 -1.4198 -1.3896 -1.3896 -1.3621 -1.3621 -1.3438 -1.3438 -1.3259 -1.3259 -1.3044 -1.3044 -1.2750 -1.2750 -1.2277 -1.2277 -1.2025 -1.2025 -1.1751 -1.1751 -1.1583 -1.1583 -1.1183 -1.1183 -1.0919 -1.0919 -1.0367 -1.0367 -0.9911 -0.9911 -0.9451 -0.9451 -0.6770 -0.6770 0.2926 0.2926 0.5564 0.5564 2.0828 2.0828 2.3903 2.3903 2.6625 2.6625 4.9059 4.9059 4.9545 4.9545 5.4969 5.4969 5.6412 5.6412 6.7571 6.7571 7.8616 7.8616 8.0403 8.0403 k = 0.0000 0.6208-0.0760 ( 8691 PWs) bands (ev): -3.1688 -3.1688 -3.1504 -3.1504 -3.1349 -3.1349 -3.1247 -3.1247 -3.1127 -3.1127 -3.0879 -3.0879 -3.0743 -3.0743 -3.0683 -3.0683 -3.0595 -3.0595 -3.0439 -3.0439 -3.0174 -3.0174 -3.0030 -3.0030 -1.4915 -1.4915 -1.4735 -1.4735 -1.4196 -1.4196 -1.3907 -1.3907 -1.3619 -1.3619 -1.3439 -1.3439 -1.3257 -1.3257 -1.3036 -1.3036 -1.2763 -1.2763 -1.2263 -1.2263 -1.2037 -1.2037 -1.1732 -1.1732 -1.1571 -1.1571 -1.1192 -1.1192 -1.0904 -1.0904 -1.0362 -1.0362 -0.9921 -0.9921 -0.9456 -0.9456 -0.6586 -0.6586 0.3109 0.3109 0.4810 0.4810 2.1197 2.1197 2.3951 2.3951 2.6440 2.6440 4.8687 4.8687 5.0418 5.0418 5.4957 5.4957 5.6036 5.6036 6.7299 6.7299 7.9007 7.9007 8.0980 8.0980 k = 0.0000 0.6294-0.0571 ( 8686 PWs) bands (ev): -3.1690 -3.1690 -3.1504 -3.1504 -3.1348 -3.1348 -3.1249 -3.1249 -3.1118 -3.1118 -3.0887 -3.0887 -3.0742 -3.0742 -3.0686 -3.0686 -3.0594 -3.0594 -3.0435 -3.0435 -3.0173 -3.0173 -3.0033 -3.0033 -1.4908 -1.4908 -1.4711 -1.4711 -1.4196 -1.4196 -1.3915 -1.3915 -1.3621 -1.3621 -1.3438 -1.3438 -1.3254 -1.3254 -1.3029 -1.3029 -1.2776 -1.2776 -1.2256 -1.2256 -1.2041 -1.2041 -1.1713 -1.1713 -1.1554 -1.1554 -1.1202 -1.1202 -1.0889 -1.0889 -1.0357 -1.0357 -0.9931 -0.9931 -0.9460 -0.9460 -0.6379 -0.6379 0.3307 0.3307 0.4040 0.4040 2.1557 2.1557 2.3999 2.3999 2.6241 2.6241 4.8247 4.8247 5.1413 5.1413 5.4687 5.4687 5.5977 5.5977 6.7038 6.7038 7.9124 7.9124 8.1457 8.1457 k = 0.0000 0.6380-0.0382 ( 8698 PWs) bands (ev): -3.1692 -3.1692 -3.1504 -3.1504 -3.1348 -3.1348 -3.1250 -3.1250 -3.1110 -3.1110 -3.0896 -3.0896 -3.0742 -3.0742 -3.0689 -3.0689 -3.0593 -3.0593 -3.0431 -3.0431 -3.0172 -3.0172 -3.0036 -3.0036 -1.4905 -1.4905 -1.4684 -1.4684 -1.4196 -1.4196 -1.3919 -1.3919 -1.3628 -1.3628 -1.3434 -1.3434 -1.3250 -1.3250 -1.3023 -1.3023 -1.2789 -1.2789 -1.2257 -1.2257 -1.2037 -1.2037 -1.1694 -1.1694 -1.1535 -1.1535 -1.1212 -1.1212 -1.0875 -1.0875 -1.0352 -1.0352 -0.9943 -0.9943 -0.9463 -0.9463 -0.6148 -0.6148 0.3209 0.3209 0.3573 0.3573 2.1904 2.1904 2.4047 2.4047 2.6027 2.6027 4.7818 4.7818 5.2411 5.2411 5.4283 5.4283 5.6159 5.6159 6.6799 6.6799 7.8975 7.8975 8.1793 8.1793 k = 0.0000 0.6466-0.0192 ( 8689 PWs) bands (ev): -3.1694 -3.1694 -3.1503 -3.1503 -3.1349 -3.1349 -3.1250 -3.1250 -3.1101 -3.1101 -3.0905 -3.0905 -3.0744 -3.0744 -3.0692 -3.0692 -3.0591 -3.0591 -3.0426 -3.0426 -3.0170 -3.0170 -3.0039 -3.0039 -1.4906 -1.4906 -1.4657 -1.4657 -1.4196 -1.4196 -1.3921 -1.3921 -1.3639 -1.3639 -1.3427 -1.3427 -1.3245 -1.3245 -1.3018 -1.3018 -1.2801 -1.2801 -1.2266 -1.2266 -1.2024 -1.2024 -1.1676 -1.1676 -1.1512 -1.1512 -1.1223 -1.1223 -1.0862 -1.0862 -1.0349 -1.0349 -0.9955 -0.9955 -0.9465 -0.9465 -0.5892 -0.5892 0.2436 0.2436 0.3795 0.3795 2.2235 2.2235 2.4092 2.4092 2.5801 2.5801 4.7414 4.7414 5.3134 5.3134 5.4123 5.4123 5.6468 5.6468 6.6594 6.6594 7.8638 7.8638 8.1913 8.1913 k = 0.0000 0.6552-0.0003 ( 8692 PWs) bands (ev): -3.1697 -3.1697 -3.1503 -3.1503 -3.1350 -3.1350 -3.1249 -3.1249 -3.1093 -3.1093 -3.0914 -3.0914 -3.0747 -3.0747 -3.0694 -3.0694 -3.0588 -3.0588 -3.0421 -3.0421 -3.0168 -3.0168 -3.0043 -3.0043 -1.4909 -1.4909 -1.4630 -1.4630 -1.4196 -1.4196 -1.3921 -1.3921 -1.3653 -1.3653 -1.3420 -1.3420 -1.3239 -1.3239 -1.3014 -1.3014 -1.2811 -1.2811 -1.2281 -1.2281 -1.2004 -1.2004 -1.1659 -1.1659 -1.1487 -1.1487 -1.1235 -1.1235 -1.0852 -1.0852 -1.0347 -1.0347 -0.9969 -0.9969 -0.9464 -0.9464 -0.5609 -0.5609 0.1643 0.1643 0.4054 0.4054 2.2546 2.2546 2.4132 2.4132 2.5562 2.5562 4.7045 4.7045 5.2994 5.2994 5.4789 5.4789 5.6897 5.6897 6.6436 6.6436 7.8191 7.8191 8.1783 8.1783 k = 0.0000 0.6638 0.0187 ( 8700 PWs) bands (ev): -3.1699 -3.1699 -3.1503 -3.1503 -3.1352 -3.1352 -3.1247 -3.1247 -3.1084 -3.1084 -3.0924 -3.0924 -3.0751 -3.0751 -3.0695 -3.0695 -3.0584 -3.0584 -3.0416 -3.0416 -3.0166 -3.0166 -3.0047 -3.0047 -1.4916 -1.4916 -1.4603 -1.4603 -1.4195 -1.4195 -1.3920 -1.3920 -1.3669 -1.3669 -1.3412 -1.3412 -1.3231 -1.3231 -1.3011 -1.3011 -1.2821 -1.2821 -1.2300 -1.2300 -1.1979 -1.1979 -1.1643 -1.1643 -1.1462 -1.1462 -1.1245 -1.1245 -1.0842 -1.0842 -1.0348 -1.0348 -0.9983 -0.9983 -0.9463 -0.9463 -0.5300 -0.5300 0.0853 0.0853 0.4331 0.4331 2.2834 2.2834 2.4165 2.4165 2.5312 2.5312 4.6720 4.6720 5.2598 5.2598 5.5601 5.5601 5.7498 5.7498 6.6343 6.6343 7.7689 7.7689 8.1443 8.1443 k = 0.0000 0.6723 0.0376 ( 8702 PWs) bands (ev): -3.1702 -3.1702 -3.1502 -3.1502 -3.1353 -3.1353 -3.1245 -3.1245 -3.1076 -3.1076 -3.0934 -3.0934 -3.0755 -3.0755 -3.0695 -3.0695 -3.0580 -3.0580 -3.0411 -3.0411 -3.0164 -3.0164 -3.0051 -3.0051 -1.4925 -1.4925 -1.4579 -1.4579 -1.4194 -1.4194 -1.3919 -1.3919 -1.3685 -1.3685 -1.3406 -1.3406 -1.3222 -1.3222 -1.3008 -1.3008 -1.2828 -1.2828 -1.2320 -1.2320 -1.1953 -1.1953 -1.1626 -1.1626 -1.1440 -1.1440 -1.1253 -1.1253 -1.0835 -1.0835 -1.0351 -1.0351 -0.9997 -0.9997 -0.9460 -0.9460 -0.4964 -0.4964 0.0071 0.0071 0.4626 0.4626 2.3098 2.3098 2.4185 2.4185 2.5057 2.5057 4.6446 4.6446 5.2204 5.2204 5.6251 5.6251 5.8294 5.8294 6.6337 6.6337 7.7168 7.7168 8.0959 8.0959 k = 0.0000 0.6809 0.0565 ( 8700 PWs) bands (ev): -3.1704 -3.1704 -3.1502 -3.1502 -3.1355 -3.1355 -3.1241 -3.1241 -3.1069 -3.1069 -3.0944 -3.0944 -3.0759 -3.0759 -3.0696 -3.0696 -3.0577 -3.0577 -3.0406 -3.0406 -3.0161 -3.0161 -3.0056 -3.0056 -1.4937 -1.4937 -1.4555 -1.4555 -1.4191 -1.4191 -1.3918 -1.3918 -1.3701 -1.3701 -1.3403 -1.3403 -1.3213 -1.3213 -1.3007 -1.3007 -1.2833 -1.2833 -1.2339 -1.2339 -1.1926 -1.1926 -1.1609 -1.1609 -1.1424 -1.1424 -1.1255 -1.1255 -1.0830 -1.0830 -1.0358 -1.0358 -1.0010 -1.0010 -0.9457 -0.9457 -0.4600 -0.4600 -0.0699 -0.0699 0.4936 0.4936 2.3331 2.3331 2.4182 2.4182 2.4809 2.4809 4.6228 4.6228 5.1848 5.1848 5.6750 5.6750 5.9200 5.9200 6.6448 6.6448 7.6657 7.6657 8.0391 8.0391 k = 0.5000 0.4060 0.5496 ( 8690 PWs) bands (ev): -3.1481 -3.1481 -3.1450 -3.1450 -3.1344 -3.1344 -3.1264 -3.1264 -3.1028 -3.1028 -3.1010 -3.1010 -3.0847 -3.0847 -3.0657 -3.0657 -3.0514 -3.0514 -3.0500 -3.0500 -3.0158 -3.0158 -3.0102 -3.0102 -1.4803 -1.4803 -1.4629 -1.4629 -1.3907 -1.3907 -1.3856 -1.3856 -1.3580 -1.3580 -1.3525 -1.3525 -1.3181 -1.3181 -1.3033 -1.3033 -1.2600 -1.2600 -1.2365 -1.2365 -1.2044 -1.2044 -1.1721 -1.1721 -1.1262 -1.1262 -1.1048 -1.1048 -1.0777 -1.0777 -1.0604 -1.0604 -1.0062 -1.0062 -0.9497 -0.9497 0.1429 0.1429 0.1529 0.1529 0.6707 0.6707 0.6809 0.6809 1.9020 1.9020 1.9154 1.9154 5.7790 5.7790 5.8264 5.8264 6.4823 6.4823 6.4874 6.4874 7.2907 7.2907 7.3589 7.3589 8.3329 8.3329 k = 0.5000 0.3846 0.5496 ( 8688 PWs) bands (ev): -3.1467 -3.1467 -3.1441 -3.1441 -3.1351 -3.1351 -3.1262 -3.1262 -3.1033 -3.1033 -3.1007 -3.1007 -3.0852 -3.0852 -3.0664 -3.0664 -3.0507 -3.0507 -3.0499 -3.0499 -3.0158 -3.0158 -3.0103 -3.0103 -1.4810 -1.4810 -1.4647 -1.4647 -1.3901 -1.3901 -1.3864 -1.3864 -1.3555 -1.3555 -1.3541 -1.3541 -1.3188 -1.3188 -1.3039 -1.3039 -1.2617 -1.2617 -1.2404 -1.2404 -1.2034 -1.2034 -1.1689 -1.1689 -1.1239 -1.1239 -1.1026 -1.1026 -1.0789 -1.0789 -1.0616 -1.0616 -1.0048 -1.0048 -0.9528 -0.9528 0.1191 0.1191 0.1283 0.1283 0.6981 0.6981 0.7100 0.7100 1.8975 1.8975 1.9110 1.9110 5.8518 5.8518 5.8979 5.8979 6.5447 6.5447 6.5576 6.5576 7.1591 7.1591 7.2338 7.2338 8.3000 8.3000 k = 0.5000 0.3632 0.5496 ( 8690 PWs) bands (ev): -3.1457 -3.1457 -3.1435 -3.1435 -3.1353 -3.1353 -3.1257 -3.1257 -3.1038 -3.1038 -3.1004 -3.1004 -3.0856 -3.0856 -3.0672 -3.0672 -3.0500 -3.0500 -3.0499 -3.0499 -3.0158 -3.0158 -3.0105 -3.0105 -1.4816 -1.4816 -1.4667 -1.4667 -1.3897 -1.3897 -1.3873 -1.3873 -1.3562 -1.3562 -1.3531 -1.3531 -1.3188 -1.3188 -1.3047 -1.3047 -1.2630 -1.2630 -1.2442 -1.2442 -1.2021 -1.2021 -1.1658 -1.1658 -1.1219 -1.1219 -1.1014 -1.1014 -1.0799 -1.0799 -1.0626 -1.0626 -1.0032 -1.0032 -0.9563 -0.9563 0.0912 0.0912 0.0996 0.0996 0.7279 0.7279 0.7412 0.7412 1.9005 1.9005 1.9140 1.9140 5.9251 5.9251 5.9704 5.9704 6.5943 6.5943 6.6148 6.6148 7.0427 7.0427 7.1237 7.1237 8.2652 8.2652 k = 0.5000 0.3419 0.5496 ( 8696 PWs) bands (ev): -3.1452 -3.1452 -3.1432 -3.1432 -3.1350 -3.1350 -3.1249 -3.1249 -3.1043 -3.1043 -3.1001 -3.1001 -3.0859 -3.0859 -3.0680 -3.0680 -3.0499 -3.0499 -3.0493 -3.0493 -3.0157 -3.0157 -3.0106 -3.0106 -1.4821 -1.4821 -1.4688 -1.4688 -1.3893 -1.3893 -1.3884 -1.3884 -1.3586 -1.3586 -1.3510 -1.3510 -1.3182 -1.3182 -1.3055 -1.3055 -1.2641 -1.2641 -1.2480 -1.2480 -1.2003 -1.2003 -1.1627 -1.1627 -1.1206 -1.1206 -1.1013 -1.1013 -1.0804 -1.0804 -1.0633 -1.0633 -1.0014 -1.0014 -0.9603 -0.9603 0.0615 0.0615 0.0690 0.0690 0.7571 0.7571 0.7714 0.7714 1.9120 1.9120 1.9252 1.9252 5.9959 5.9959 6.0415 6.0415 6.6166 6.6166 6.6368 6.6368 6.9662 6.9662 7.0464 7.0464 8.2304 8.2304 k = 0.5000 0.3205 0.5496 ( 8698 PWs) bands (ev): -3.1452 -3.1452 -3.1433 -3.1433 -3.1341 -3.1341 -3.1238 -3.1238 -3.1048 -3.1048 -3.0997 -3.0997 -3.0861 -3.0861 -3.0687 -3.0687 -3.0500 -3.0500 -3.0487 -3.0487 -3.0156 -3.0156 -3.0107 -3.0107 -1.4825 -1.4825 -1.4711 -1.4711 -1.3897 -1.3897 -1.3890 -1.3890 -1.3611 -1.3611 -1.3493 -1.3493 -1.3170 -1.3170 -1.3059 -1.3059 -1.2650 -1.2650 -1.2516 -1.2516 -1.1981 -1.1981 -1.1598 -1.1598 -1.1199 -1.1199 -1.1022 -1.1022 -1.0805 -1.0805 -1.0638 -1.0638 -0.9994 -0.9994 -0.9646 -0.9646 0.0313 0.0313 0.0382 0.0382 0.7834 0.7834 0.7983 0.7983 1.9325 1.9325 1.9451 1.9451 6.0583 6.0583 6.1054 6.1054 6.5976 6.5976 6.5988 6.5988 6.9598 6.9598 7.0220 7.0220 8.1970 8.1970 k = 0.5000 0.2991 0.5496 ( 8706 PWs) bands (ev): -3.1456 -3.1456 -3.1436 -3.1436 -3.1328 -3.1328 -3.1226 -3.1226 -3.1051 -3.1051 -3.0994 -3.0994 -3.0862 -3.0862 -3.0695 -3.0695 -3.0502 -3.0502 -3.0481 -3.0481 -3.0154 -3.0154 -3.0108 -3.0108 -1.4829 -1.4829 -1.4733 -1.4733 -1.3912 -1.3912 -1.3887 -1.3887 -1.3635 -1.3635 -1.3483 -1.3483 -1.3154 -1.3154 -1.3057 -1.3057 -1.2655 -1.2655 -1.2550 -1.2550 -1.1954 -1.1954 -1.1572 -1.1572 -1.1200 -1.1200 -1.1039 -1.1039 -1.0800 -1.0800 -1.0641 -1.0641 -0.9973 -0.9973 -0.9693 -0.9693 0.0017 0.0017 0.0079 0.0079 0.8056 0.8056 0.8208 0.8208 1.9622 1.9622 1.9740 1.9740 6.0990 6.0990 6.1471 6.1471 6.5340 6.5340 6.5542 6.5542 7.0052 7.0052 7.0464 7.0464 8.1662 8.1662 k = 0.5000 0.2778 0.5496 ( 8696 PWs) bands (ev): -3.1463 -3.1463 -3.1441 -3.1441 -3.1311 -3.1311 -3.1213 -3.1213 -3.1054 -3.1054 -3.0991 -3.0991 -3.0861 -3.0861 -3.0701 -3.0701 -3.0504 -3.0504 -3.0476 -3.0476 -3.0151 -3.0151 -3.0110 -3.0110 -1.4831 -1.4831 -1.4757 -1.4757 -1.3929 -1.3929 -1.3884 -1.3884 -1.3658 -1.3658 -1.3481 -1.3481 -1.3136 -1.3136 -1.3047 -1.3047 -1.2659 -1.2659 -1.2580 -1.2580 -1.1923 -1.1923 -1.1549 -1.1549 -1.1208 -1.1208 -1.1062 -1.1062 -1.0791 -1.0791 -1.0644 -1.0644 -0.9950 -0.9950 -0.9744 -0.9744 -0.0266 -0.0266 -0.0211 -0.0211 0.8231 0.8231 0.8382 0.8382 2.0008 2.0008 2.0116 2.0116 6.0960 6.0960 6.1367 6.1367 6.5036 6.5036 6.5304 6.5304 7.0702 7.0702 7.0976 7.0976 8.1393 8.1393 k = 0.5000 0.2564 0.5496 ( 8696 PWs) bands (ev): -3.1472 -3.1472 -3.1448 -3.1448 -3.1293 -3.1293 -3.1200 -3.1200 -3.1055 -3.1055 -3.0989 -3.0989 -3.0859 -3.0859 -3.0707 -3.0707 -3.0506 -3.0506 -3.0472 -3.0472 -3.0149 -3.0149 -3.0110 -3.0110 -1.4832 -1.4832 -1.4781 -1.4781 -1.3948 -1.3948 -1.3881 -1.3881 -1.3680 -1.3680 -1.3488 -1.3488 -1.3115 -1.3115 -1.3029 -1.3029 -1.2661 -1.2661 -1.2607 -1.2607 -1.1889 -1.1889 -1.1534 -1.1534 -1.1221 -1.1221 -1.1086 -1.1086 -1.0778 -1.0778 -1.0648 -1.0648 -0.9926 -0.9926 -0.9798 -0.9798 -0.0534 -0.0534 -0.0485 -0.0485 0.8358 0.8358 0.8506 0.8506 2.0477 2.0477 2.0571 2.0571 6.0384 6.0384 6.0634 6.0634 6.5317 6.5317 6.5519 6.5519 7.1407 7.1407 7.1601 7.1601 8.1175 8.1175 k = 0.5000 0.2350 0.5496 ( 8698 PWs) bands (ev): -3.1481 -3.1481 -3.1456 -3.1456 -3.1274 -3.1274 -3.1189 -3.1189 -3.1054 -3.1054 -3.0987 -3.0987 -3.0856 -3.0856 -3.0711 -3.0711 -3.0509 -3.0509 -3.0469 -3.0469 -3.0146 -3.0146 -3.0111 -3.0111 -1.4833 -1.4833 -1.4806 -1.4806 -1.3968 -1.3968 -1.3877 -1.3877 -1.3701 -1.3701 -1.3503 -1.3503 -1.3093 -1.3093 -1.3003 -1.3003 -1.2662 -1.2662 -1.2629 -1.2629 -1.1852 -1.1852 -1.1527 -1.1527 -1.1238 -1.1238 -1.1107 -1.1107 -1.0762 -1.0762 -1.0654 -1.0654 -0.9902 -0.9902 -0.9855 -0.9855 -0.0783 -0.0783 -0.0740 -0.0740 0.8441 0.8441 0.8583 0.8583 2.1016 2.1016 2.1096 2.1096 5.9440 5.9440 5.9560 5.9560 6.5941 6.5941 6.6074 6.6074 7.2110 7.2110 7.2265 7.2265 8.1023 8.1038 k = 0.5000 0.2137 0.5496 ( 8692 PWs) bands (ev): -3.1490 -3.1490 -3.1464 -3.1464 -3.1255 -3.1255 -3.1179 -3.1179 -3.1051 -3.1051 -3.0987 -3.0987 -3.0852 -3.0852 -3.0714 -3.0714 -3.0513 -3.0513 -3.0467 -3.0467 -3.0143 -3.0143 -3.0112 -3.0112 -1.4834 -1.4834 -1.4831 -1.4831 -1.3987 -1.3987 -1.3873 -1.3873 -1.3722 -1.3722 -1.3523 -1.3523 -1.3071 -1.3071 -1.2972 -1.2972 -1.2662 -1.2662 -1.2644 -1.2644 -1.1813 -1.1813 -1.1532 -1.1532 -1.1256 -1.1256 -1.1121 -1.1121 -1.0746 -1.0746 -1.0662 -1.0662 -0.9915 -0.9915 -0.9878 -0.9878 -0.1011 -0.1011 -0.0974 -0.0974 0.8486 0.8486 0.8622 0.8622 2.1612 2.1612 2.1676 2.1676 5.8334 5.8334 5.8370 5.8370 6.6702 6.6702 6.6794 6.6794 7.2776 7.2776 7.2928 7.2928 8.0924 8.0924 k = 0.5000 0.1923 0.5496 ( 8696 PWs) bands (ev): -3.1499 -3.1499 -3.1473 -3.1473 -3.1236 -3.1236 -3.1172 -3.1172 -3.1046 -3.1046 -3.0988 -3.0988 -3.0847 -3.0847 -3.0716 -3.0716 -3.0516 -3.0516 -3.0466 -3.0466 -3.0139 -3.0139 -3.0112 -3.0112 -1.4855 -1.4855 -1.4834 -1.4834 -1.4005 -1.4005 -1.3869 -1.3869 -1.3743 -1.3743 -1.3546 -1.3546 -1.3049 -1.3049 -1.2937 -1.2937 -1.2661 -1.2661 -1.2653 -1.2653 -1.1775 -1.1775 -1.1550 -1.1550 -1.1272 -1.1272 -1.1125 -1.1125 -1.0732 -1.0732 -1.0673 -1.0673 -0.9976 -0.9976 -0.9855 -0.9855 -0.1218 -0.1218 -0.1187 -0.1187 0.8501 0.8501 0.8630 0.8630 2.2247 2.2247 2.2295 2.2295 5.7161 5.7161 5.7179 5.7179 6.7513 6.7513 6.7578 6.7578 7.3378 7.3378 7.3563 7.3563 8.0894 8.0894 k = 0.5000 0.1709 0.5496 ( 8700 PWs) bands (ev): -3.1508 -3.1508 -3.1482 -3.1482 -3.1217 -3.1217 -3.1167 -3.1167 -3.1041 -3.1041 -3.0991 -3.0991 -3.0840 -3.0840 -3.0717 -3.0717 -3.0520 -3.0520 -3.0465 -3.0465 -3.0136 -3.0136 -3.0112 -3.0112 -1.4879 -1.4879 -1.4834 -1.4834 -1.4019 -1.4019 -1.3863 -1.3863 -1.3766 -1.3766 -1.3571 -1.3571 -1.3030 -1.3030 -1.2900 -1.2900 -1.2660 -1.2660 -1.2653 -1.2653 -1.1738 -1.1738 -1.1581 -1.1581 -1.1284 -1.1284 -1.1118 -1.1118 -1.0719 -1.0719 -1.0687 -1.0687 -1.0038 -1.0038 -0.9833 -0.9833 -0.1403 -0.1403 -0.1377 -0.1377 0.8494 0.8494 0.8616 0.8616 2.2903 2.2903 2.2936 2.2936 5.5981 5.5981 5.6036 5.6036 6.8332 6.8332 6.8373 6.8373 7.3893 7.3893 7.4148 7.4148 8.0964 8.0964 k = 0.5000 0.1496 0.5496 ( 8698 PWs) bands (ev): -3.1516 -3.1516 -3.1490 -3.1490 -3.1199 -3.1199 -3.1164 -3.1164 -3.1034 -3.1034 -3.0995 -3.0995 -3.0832 -3.0832 -3.0716 -3.0716 -3.0524 -3.0524 -3.0466 -3.0466 -3.0133 -3.0133 -3.0112 -3.0112 -1.4901 -1.4901 -1.4835 -1.4835 -1.4030 -1.4030 -1.3856 -1.3856 -1.3790 -1.3790 -1.3597 -1.3597 -1.3015 -1.3015 -1.2864 -1.2864 -1.2658 -1.2658 -1.2646 -1.2646 -1.1708 -1.1708 -1.1621 -1.1621 -1.1286 -1.1286 -1.1103 -1.1103 -1.0711 -1.0711 -1.0703 -1.0703 -1.0099 -1.0099 -0.9813 -0.9813 -0.1565 -0.1565 -0.1545 -0.1545 0.8471 0.8471 0.8587 0.8587 2.3560 2.3560 2.3579 2.3579 5.4858 5.4858 5.4939 5.4939 6.9134 6.9134 6.9145 6.9145 7.4306 7.4306 7.4666 7.4666 8.1150 8.1150 k = 0.5000 0.1282 0.5496 ( 8684 PWs) bands (ev): -3.1523 -3.1523 -3.1497 -3.1497 -3.1182 -3.1182 -3.1162 -3.1162 -3.1028 -3.1028 -3.1001 -3.1001 -3.0824 -3.0824 -3.0715 -3.0715 -3.0528 -3.0528 -3.0468 -3.0468 -3.0131 -3.0131 -3.0111 -3.0111 -1.4922 -1.4922 -1.4835 -1.4835 -1.4036 -1.4036 -1.3848 -1.3848 -1.3815 -1.3815 -1.3623 -1.3623 -1.3002 -1.3002 -1.2829 -1.2829 -1.2657 -1.2657 -1.2630 -1.2630 -1.1686 -1.1686 -1.1668 -1.1668 -1.1276 -1.1276 -1.1083 -1.1083 -1.0722 -1.0722 -1.0708 -1.0708 -1.0157 -1.0157 -0.9795 -0.9795 -0.1706 -0.1706 -0.1689 -0.1689 0.8439 0.8439 0.8549 0.8549 2.4200 2.4200 2.4204 2.4204 5.3816 5.3816 5.3918 5.3918 6.9867 6.9867 6.9897 6.9897 7.4611 7.4611 7.5106 7.5106 8.1464 8.1464 k = 0.5000 0.1068 0.5496 ( 8694 PWs) bands (ev): -3.1529 -3.1529 -3.1504 -3.1504 -3.1165 -3.1165 -3.1161 -3.1161 -3.1022 -3.1022 -3.1007 -3.1007 -3.0816 -3.0816 -3.0713 -3.0713 -3.0531 -3.0531 -3.0470 -3.0470 -3.0128 -3.0128 -3.0111 -3.0111 -1.4941 -1.4941 -1.4835 -1.4835 -1.4038 -1.4038 -1.3841 -1.3841 -1.3838 -1.3838 -1.3649 -1.3649 -1.2994 -1.2994 -1.2796 -1.2796 -1.2656 -1.2656 -1.2608 -1.2608 -1.1717 -1.1717 -1.1674 -1.1674 -1.1251 -1.1251 -1.1058 -1.1058 -1.0743 -1.0743 -1.0713 -1.0713 -1.0210 -1.0210 -0.9779 -0.9779 -0.1824 -0.1824 -0.1812 -0.1812 0.8404 0.8404 0.8509 0.8509 2.4790 2.4790 2.4798 2.4798 5.2879 5.2879 5.2996 5.2996 7.0515 7.0515 7.0603 7.0603 7.4816 7.4816 7.5465 7.5465 8.1909 8.1909 k = 0.5000 0.0855 0.5496 ( 8698 PWs) bands (ev): -3.1534 -3.1534 -3.1509 -3.1509 -3.1160 -3.1160 -3.1150 -3.1150 -3.1017 -3.1017 -3.1015 -3.1015 -3.0808 -3.0808 -3.0711 -3.0711 -3.0534 -3.0534 -3.0473 -3.0473 -3.0126 -3.0126 -3.0110 -3.0110 -1.4957 -1.4957 -1.4836 -1.4836 -1.4034 -1.4034 -1.3869 -1.3869 -1.3827 -1.3827 -1.3673 -1.3673 -1.2988 -1.2988 -1.2767 -1.2767 -1.2655 -1.2655 -1.2583 -1.2583 -1.1764 -1.1764 -1.1671 -1.1671 -1.1215 -1.1215 -1.1031 -1.1031 -1.0766 -1.0766 -1.0727 -1.0727 -1.0256 -1.0256 -0.9766 -0.9766 -0.1920 -0.1920 -0.1911 -0.1911 0.8369 0.8369 0.8470 0.8470 2.5313 2.5313 2.5334 2.5334 5.2068 5.2068 5.2197 5.2197 7.1068 7.1068 7.1231 7.1231 7.4937 7.4937 7.5747 7.5747 8.2477 8.2477 k = 0.5000 0.0641 0.5496 ( 8686 PWs) bands (ev): -3.1538 -3.1538 -3.1514 -3.1514 -3.1160 -3.1160 -3.1136 -3.1136 -3.1022 -3.1022 -3.1013 -3.1013 -3.0801 -3.0801 -3.0709 -3.0709 -3.0536 -3.0536 -3.0475 -3.0475 -3.0124 -3.0124 -3.0110 -3.0110 -1.4970 -1.4970 -1.4836 -1.4836 -1.4025 -1.4025 -1.3896 -1.3896 -1.3815 -1.3815 -1.3696 -1.3696 -1.2984 -1.2984 -1.2742 -1.2742 -1.2655 -1.2655 -1.2557 -1.2557 -1.1808 -1.1808 -1.1673 -1.1673 -1.1171 -1.1171 -1.1004 -1.1004 -1.0789 -1.0789 -1.0750 -1.0750 -1.0292 -1.0292 -0.9755 -0.9755 -0.1995 -0.1995 -0.1989 -0.1989 0.8339 0.8339 0.8437 0.8437 2.5752 2.5752 2.5782 2.5782 5.1406 5.1406 5.1545 5.1545 7.1510 7.1510 7.1759 7.1759 7.4994 7.4994 7.5961 7.5961 8.3232 8.3241 k = 0.5000 0.0427 0.5496 ( 8686 PWs) bands (ev): -3.1541 -3.1541 -3.1517 -3.1517 -3.1160 -3.1160 -3.1125 -3.1125 -3.1030 -3.1030 -3.1010 -3.1010 -3.0795 -3.0795 -3.0707 -3.0707 -3.0538 -3.0538 -3.0477 -3.0477 -3.0123 -3.0123 -3.0110 -3.0110 -1.4979 -1.4979 -1.4837 -1.4837 -1.4012 -1.4012 -1.3924 -1.3924 -1.3802 -1.3802 -1.3716 -1.3716 -1.2982 -1.2982 -1.2723 -1.2723 -1.2655 -1.2655 -1.2533 -1.2533 -1.1843 -1.1843 -1.1678 -1.1678 -1.1126 -1.1126 -1.0979 -1.0979 -1.0811 -1.0811 -1.0778 -1.0778 -1.0317 -1.0317 -0.9747 -0.9747 -0.2048 -0.2048 -0.2044 -0.2044 0.8316 0.8316 0.8411 0.8411 2.6085 2.6085 2.6122 2.6122 5.0914 5.0914 5.1060 5.1060 7.1831 7.1831 7.2166 7.2166 7.5009 7.5009 7.6111 7.6111 8.3723 8.3723 k = 0.5000 0.0214 0.5496 ( 8686 PWs) bands (ev): -3.1543 -3.1543 -3.1519 -3.1519 -3.1161 -3.1161 -3.1117 -3.1117 -3.1035 -3.1035 -3.1008 -3.1008 -3.0792 -3.0792 -3.0706 -3.0706 -3.0539 -3.0539 -3.0478 -3.0478 -3.0123 -3.0123 -3.0109 -3.0109 -1.4985 -1.4985 -1.4837 -1.4837 -1.3994 -1.3994 -1.3949 -1.3949 -1.3790 -1.3790 -1.3733 -1.3733 -1.2981 -1.2981 -1.2711 -1.2711 -1.2655 -1.2655 -1.2517 -1.2517 -1.1866 -1.1866 -1.1681 -1.1681 -1.1090 -1.1090 -1.0958 -1.0958 -1.0829 -1.0829 -1.0804 -1.0804 -1.0331 -1.0331 -0.9743 -0.9743 -0.2080 -0.2080 -0.2077 -0.2077 0.8301 0.8301 0.8395 0.8395 2.6293 2.6293 2.6335 2.6335 5.0611 5.0611 5.0761 5.0761 7.2025 7.2025 7.2424 7.2424 7.5005 7.5005 7.6201 7.6201 8.4072 8.4072 k = 0.5000-0.0000 0.5496 ( 8680 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1161 -3.1161 -3.1114 -3.1114 -3.1037 -3.1037 -3.1008 -3.1008 -3.0791 -3.0791 -3.0705 -3.0705 -3.0540 -3.0540 -3.0479 -3.0479 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4838 -1.4838 -1.3974 -1.3974 -1.3972 -1.3972 -1.3784 -1.3784 -1.3741 -1.3741 -1.2980 -1.2980 -1.2707 -1.2707 -1.2656 -1.2656 -1.2511 -1.2511 -1.1875 -1.1875 -1.1683 -1.1683 -1.1075 -1.1075 -1.0950 -1.0950 -1.0837 -1.0837 -1.0816 -1.0816 -1.0336 -1.0336 -0.9741 -0.9741 -0.2091 -0.2091 -0.2088 -0.2088 0.8296 0.8296 0.8389 0.8389 2.6363 2.6363 2.6407 2.6407 5.0508 5.0508 5.0660 5.0660 7.2090 7.2090 7.2514 7.2514 7.5001 7.5001 7.6232 7.6232 8.4202 8.4202 k = 0.5000-0.0000 0.5496 ( 8680 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1161 -3.1161 -3.1114 -3.1114 -3.1037 -3.1037 -3.1008 -3.1008 -3.0791 -3.0791 -3.0705 -3.0705 -3.0540 -3.0540 -3.0479 -3.0479 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4838 -1.4838 -1.3974 -1.3974 -1.3972 -1.3972 -1.3784 -1.3784 -1.3741 -1.3741 -1.2980 -1.2980 -1.2707 -1.2707 -1.2656 -1.2656 -1.2511 -1.2511 -1.1875 -1.1875 -1.1683 -1.1683 -1.1075 -1.1075 -1.0950 -1.0950 -1.0837 -1.0837 -1.0816 -1.0816 -1.0336 -1.0336 -0.9741 -0.9741 -0.2091 -0.2091 -0.2088 -0.2088 0.8296 0.8296 0.8389 0.8389 2.6363 2.6363 2.6407 2.6407 5.0508 5.0508 5.0660 5.0660 7.2090 7.2090 7.2514 7.2514 7.5001 7.5001 7.6232 7.6232 8.4202 8.4202 k = 0.5000-0.0000 0.5285 ( 8682 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1161 -3.1161 -3.1115 -3.1115 -3.1036 -3.1036 -3.1008 -3.1008 -3.0791 -3.0791 -3.0706 -3.0706 -3.0539 -3.0539 -3.0478 -3.0478 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4837 -1.4837 -1.3990 -1.3990 -1.3956 -1.3956 -1.3792 -1.3792 -1.3732 -1.3732 -1.2983 -1.2983 -1.2723 -1.2723 -1.2639 -1.2639 -1.2509 -1.2509 -1.1875 -1.1875 -1.1682 -1.1682 -1.1079 -1.1079 -1.0953 -1.0953 -1.0836 -1.0836 -1.0813 -1.0813 -1.0337 -1.0337 -0.9742 -0.9742 -0.2125 -0.2125 -0.2122 -0.2122 0.8351 0.8351 0.8445 0.8445 2.6365 2.6365 2.6408 2.6408 5.0520 5.0520 5.0671 5.0671 7.1899 7.1899 7.2213 7.2213 7.5261 7.5261 7.6365 7.6365 8.4107 8.4107 k = 0.5000-0.0000 0.5073 ( 8684 PWs) bands (ev): -3.1542 -3.1542 -3.1519 -3.1519 -3.1161 -3.1161 -3.1118 -3.1118 -3.1033 -3.1033 -3.1008 -3.1008 -3.0791 -3.0791 -3.0707 -3.0707 -3.0538 -3.0538 -3.0478 -3.0478 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4835 -1.4835 -1.4006 -1.4006 -1.3937 -1.3937 -1.3807 -1.3807 -1.3715 -1.3715 -1.2989 -1.2989 -1.2753 -1.2753 -1.2611 -1.2611 -1.2503 -1.2503 -1.1875 -1.1875 -1.1679 -1.1679 -1.1092 -1.1092 -1.0962 -1.0962 -1.0834 -1.0834 -1.0806 -1.0806 -1.0339 -1.0339 -0.9744 -0.9744 -0.2225 -0.2225 -0.2223 -0.2223 0.8515 0.8515 0.8608 0.8608 2.6368 2.6368 2.6410 2.6410 5.0557 5.0557 5.0704 5.0704 7.1399 7.1399 7.1534 7.1534 7.5811 7.5811 7.6679 7.6679 8.3843 8.3843 k = 0.5000-0.0000 0.4862 ( 8686 PWs) bands (ev): -3.1540 -3.1540 -3.1517 -3.1517 -3.1162 -3.1162 -3.1123 -3.1123 -3.1028 -3.1028 -3.1007 -3.1007 -3.0791 -3.0791 -3.0709 -3.0709 -3.0535 -3.0535 -3.0476 -3.0476 -3.0122 -3.0122 -3.0110 -3.0110 -1.4986 -1.4986 -1.4833 -1.4833 -1.4020 -1.4020 -1.3918 -1.3918 -1.3823 -1.3823 -1.3694 -1.3694 -1.3000 -1.3000 -1.2785 -1.2785 -1.2581 -1.2581 -1.2493 -1.2493 -1.1875 -1.1875 -1.1675 -1.1675 -1.1111 -1.1111 -1.0975 -1.0975 -1.0831 -1.0831 -1.0795 -1.0795 -1.0343 -1.0343 -0.9747 -0.9747 -0.2384 -0.2384 -0.2382 -0.2382 0.8780 0.8780 0.8873 0.8873 2.6374 2.6374 2.6414 2.6414 5.0617 5.0617 5.0759 5.0759 7.0712 7.0712 7.0718 7.0718 7.6386 7.6386 7.7000 7.7000 8.3462 8.3462 k = 0.5000-0.0000 0.4650 ( 8696 PWs) bands (ev): -3.1537 -3.1537 -3.1515 -3.1515 -3.1163 -3.1163 -3.1129 -3.1129 -3.1022 -3.1022 -3.1007 -3.1007 -3.0792 -3.0792 -3.0711 -3.0711 -3.0532 -3.0532 -3.0474 -3.0474 -3.0123 -3.0123 -3.0110 -3.0110 -1.4985 -1.4985 -1.4829 -1.4829 -1.4033 -1.4033 -1.3899 -1.3899 -1.3839 -1.3839 -1.3673 -1.3673 -1.3014 -1.3014 -1.2816 -1.2816 -1.2553 -1.2553 -1.2480 -1.2480 -1.1875 -1.1875 -1.1670 -1.1670 -1.1135 -1.1135 -1.0993 -1.0993 -1.0828 -1.0828 -1.0783 -1.0783 -1.0348 -1.0348 -0.9752 -0.9752 -0.2592 -0.2592 -0.2592 -0.2592 0.9136 0.9136 0.9229 0.9229 2.6383 2.6383 2.6419 2.6419 5.0700 5.0700 5.0835 5.0835 6.9834 6.9834 6.9940 6.9940 7.6841 7.6841 7.7171 7.7171 8.3047 8.3047 k = 0.5000-0.0000 0.4439 ( 8692 PWs) bands (ev): -3.1534 -3.1534 -3.1513 -3.1513 -3.1164 -3.1164 -3.1136 -3.1136 -3.1017 -3.1017 -3.1007 -3.1007 -3.0792 -3.0792 -3.0714 -3.0714 -3.0528 -3.0528 -3.0471 -3.0471 -3.0123 -3.0123 -3.0110 -3.0110 -1.4984 -1.4984 -1.4825 -1.4825 -1.4044 -1.4044 -1.3879 -1.3879 -1.3855 -1.3855 -1.3651 -1.3651 -1.3031 -1.3031 -1.2846 -1.2846 -1.2526 -1.2526 -1.2464 -1.2464 -1.1876 -1.1876 -1.1664 -1.1664 -1.1161 -1.1161 -1.1013 -1.1013 -1.0826 -1.0826 -1.0772 -1.0772 -1.0354 -1.0354 -0.9758 -0.9758 -0.2840 -0.2840 -0.2838 -0.2838 0.9571 0.9571 0.9665 0.9665 2.6393 2.6393 2.6425 2.6425 5.0805 5.0805 5.0930 5.0930 6.8934 6.8934 6.9116 6.9116 7.7069 7.7069 7.7080 7.7080 8.2692 8.2692 k = 0.5000-0.0000 0.4228 ( 8698 PWs) bands (ev): -3.1530 -3.1530 -3.1510 -3.1510 -3.1164 -3.1164 -3.1142 -3.1142 -3.1011 -3.1011 -3.1007 -3.1007 -3.0792 -3.0792 -3.0717 -3.0717 -3.0524 -3.0524 -3.0469 -3.0469 -3.0123 -3.0123 -3.0110 -3.0110 -1.4982 -1.4982 -1.4821 -1.4821 -1.4053 -1.4053 -1.3869 -1.3869 -1.3859 -1.3859 -1.3630 -1.3630 -1.3050 -1.3050 -1.2874 -1.2874 -1.2502 -1.2502 -1.2447 -1.2447 -1.1876 -1.1876 -1.1657 -1.1657 -1.1187 -1.1187 -1.1037 -1.1037 -1.0824 -1.0824 -1.0762 -1.0762 -1.0360 -1.0360 -0.9766 -0.9766 -0.3117 -0.3117 -0.3113 -0.3113 1.0074 1.0074 1.0169 1.0169 2.6404 2.6404 2.6431 2.6431 5.0931 5.0931 5.1043 5.1043 6.8028 6.8028 6.8272 6.8272 7.6700 7.6700 7.6991 7.6991 8.2457 8.2457 k = 0.5000-0.0000 0.4016 ( 8690 PWs) bands (ev): -3.1525 -3.1525 -3.1506 -3.1506 -3.1165 -3.1165 -3.1149 -3.1149 -3.1008 -3.1008 -3.1006 -3.1006 -3.0792 -3.0792 -3.0720 -3.0720 -3.0519 -3.0519 -3.0465 -3.0465 -3.0123 -3.0123 -3.0110 -3.0110 -1.4981 -1.4981 -1.4816 -1.4816 -1.4060 -1.4060 -1.3882 -1.3882 -1.3838 -1.3838 -1.3608 -1.3608 -1.3070 -1.3070 -1.2900 -1.2900 -1.2482 -1.2482 -1.2429 -1.2429 -1.1877 -1.1877 -1.1651 -1.1651 -1.1214 -1.1214 -1.1063 -1.1063 -1.0823 -1.0823 -1.0756 -1.0756 -1.0365 -1.0365 -0.9776 -0.9776 -0.3411 -0.3411 -0.3405 -0.3405 1.0635 1.0635 1.0730 1.0730 2.6415 2.6415 2.6436 2.6436 5.1075 5.1075 5.1171 5.1171 6.7124 6.7124 6.7422 6.7422 7.6087 7.6087 7.6607 7.6607 8.2314 8.2314 k = 0.5000-0.0000 0.3805 ( 8692 PWs) bands (ev): -3.1519 -3.1519 -3.1502 -3.1502 -3.1166 -3.1166 -3.1155 -3.1155 -3.1009 -3.1009 -3.1002 -3.1002 -3.0791 -3.0791 -3.0723 -3.0723 -3.0514 -3.0514 -3.0462 -3.0462 -3.0123 -3.0123 -3.0111 -3.0111 -1.4979 -1.4979 -1.4811 -1.4811 -1.4065 -1.4065 -1.3894 -1.3894 -1.3818 -1.3818 -1.3588 -1.3588 -1.3091 -1.3091 -1.2924 -1.2924 -1.2465 -1.2465 -1.2411 -1.2411 -1.1879 -1.1879 -1.1646 -1.1646 -1.1237 -1.1237 -1.1091 -1.1091 -1.0822 -1.0822 -1.0753 -1.0753 -1.0370 -1.0370 -0.9787 -0.9787 -0.3716 -0.3716 -0.3707 -0.3707 1.1242 1.1242 1.1338 1.1338 2.6427 2.6427 2.6441 2.6441 5.1235 5.1235 5.1312 5.1312 6.6228 6.6228 6.6577 6.6577 7.5323 7.5323 7.5990 7.5990 8.2163 8.2163 k = 0.5000-0.0000 0.3594 ( 8692 PWs) bands (ev): -3.1513 -3.1513 -3.1497 -3.1497 -3.1166 -3.1166 -3.1160 -3.1160 -3.1011 -3.1011 -3.0999 -3.0999 -3.0790 -3.0790 -3.0726 -3.0726 -3.0508 -3.0508 -3.0459 -3.0459 -3.0123 -3.0123 -3.0111 -3.0111 -1.4977 -1.4977 -1.4806 -1.4806 -1.4067 -1.4067 -1.3904 -1.3904 -1.3799 -1.3799 -1.3568 -1.3568 -1.3113 -1.3113 -1.2945 -1.2945 -1.2452 -1.2452 -1.2393 -1.2393 -1.1881 -1.1881 -1.1644 -1.1644 -1.1258 -1.1258 -1.1120 -1.1120 -1.0822 -1.0822 -1.0754 -1.0754 -1.0374 -1.0374 -0.9800 -0.9800 -0.4023 -0.4023 -0.4011 -0.4011 1.1888 1.1888 1.1985 1.1985 2.6437 2.6437 2.6444 2.6444 5.1409 5.1409 5.1462 5.1462 6.5344 6.5344 6.5745 6.5745 7.4475 7.4475 7.5231 7.5231 8.1921 8.1921 k = 0.5000-0.0000 0.3382 ( 8692 PWs) bands (ev): -3.1507 -3.1507 -3.1492 -3.1492 -3.1167 -3.1167 -3.1165 -3.1165 -3.1014 -3.1014 -3.0997 -3.0997 -3.0789 -3.0789 -3.0729 -3.0729 -3.0503 -3.0503 -3.0455 -3.0455 -3.0123 -3.0123 -3.0111 -3.0111 -1.4975 -1.4975 -1.4803 -1.4803 -1.4067 -1.4067 -1.3913 -1.3913 -1.3779 -1.3779 -1.3550 -1.3550 -1.3134 -1.3134 -1.2963 -1.2963 -1.2443 -1.2443 -1.2376 -1.2376 -1.1884 -1.1884 -1.1645 -1.1645 -1.1273 -1.1273 -1.1150 -1.1150 -1.0823 -1.0823 -1.0760 -1.0760 -1.0376 -1.0376 -0.9815 -0.9815 -0.4327 -0.4327 -0.4313 -0.4313 1.2565 1.2565 1.2663 1.2663 2.6444 2.6444 2.6445 2.6445 5.1592 5.1592 5.1616 5.1616 6.4477 6.4477 6.4931 6.4931 7.3593 7.3593 7.4402 7.4402 8.1569 8.1569 k = 0.5000-0.0000 0.3171 ( 8698 PWs) bands (ev): -3.1500 -3.1500 -3.1486 -3.1486 -3.1170 -3.1170 -3.1166 -3.1166 -3.1018 -3.1018 -3.0996 -3.0996 -3.0787 -3.0787 -3.0731 -3.0731 -3.0498 -3.0498 -3.0452 -3.0452 -3.0124 -3.0124 -3.0112 -3.0112 -1.4973 -1.4973 -1.4800 -1.4800 -1.4063 -1.4063 -1.3920 -1.3920 -1.3760 -1.3760 -1.3534 -1.3534 -1.3155 -1.3155 -1.2977 -1.2977 -1.2438 -1.2438 -1.2359 -1.2359 -1.1887 -1.1887 -1.1651 -1.1651 -1.1283 -1.1283 -1.1180 -1.1180 -1.0824 -1.0824 -1.0770 -1.0770 -1.0376 -1.0376 -0.9831 -0.9831 -0.4624 -0.4624 -0.4607 -0.4607 1.3266 1.3266 1.3365 1.3365 2.6440 2.6440 2.6450 2.6450 5.1771 5.1771 5.1781 5.1781 6.3631 6.3631 6.4142 6.4142 7.2708 7.2708 7.3550 7.3550 8.1129 8.1129 k = 0.5000-0.0000 0.2959 ( 8694 PWs) bands (ev): -3.1492 -3.1492 -3.1480 -3.1480 -3.1173 -3.1173 -3.1166 -3.1166 -3.1023 -3.1023 -3.0997 -3.0997 -3.0784 -3.0784 -3.0732 -3.0732 -3.0492 -3.0492 -3.0449 -3.0449 -3.0124 -3.0124 -3.0112 -3.0112 -1.4970 -1.4970 -1.4798 -1.4798 -1.4057 -1.4057 -1.3926 -1.3926 -1.3742 -1.3742 -1.3520 -1.3520 -1.3175 -1.3175 -1.2989 -1.2989 -1.2436 -1.2436 -1.2345 -1.2345 -1.1891 -1.1891 -1.1661 -1.1661 -1.1286 -1.1286 -1.1209 -1.1209 -1.0826 -1.0826 -1.0784 -1.0784 -1.0374 -1.0374 -0.9849 -0.9849 -0.4909 -0.4909 -0.4889 -0.4889 1.3984 1.3984 1.4084 1.4084 2.6430 2.6430 2.6450 2.6450 5.1919 5.1919 5.1971 5.1971 6.2811 6.2811 6.3382 6.3382 7.1845 7.1845 7.2708 7.2708 8.0629 8.0629 k = 0.5000-0.0000 0.2748 ( 8700 PWs) bands (ev): -3.1485 -3.1485 -3.1474 -3.1474 -3.1176 -3.1176 -3.1165 -3.1165 -3.1028 -3.1028 -3.0999 -3.0999 -3.0781 -3.0781 -3.0733 -3.0733 -3.0487 -3.0487 -3.0446 -3.0446 -3.0124 -3.0124 -3.0113 -3.0113 -1.4968 -1.4968 -1.4798 -1.4798 -1.4048 -1.4048 -1.3930 -1.3930 -1.3724 -1.3724 -1.3508 -1.3508 -1.3195 -1.3195 -1.2998 -1.2998 -1.2439 -1.2439 -1.2332 -1.2332 -1.1895 -1.1895 -1.1676 -1.1676 -1.1285 -1.1285 -1.1237 -1.1237 -1.0828 -1.0828 -1.0800 -1.0800 -1.0369 -1.0369 -0.9869 -0.9869 -0.5180 -0.5180 -0.5158 -0.5158 1.4713 1.4713 1.4815 1.4815 2.6414 2.6414 2.6444 2.6444 5.2055 5.2055 5.2153 5.2153 6.2023 6.2023 6.2657 6.2657 7.1022 7.1022 7.1897 7.1897 8.0092 8.0092 k = 0.5000-0.0000 0.2537 ( 8700 PWs) bands (ev): -3.1477 -3.1477 -3.1467 -3.1467 -3.1178 -3.1178 -3.1163 -3.1163 -3.1034 -3.1034 -3.1002 -3.1002 -3.0778 -3.0778 -3.0734 -3.0734 -3.0481 -3.0481 -3.0443 -3.0443 -3.0124 -3.0124 -3.0113 -3.0113 -1.4965 -1.4965 -1.4799 -1.4799 -1.4036 -1.4036 -1.3933 -1.3933 -1.3707 -1.3707 -1.3498 -1.3498 -1.3213 -1.3213 -1.3005 -1.3005 -1.2445 -1.2445 -1.2321 -1.2321 -1.1901 -1.1901 -1.1694 -1.1694 -1.1281 -1.1281 -1.1264 -1.1264 -1.0831 -1.0831 -1.0819 -1.0819 -1.0364 -1.0364 -0.9891 -0.9891 -0.5434 -0.5434 -0.5410 -0.5410 1.5448 1.5448 1.5551 1.5551 2.6390 2.6390 2.6430 2.6430 5.2170 5.2170 5.2322 5.2322 6.1274 6.1274 6.1974 6.1974 7.0253 7.0253 7.1133 7.1133 7.9532 7.9532 k = 0.5000-0.0000 0.2325 ( 8694 PWs) bands (ev): -3.1469 -3.1469 -3.1460 -3.1460 -3.1179 -3.1179 -3.1162 -3.1162 -3.1041 -3.1041 -3.1006 -3.1006 -3.0775 -3.0775 -3.0734 -3.0734 -3.0476 -3.0476 -3.0441 -3.0441 -3.0124 -3.0124 -3.0114 -3.0114 -1.4962 -1.4962 -1.4801 -1.4801 -1.4022 -1.4022 -1.3935 -1.3935 -1.3690 -1.3690 -1.3491 -1.3491 -1.3230 -1.3230 -1.3011 -1.3011 -1.2453 -1.2453 -1.2313 -1.2313 -1.1906 -1.1906 -1.1714 -1.1714 -1.1289 -1.1289 -1.1275 -1.1275 -1.0838 -1.0838 -1.0834 -1.0834 -1.0356 -1.0356 -0.9913 -0.9913 -0.5670 -0.5670 -0.5644 -0.5644 1.6181 1.6181 1.6287 1.6287 2.6357 2.6357 2.6406 2.6406 5.2259 5.2259 5.2468 5.2468 6.0575 6.0575 6.1340 6.1340 6.9549 6.9549 7.0427 7.0427 7.8961 7.8961 k = 0.5000-0.0000 0.2114 ( 8692 PWs) bands (ev): -3.1461 -3.1461 -3.1454 -3.1454 -3.1180 -3.1180 -3.1160 -3.1160 -3.1048 -3.1048 -3.1012 -3.1012 -3.0771 -3.0771 -3.0735 -3.0735 -3.0471 -3.0471 -3.0439 -3.0439 -3.0124 -3.0124 -3.0114 -3.0114 -1.4958 -1.4958 -1.4805 -1.4805 -1.4005 -1.4005 -1.3935 -1.3935 -1.3673 -1.3673 -1.3485 -1.3485 -1.3246 -1.3246 -1.3016 -1.3016 -1.2462 -1.2462 -1.2308 -1.2308 -1.1911 -1.1911 -1.1735 -1.1735 -1.1311 -1.1311 -1.1270 -1.1270 -1.0856 -1.0856 -1.0837 -1.0837 -1.0347 -1.0347 -0.9937 -0.9937 -0.5886 -0.5886 -0.5860 -0.5860 1.6908 1.6908 1.7015 1.7015 2.6312 2.6312 2.6371 2.6371 5.2313 5.2313 5.2581 5.2581 5.9937 5.9937 6.0761 6.0761 6.8919 6.8919 6.9787 6.9787 7.8388 7.8388 k = 0.5000-0.0000 0.1902 ( 8696 PWs) bands (ev): -3.1453 -3.1453 -3.1447 -3.1447 -3.1179 -3.1179 -3.1157 -3.1157 -3.1055 -3.1055 -3.1018 -3.1018 -3.0768 -3.0768 -3.0735 -3.0735 -3.0467 -3.0467 -3.0437 -3.0437 -3.0125 -3.0125 -3.0115 -3.0115 -1.4955 -1.4955 -1.4811 -1.4811 -1.3988 -1.3988 -1.3934 -1.3934 -1.3656 -1.3656 -1.3481 -1.3481 -1.3261 -1.3261 -1.3023 -1.3023 -1.2472 -1.2472 -1.2306 -1.2306 -1.1916 -1.1916 -1.1755 -1.1755 -1.1330 -1.1330 -1.1267 -1.1267 -1.0873 -1.0873 -1.0841 -1.0841 -1.0336 -1.0336 -0.9962 -0.9962 -0.6082 -0.6082 -0.6055 -0.6055 1.7622 1.7622 1.7730 1.7730 2.6254 2.6254 2.6323 2.6323 5.2328 5.2328 5.2650 5.2650 5.9372 5.9372 6.0242 6.0242 6.8370 6.8370 6.9218 6.9218 7.7820 7.7820 k = 0.5000-0.0000 0.1691 ( 8692 PWs) bands (ev): -3.1445 -3.1445 -3.1440 -3.1440 -3.1178 -3.1178 -3.1154 -3.1154 -3.1062 -3.1062 -3.1025 -3.1025 -3.0764 -3.0764 -3.0735 -3.0735 -3.0462 -3.0462 -3.0435 -3.0435 -3.0125 -3.0125 -3.0116 -3.0116 -1.4950 -1.4950 -1.4818 -1.4818 -1.3970 -1.3970 -1.3932 -1.3932 -1.3638 -1.3638 -1.3478 -1.3478 -1.3274 -1.3274 -1.3033 -1.3033 -1.2480 -1.2480 -1.2307 -1.2307 -1.1920 -1.1920 -1.1776 -1.1776 -1.1346 -1.1346 -1.1267 -1.1267 -1.0886 -1.0886 -1.0845 -1.0845 -1.0324 -1.0324 -0.9987 -0.9987 -0.6257 -0.6257 -0.6231 -0.6231 1.8314 1.8314 1.8423 1.8423 2.6183 2.6183 2.6260 2.6260 5.2303 5.2303 5.2667 5.2667 5.8893 5.8893 5.9787 5.9787 6.7908 6.7908 6.8723 6.8723 7.7265 7.7265 k = 0.5000-0.0000 0.1480 ( 8680 PWs) bands (ev): -3.1438 -3.1438 -3.1434 -3.1434 -3.1176 -3.1176 -3.1151 -3.1151 -3.1069 -3.1069 -3.1033 -3.1033 -3.0761 -3.0761 -3.0735 -3.0735 -3.0458 -3.0458 -3.0434 -3.0434 -3.0125 -3.0125 -3.0116 -3.0116 -1.4945 -1.4945 -1.4826 -1.4826 -1.3953 -1.3953 -1.3928 -1.3928 -1.3620 -1.3620 -1.3476 -1.3476 -1.3285 -1.3285 -1.3047 -1.3047 -1.2485 -1.2485 -1.2312 -1.2312 -1.1923 -1.1923 -1.1795 -1.1795 -1.1359 -1.1359 -1.1271 -1.1271 -1.0895 -1.0895 -1.0849 -1.0849 -1.0311 -1.0311 -1.0013 -1.0013 -0.6410 -0.6410 -0.6385 -0.6385 1.8978 1.8978 1.9087 1.9087 2.6097 2.6097 2.6181 2.6181 5.2239 5.2239 5.2627 5.2627 5.8508 5.8508 5.9397 5.9397 6.7533 6.7533 6.8301 6.8301 7.6734 7.6734 k = 0.5000-0.0000 0.1268 ( 8680 PWs) bands (ev): -3.1432 -3.1432 -3.1428 -3.1428 -3.1174 -3.1174 -3.1148 -3.1148 -3.1076 -3.1076 -3.1040 -3.1040 -3.0757 -3.0757 -3.0736 -3.0736 -3.0454 -3.0454 -3.0433 -3.0433 -3.0124 -3.0124 -3.0117 -3.0117 -1.4940 -1.4940 -1.4835 -1.4835 -1.3938 -1.3938 -1.3924 -1.3924 -1.3600 -1.3600 -1.3475 -1.3475 -1.3294 -1.3294 -1.3067 -1.3067 -1.2487 -1.2487 -1.2320 -1.2320 -1.1924 -1.1924 -1.1813 -1.1813 -1.1368 -1.1368 -1.1278 -1.1278 -1.0901 -1.0901 -1.0853 -1.0853 -1.0297 -1.0297 -1.0039 -1.0039 -0.6543 -0.6543 -0.6520 -0.6520 1.9605 1.9605 1.9712 1.9712 2.5997 2.5997 2.6085 2.6085 5.2146 5.2146 5.2534 5.2534 5.8221 5.8221 5.9066 5.9066 6.7244 6.7244 6.7949 6.7949 7.6237 7.6237 k = 0.5000-0.0000 0.1057 ( 8674 PWs) bands (ev): -3.1426 -3.1426 -3.1423 -3.1423 -3.1170 -3.1170 -3.1145 -3.1145 -3.1082 -3.1082 -3.1049 -3.1049 -3.0754 -3.0754 -3.0736 -3.0736 -3.0450 -3.0450 -3.0433 -3.0433 -3.0124 -3.0124 -3.0118 -3.0118 -1.4934 -1.4934 -1.4844 -1.4844 -1.3924 -1.3924 -1.3920 -1.3920 -1.3578 -1.3578 -1.3474 -1.3474 -1.3299 -1.3299 -1.3091 -1.3091 -1.2484 -1.2484 -1.2332 -1.2332 -1.1923 -1.1923 -1.1829 -1.1829 -1.1374 -1.1374 -1.1289 -1.1289 -1.0903 -1.0903 -1.0858 -1.0858 -1.0281 -1.0281 -1.0064 -1.0064 -0.6654 -0.6654 -0.6633 -0.6633 2.0185 2.0185 2.0287 2.0287 2.5885 2.5885 2.5974 2.5974 5.2036 5.2036 5.2397 5.2397 5.8025 5.8025 5.8790 5.8790 6.7038 6.7038 6.7662 6.7662 7.5786 7.5787 k = 0.5000-0.0000 0.0846 ( 8682 PWs) bands (ev): -3.1421 -3.1421 -3.1419 -3.1419 -3.1167 -3.1167 -3.1142 -3.1142 -3.1087 -3.1087 -3.1057 -3.1057 -3.0752 -3.0752 -3.0737 -3.0737 -3.0447 -3.0447 -3.0433 -3.0433 -3.0124 -3.0124 -3.0119 -3.0119 -1.4927 -1.4927 -1.4854 -1.4854 -1.3915 -1.3915 -1.3914 -1.3914 -1.3556 -1.3556 -1.3474 -1.3474 -1.3301 -1.3301 -1.3120 -1.3120 -1.2477 -1.2477 -1.2346 -1.2346 -1.1920 -1.1920 -1.1845 -1.1845 -1.1377 -1.1377 -1.1303 -1.1303 -1.0902 -1.0902 -1.0863 -1.0863 -1.0264 -1.0264 -1.0090 -1.0090 -0.6744 -0.6744 -0.6726 -0.6726 2.0704 2.0704 2.0799 2.0799 2.5767 2.5767 2.5853 2.5853 5.1925 5.1925 5.2237 5.2237 5.7909 5.7909 5.8560 5.8560 6.6905 6.6905 6.7432 6.7432 7.5397 7.5397 k = 0.5000-0.0000 0.0634 ( 8678 PWs) bands (ev): -3.1417 -3.1417 -3.1415 -3.1415 -3.1162 -3.1162 -3.1141 -3.1141 -3.1091 -3.1091 -3.1065 -3.1065 -3.0749 -3.0749 -3.0738 -3.0738 -3.0444 -3.0444 -3.0433 -3.0433 -3.0124 -3.0124 -3.0120 -3.0120 -1.4920 -1.4920 -1.4864 -1.4864 -1.3910 -1.3910 -1.3906 -1.3906 -1.3534 -1.3534 -1.3475 -1.3475 -1.3298 -1.3298 -1.3152 -1.3152 -1.2466 -1.2466 -1.2362 -1.2362 -1.1916 -1.1916 -1.1859 -1.1859 -1.1376 -1.1376 -1.1317 -1.1317 -1.0899 -1.0899 -1.0868 -1.0868 -1.0246 -1.0246 -1.0115 -1.0115 -0.6813 -0.6813 -0.6799 -0.6799 2.1148 2.1148 2.1230 2.1230 2.5651 2.5651 2.5727 2.5727 5.1827 5.1827 5.2075 5.2075 5.7859 5.7859 5.8369 5.8369 6.6838 6.6838 6.7250 6.7250 7.5081 7.5081 k = 0.5000-0.0000 0.0423 ( 8678 PWs) bands (ev): -3.1414 -3.1414 -3.1413 -3.1413 -3.1157 -3.1157 -3.1142 -3.1142 -3.1091 -3.1091 -3.1072 -3.1072 -3.0746 -3.0746 -3.0739 -3.0739 -3.0441 -3.0441 -3.0434 -3.0434 -3.0123 -3.0123 -3.0121 -3.0121 -1.4912 -1.4912 -1.4875 -1.4875 -1.3906 -1.3906 -1.3902 -1.3902 -1.3515 -1.3515 -1.3477 -1.3477 -1.3289 -1.3289 -1.3185 -1.3185 -1.2452 -1.2452 -1.2380 -1.2380 -1.1910 -1.1910 -1.1872 -1.1872 -1.1372 -1.1372 -1.1331 -1.1331 -1.0895 -1.0895 -1.0873 -1.0873 -1.0226 -1.0226 -1.0139 -1.0139 -0.6861 -0.6861 -0.6852 -0.6852 2.1497 2.1497 2.1558 2.1558 2.5553 2.5553 2.5612 2.5612 5.1759 5.1759 5.1930 5.1930 5.7860 5.7860 5.8210 5.8210 6.6823 6.6823 6.7107 6.7107 7.4852 7.4853 k = 0.5000-0.0000 0.0211 ( 8672 PWs) bands (ev): -3.1412 -3.1412 -3.1411 -3.1411 -3.1153 -3.1153 -3.1144 -3.1144 -3.1089 -3.1089 -3.1079 -3.1079 -3.0744 -3.0744 -3.0741 -3.0741 -3.0439 -3.0439 -3.0435 -3.0435 -3.0123 -3.0123 -3.0121 -3.0121 -1.4904 -1.4904 -1.4885 -1.4885 -1.3903 -1.3903 -1.3900 -1.3900 -1.3499 -1.3499 -1.3481 -1.3481 -1.3272 -1.3272 -1.3218 -1.3218 -1.2435 -1.2435 -1.2398 -1.2398 -1.1902 -1.1902 -1.1883 -1.1883 -1.1366 -1.1366 -1.1345 -1.1345 -1.0890 -1.0890 -1.0879 -1.0879 -1.0206 -1.0206 -1.0162 -1.0162 -0.6889 -0.6889 -0.6884 -0.6884 2.1728 2.1728 2.1761 2.1761 2.5490 2.5490 2.5523 2.5523 5.1732 5.1732 5.1819 5.1819 5.7902 5.7902 5.8080 5.8080 6.6849 6.6849 6.6994 6.6994 7.4719 7.4720 k = 0.5000-0.0000-0.0000 ( 8688 PWs) bands (ev): -3.1411 -3.1411 -3.1411 -3.1411 -3.1148 -3.1148 -3.1148 -3.1148 -3.1085 -3.1085 -3.1085 -3.1085 -3.0742 -3.0742 -3.0742 -3.0742 -3.0437 -3.0437 -3.0437 -3.0437 -3.0122 -3.0122 -3.0122 -3.0122 -1.4894 -1.4894 -1.4894 -1.4894 -1.3900 -1.3900 -1.3900 -1.3900 -1.3488 -1.3488 -1.3488 -1.3488 -1.3248 -1.3248 -1.3248 -1.3248 -1.2417 -1.2417 -1.2417 -1.2417 -1.1894 -1.1894 -1.1894 -1.1894 -1.1356 -1.1356 -1.1356 -1.1356 -1.0884 -1.0884 -1.0884 -1.0884 -1.0185 -1.0185 -1.0185 -1.0185 -0.6897 -0.6897 -0.6897 -0.6897 2.1820 2.1820 2.1820 2.1820 2.5479 2.5479 2.5479 2.5479 5.1751 5.1751 5.1751 5.1751 5.7977 5.7977 5.7977 5.7977 6.6908 6.6908 6.6908 6.6908 7.4689 7.4689 k = 0.0000 0.0000 0.5496 ( 8700 PWs) bands (ev): -3.1490 -3.1490 -3.1490 -3.1490 -3.1200 -3.1200 -3.1200 -3.1200 -3.1113 -3.1113 -3.1113 -3.1113 -3.0777 -3.0777 -3.0777 -3.0777 -3.0415 -3.0415 -3.0415 -3.0415 -3.0106 -3.0106 -3.0106 -3.0106 -1.5032 -1.5032 -1.5032 -1.5032 -1.3930 -1.3930 -1.3930 -1.3930 -1.3571 -1.3571 -1.3571 -1.3571 -1.3113 -1.3113 -1.3113 -1.3113 -1.2433 -1.2433 -1.2433 -1.2433 -1.1970 -1.1970 -1.1970 -1.1970 -1.1233 -1.1233 -1.1233 -1.1233 -1.0892 -1.0892 -1.0892 -1.0892 -0.9995 -0.9995 -0.9995 -0.9995 -0.5878 -0.5878 -0.5878 -0.5878 2.0921 2.0921 2.0921 2.0921 2.3141 2.3141 2.3141 2.3141 4.9201 4.9201 4.9201 4.9201 5.9214 5.9214 5.9214 5.9214 7.4266 7.4266 7.4266 7.4266 7.9946 7.9946 k = 0.0217-0.0000 0.5496 ( 8706 PWs) bands (ev): -3.1491 -3.1491 -3.1490 -3.1490 -3.1200 -3.1200 -3.1199 -3.1199 -3.1120 -3.1120 -3.1105 -3.1105 -3.0781 -3.0781 -3.0774 -3.0774 -3.0417 -3.0417 -3.0413 -3.0413 -3.0106 -3.0106 -3.0105 -3.0105 -1.5042 -1.5042 -1.5019 -1.5019 -1.3948 -1.3948 -1.3915 -1.3915 -1.3593 -1.3593 -1.3549 -1.3549 -1.3125 -1.3125 -1.3101 -1.3101 -1.2462 -1.2462 -1.2399 -1.2399 -1.2015 -1.2015 -1.1925 -1.1925 -1.1249 -1.1249 -1.1222 -1.1222 -1.0892 -1.0892 -1.0890 -1.0890 -1.0013 -1.0013 -0.9976 -0.9976 -0.5871 -0.5871 -0.5863 -0.5863 2.0762 2.0762 2.0848 2.0848 2.3159 2.3159 2.3251 2.3251 4.9284 4.9284 4.9285 4.9285 5.9153 5.9153 5.9166 5.9166 7.4292 7.4292 7.4333 7.4333 7.9835 7.9835 k = 0.0435-0.0000 0.5496 ( 8710 PWs) bands (ev): -3.1493 -3.1493 -3.1491 -3.1491 -3.1198 -3.1198 -3.1197 -3.1197 -3.1127 -3.1127 -3.1097 -3.1097 -3.0783 -3.0783 -3.0769 -3.0769 -3.0420 -3.0420 -3.0412 -3.0412 -3.0107 -3.0107 -3.0105 -3.0105 -1.5048 -1.5048 -1.5004 -1.5004 -1.3968 -1.3968 -1.3904 -1.3904 -1.3615 -1.3615 -1.3527 -1.3527 -1.3135 -1.3135 -1.3088 -1.3088 -1.2485 -1.2485 -1.2362 -1.2362 -1.2057 -1.2057 -1.1880 -1.1880 -1.1268 -1.1268 -1.1216 -1.1216 -1.0891 -1.0891 -1.0887 -1.0887 -1.0030 -1.0030 -0.9956 -0.9956 -0.5840 -0.5840 -0.5825 -0.5825 2.0419 2.0419 2.0558 2.0558 2.3293 2.3293 2.3443 2.3443 4.9533 4.9533 4.9535 4.9535 5.8987 5.8987 5.9012 5.9012 7.4409 7.4409 7.4490 7.4490 7.9763 7.9763 k = 0.0652-0.0000 0.5496 ( 8714 PWs) bands (ev): -3.1496 -3.1496 -3.1492 -3.1492 -3.1197 -3.1197 -3.1194 -3.1194 -3.1133 -3.1133 -3.1089 -3.1089 -3.0785 -3.0785 -3.0765 -3.0765 -3.0424 -3.0424 -3.0413 -3.0413 -3.0107 -3.0107 -3.0105 -3.0105 -1.5052 -1.5052 -1.4986 -1.4986 -1.3990 -1.3990 -1.3897 -1.3897 -1.3636 -1.3636 -1.3505 -1.3505 -1.3146 -1.3146 -1.3074 -1.3074 -1.2499 -1.2499 -1.2329 -1.2329 -1.2094 -1.2094 -1.1838 -1.1838 -1.1289 -1.1289 -1.1215 -1.1215 -1.0890 -1.0890 -1.0882 -1.0882 -1.0044 -1.0044 -0.9936 -0.9936 -0.5787 -0.5787 -0.5765 -0.5765 1.9949 1.9949 2.0110 2.0110 2.3490 2.3490 2.3666 2.3666 4.9940 4.9940 4.9943 4.9943 5.8724 5.8724 5.8763 5.8763 7.4608 7.4608 7.4725 7.4725 7.9729 7.9729 k = 0.0870-0.0000 0.5496 ( 8718 PWs) bands (ev): -3.1499 -3.1499 -3.1494 -3.1494 -3.1195 -3.1195 -3.1190 -3.1190 -3.1136 -3.1136 -3.1080 -3.1080 -3.0787 -3.0787 -3.0760 -3.0760 -3.0428 -3.0428 -3.0413 -3.0413 -3.0108 -3.0108 -3.0105 -3.0105 -1.5054 -1.5054 -1.4966 -1.4966 -1.4011 -1.4011 -1.3895 -1.3895 -1.3657 -1.3657 -1.3484 -1.3484 -1.3157 -1.3157 -1.3059 -1.3059 -1.2505 -1.2505 -1.2308 -1.2308 -1.2115 -1.2115 -1.1797 -1.1797 -1.1312 -1.1312 -1.1219 -1.1219 -1.0890 -1.0890 -1.0873 -1.0873 -1.0057 -1.0057 -0.9915 -0.9915 -0.5711 -0.5711 -0.5682 -0.5682 1.9391 1.9391 1.9555 1.9555 2.3708 2.3708 2.3890 2.3890 5.0493 5.0493 5.0497 5.0497 5.8380 5.8380 5.8433 5.8433 7.4876 7.4876 7.5025 7.5025 7.9734 7.9734 k = 0.1087-0.0000 0.5496 ( 8706 PWs) bands (ev): -3.1502 -3.1502 -3.1496 -3.1496 -3.1193 -3.1193 -3.1185 -3.1185 -3.1139 -3.1139 -3.1072 -3.1072 -3.0788 -3.0788 -3.0755 -3.0755 -3.0433 -3.0433 -3.0415 -3.0415 -3.0109 -3.0109 -3.0105 -3.0105 -1.5052 -1.5052 -1.4946 -1.4946 -1.4031 -1.4031 -1.3897 -1.3897 -1.3678 -1.3678 -1.3464 -1.3464 -1.3168 -1.3168 -1.3043 -1.3043 -1.2503 -1.2503 -1.2313 -1.2313 -1.2109 -1.2109 -1.1758 -1.1758 -1.1336 -1.1336 -1.1227 -1.1227 -1.0890 -1.0890 -1.0863 -1.0863 -1.0069 -1.0069 -0.9895 -0.9895 -0.5612 -0.5612 -0.5577 -0.5577 1.8768 1.8768 1.8924 1.8924 2.3929 2.3929 2.4106 2.4106 5.1177 5.1177 5.1178 5.1178 5.7973 5.7973 5.8043 5.8043 7.5197 7.5197 7.5375 7.5375 7.9777 7.9777 k = 0.1304-0.0000 0.5496 ( 8694 PWs) bands (ev): -3.1506 -3.1506 -3.1499 -3.1499 -3.1192 -3.1192 -3.1179 -3.1179 -3.1138 -3.1138 -3.1063 -3.1063 -3.0789 -3.0789 -3.0750 -3.0750 -3.0439 -3.0439 -3.0417 -3.0417 -3.0110 -3.0110 -3.0105 -3.0105 -1.5049 -1.5049 -1.4924 -1.4924 -1.4049 -1.4049 -1.3903 -1.3903 -1.3698 -1.3698 -1.3447 -1.3447 -1.3178 -1.3178 -1.3027 -1.3027 -1.2492 -1.2492 -1.2341 -1.2341 -1.2078 -1.2078 -1.1720 -1.1720 -1.1361 -1.1361 -1.1237 -1.1237 -1.0891 -1.0891 -1.0852 -1.0852 -1.0080 -1.0080 -0.9875 -0.9875 -0.5491 -0.5491 -0.5451 -0.5451 1.8094 1.8094 1.8238 1.8238 2.4145 2.4145 2.4310 2.4310 5.1964 5.1964 5.1974 5.1974 5.7523 5.7523 5.7619 5.7619 7.5556 7.5556 7.5759 7.5759 7.9857 7.9857 k = 0.1522-0.0000 0.5496 ( 8706 PWs) bands (ev): -3.1510 -3.1510 -3.1502 -3.1502 -3.1193 -3.1193 -3.1172 -3.1172 -3.1136 -3.1136 -3.1055 -3.1055 -3.0789 -3.0789 -3.0746 -3.0746 -3.0445 -3.0445 -3.0420 -3.0420 -3.0111 -3.0111 -3.0105 -3.0105 -1.5044 -1.5044 -1.4903 -1.4903 -1.4062 -1.4062 -1.3911 -1.3911 -1.3718 -1.3718 -1.3435 -1.3435 -1.3185 -1.3185 -1.3010 -1.3010 -1.2475 -1.2475 -1.2381 -1.2381 -1.2035 -1.2035 -1.1684 -1.1684 -1.1385 -1.1385 -1.1249 -1.1249 -1.0893 -1.0893 -1.0839 -1.0839 -1.0090 -1.0090 -0.9856 -0.9856 -0.5349 -0.5349 -0.5303 -0.5303 1.7382 1.7382 1.7510 1.7510 2.4353 2.4353 2.4503 2.4503 5.2815 5.2815 5.2855 5.2855 5.7058 5.7058 5.7201 5.7201 7.5935 7.5935 7.6163 7.6163 7.9974 7.9974 k = 0.1739-0.0000 0.5496 ( 8704 PWs) bands (ev): -3.1514 -3.1514 -3.1505 -3.1505 -3.1194 -3.1194 -3.1165 -3.1165 -3.1132 -3.1132 -3.1046 -3.1046 -3.0790 -3.0790 -3.0741 -3.0741 -3.0452 -3.0452 -3.0424 -3.0424 -3.0112 -3.0112 -3.0106 -3.0106 -1.5038 -1.5038 -1.4884 -1.4884 -1.4072 -1.4072 -1.3922 -1.3922 -1.3737 -1.3737 -1.3429 -1.3429 -1.3187 -1.3187 -1.2994 -1.2994 -1.2454 -1.2454 -1.2425 -1.2425 -1.1989 -1.1989 -1.1648 -1.1648 -1.1409 -1.1409 -1.1260 -1.1260 -1.0894 -1.0894 -1.0827 -1.0827 -1.0100 -1.0100 -0.9838 -0.9838 -0.5185 -0.5185 -0.5136 -0.5136 1.6643 1.6643 1.6754 1.6754 2.4554 2.4554 2.4687 2.4687 5.3649 5.3649 5.3762 5.3762 5.6636 5.6636 5.6870 5.6870 7.6321 7.6321 7.6573 7.6573 8.0126 8.0126 k = 0.1957-0.0000 0.5496 ( 8702 PWs) bands (ev): -3.1518 -3.1518 -3.1508 -3.1508 -3.1195 -3.1195 -3.1158 -3.1158 -3.1127 -3.1127 -3.1038 -3.1038 -3.0790 -3.0790 -3.0737 -3.0737 -3.0459 -3.0459 -3.0428 -3.0428 -3.0113 -3.0113 -3.0106 -3.0106 -1.5032 -1.5032 -1.4867 -1.4867 -1.4076 -1.4076 -1.3933 -1.3933 -1.3755 -1.3755 -1.3432 -1.3432 -1.3180 -1.3180 -1.2978 -1.2978 -1.2470 -1.2470 -1.2430 -1.2430 -1.1945 -1.1945 -1.1613 -1.1613 -1.1432 -1.1432 -1.1269 -1.1269 -1.0895 -1.0895 -1.0815 -1.0815 -1.0110 -1.0110 -0.9822 -0.9822 -0.5000 -0.5000 -0.4949 -0.4949 1.5887 1.5887 1.5980 1.5980 2.4748 2.4748 2.4862 2.4862 5.4260 5.4260 5.4510 5.4510 5.6441 5.6441 5.6834 5.6834 7.6702 7.6702 7.6978 7.6978 8.0311 8.0311 k = 0.2174-0.0000 0.5496 ( 8706 PWs) bands (ev): -3.1521 -3.1521 -3.1510 -3.1510 -3.1196 -3.1196 -3.1150 -3.1150 -3.1121 -3.1121 -3.1029 -3.1029 -3.0791 -3.0791 -3.0733 -3.0733 -3.0466 -3.0466 -3.0432 -3.0432 -3.0114 -3.0114 -3.0106 -3.0106 -1.5025 -1.5025 -1.4852 -1.4852 -1.4075 -1.4075 -1.3945 -1.3945 -1.3771 -1.3771 -1.3444 -1.3444 -1.3164 -1.3164 -1.2963 -1.2963 -1.2514 -1.2514 -1.2406 -1.2406 -1.1904 -1.1904 -1.1579 -1.1579 -1.1453 -1.1453 -1.1273 -1.1273 -1.0895 -1.0895 -1.0804 -1.0804 -1.0121 -1.0121 -0.9807 -0.9807 -0.4797 -0.4797 -0.4743 -0.4743 1.5122 1.5122 1.5198 1.5198 2.4935 2.4935 2.5031 2.5031 5.4374 5.4374 5.4669 5.4669 5.6902 5.6902 5.7364 5.7364 7.7065 7.7065 7.7366 7.7366 8.0528 8.0528 k = 0.2391-0.0000 0.5496 ( 8720 PWs) bands (ev): -3.1525 -3.1525 -3.1513 -3.1513 -3.1196 -3.1196 -3.1142 -3.1142 -3.1116 -3.1116 -3.1021 -3.1021 -3.0792 -3.0792 -3.0729 -3.0729 -3.0473 -3.0473 -3.0437 -3.0437 -3.0115 -3.0115 -3.0107 -3.0107 -1.5018 -1.5018 -1.4841 -1.4841 -1.4069 -1.4069 -1.3956 -1.3956 -1.3787 -1.3787 -1.3463 -1.3463 -1.3140 -1.3140 -1.2949 -1.2949 -1.2557 -1.2557 -1.2384 -1.2384 -1.1869 -1.1869 -1.1549 -1.1549 -1.1467 -1.1467 -1.1271 -1.1271 -1.0894 -1.0894 -1.0794 -1.0794 -1.0134 -1.0134 -0.9794 -0.9794 -0.4575 -0.4575 -0.4522 -0.4522 1.4359 1.4359 1.4416 1.4416 2.5116 2.5116 2.5194 2.5194 5.4103 5.4103 5.4347 5.4347 5.7906 5.7906 5.8344 5.8344 7.7403 7.7403 7.7724 7.7724 8.0774 8.0774 k = 0.2609-0.0000 0.5496 ( 8728 PWs) bands (ev): -3.1528 -3.1528 -3.1515 -3.1515 -3.1196 -3.1196 -3.1133 -3.1133 -3.1111 -3.1111 -3.1013 -3.1013 -3.0793 -3.0793 -3.0726 -3.0726 -3.0481 -3.0481 -3.0441 -3.0441 -3.0116 -3.0116 -3.0107 -3.0107 -1.5012 -1.5012 -1.4833 -1.4833 -1.4059 -1.4059 -1.3966 -1.3966 -1.3800 -1.3800 -1.3488 -1.3488 -1.3109 -1.3109 -1.2938 -1.2938 -1.2596 -1.2596 -1.2367 -1.2367 -1.1843 -1.1843 -1.1539 -1.1539 -1.1459 -1.1459 -1.1262 -1.1262 -1.0893 -1.0893 -1.0786 -1.0786 -1.0147 -1.0147 -0.9782 -0.9782 -0.4338 -0.4338 -0.4285 -0.4285 1.3604 1.3604 1.3644 1.3644 2.5291 2.5291 2.5351 2.5351 5.3687 5.3687 5.3893 5.3893 5.9103 5.9103 5.9532 5.9532 7.7705 7.7705 7.8038 7.8038 8.1044 8.1044 k = 0.2826-0.0000 0.5496 ( 8732 PWs) bands (ev): -3.1531 -3.1531 -3.1516 -3.1516 -3.1195 -3.1195 -3.1124 -3.1124 -3.1106 -3.1106 -3.1006 -3.1006 -3.0794 -3.0794 -3.0723 -3.0723 -3.0489 -3.0489 -3.0446 -3.0446 -3.0117 -3.0117 -3.0108 -3.0108 -1.5006 -1.5006 -1.4827 -1.4827 -1.4045 -1.4045 -1.3974 -1.3974 -1.3811 -1.3811 -1.3517 -1.3517 -1.3072 -1.3072 -1.2929 -1.2929 -1.2630 -1.2630 -1.2354 -1.2354 -1.1827 -1.1827 -1.1551 -1.1551 -1.1426 -1.1426 -1.1244 -1.1244 -1.0890 -1.0890 -1.0779 -1.0779 -1.0163 -1.0163 -0.9773 -0.9773 -0.4086 -0.4086 -0.4036 -0.4036 1.2865 1.2865 1.2888 1.2888 2.5459 2.5459 2.5501 2.5501 5.3232 5.3232 5.3416 5.3416 6.0380 6.0380 6.0821 6.0821 7.7962 7.7962 7.8289 7.8289 8.1334 8.1334 k = 0.3043-0.0000 0.5496 ( 8732 PWs) bands (ev): -3.1533 -3.1533 -3.1518 -3.1518 -3.1194 -3.1194 -3.1115 -3.1115 -3.1103 -3.1103 -3.1000 -3.1000 -3.0795 -3.0795 -3.0720 -3.0720 -3.0496 -3.0496 -3.0451 -3.0451 -3.0118 -3.0118 -3.0108 -3.0108 -1.5001 -1.5001 -1.4825 -1.4825 -1.4030 -1.4030 -1.3981 -1.3981 -1.3819 -1.3819 -1.3547 -1.3547 -1.3031 -1.3031 -1.2923 -1.2923 -1.2659 -1.2659 -1.2348 -1.2348 -1.1819 -1.1819 -1.1570 -1.1570 -1.1383 -1.1383 -1.1218 -1.1218 -1.0886 -1.0886 -1.0774 -1.0774 -1.0180 -1.0180 -0.9765 -0.9765 -0.3825 -0.3825 -0.3778 -0.3778 1.2152 1.2152 1.2158 1.2158 2.5618 2.5618 2.5645 2.5645 5.2778 5.2778 5.2948 5.2948 6.1701 6.1701 6.2165 6.2165 7.8165 7.8165 7.8456 7.8456 8.1639 8.1639 k = 0.3261-0.0000 0.5496 ( 8726 PWs) bands (ev): -3.1536 -3.1536 -3.1518 -3.1518 -3.1191 -3.1191 -3.1106 -3.1106 -3.1101 -3.1101 -3.0995 -3.0995 -3.0795 -3.0795 -3.0718 -3.0718 -3.0503 -3.0503 -3.0456 -3.0456 -3.0119 -3.0119 -3.0108 -3.0108 -1.4997 -1.4997 -1.4824 -1.4824 -1.4015 -1.4015 -1.3985 -1.3985 -1.3823 -1.3823 -1.3578 -1.3578 -1.2988 -1.2988 -1.2922 -1.2922 -1.2682 -1.2682 -1.2348 -1.2348 -1.1818 -1.1818 -1.1590 -1.1590 -1.1336 -1.1336 -1.1186 -1.1186 -1.0882 -1.0882 -1.0772 -1.0772 -1.0199 -1.0199 -0.9758 -0.9758 -0.3557 -0.3557 -0.3516 -0.3516 1.1461 1.1461 1.1471 1.1471 2.5768 2.5768 2.5780 2.5780 5.2343 5.2343 5.2506 5.2506 6.3046 6.3046 6.3540 6.3540 7.8301 7.8301 7.8515 7.8515 8.1953 8.1953 k = 0.3478-0.0000 0.5496 ( 8718 PWs) bands (ev): -3.1538 -3.1538 -3.1519 -3.1519 -3.1188 -3.1188 -3.1100 -3.1100 -3.1096 -3.1096 -3.0992 -3.0992 -3.0796 -3.0796 -3.0715 -3.0715 -3.0511 -3.0511 -3.0461 -3.0461 -3.0119 -3.0119 -3.0109 -3.0109 -1.4994 -1.4994 -1.4825 -1.4825 -1.4002 -1.4002 -1.3988 -1.3988 -1.3824 -1.3824 -1.3609 -1.3609 -1.2941 -1.2941 -1.2926 -1.2926 -1.2698 -1.2698 -1.2356 -1.2356 -1.1823 -1.1823 -1.1609 -1.1609 -1.1287 -1.1287 -1.1150 -1.1150 -1.0877 -1.0877 -1.0772 -1.0772 -1.0220 -1.0220 -0.9753 -0.9753 -0.3289 -0.3289 -0.3253 -0.3253 1.0806 1.0806 1.0831 1.0831 2.5906 2.5906 2.5906 2.5906 5.1940 5.1940 5.2099 5.2099 6.4401 6.4401 6.4929 6.4929 7.8354 7.8354 7.8445 7.8445 8.2273 8.2273 k = 0.3696-0.0000 0.5496 ( 8706 PWs) bands (ev): -3.1539 -3.1539 -3.1520 -3.1520 -3.1184 -3.1184 -3.1100 -3.1100 -3.1086 -3.1086 -3.0990 -3.0990 -3.0796 -3.0796 -3.0713 -3.0713 -3.0517 -3.0517 -3.0465 -3.0465 -3.0120 -3.0120 -3.0109 -3.0109 -1.4991 -1.4991 -1.4827 -1.4827 -1.3991 -1.3991 -1.3988 -1.3988 -1.3820 -1.3820 -1.3638 -1.3638 -1.2934 -1.2934 -1.2894 -1.2894 -1.2707 -1.2707 -1.2369 -1.2369 -1.1831 -1.1831 -1.1628 -1.1628 -1.1240 -1.1240 -1.1112 -1.1112 -1.0871 -1.0871 -1.0774 -1.0774 -1.0242 -1.0242 -0.9749 -0.9749 -0.3026 -0.3026 -0.2997 -0.2997 1.0203 1.0203 1.0243 1.0243 2.6020 2.6020 2.6031 2.6031 5.1577 5.1577 5.1733 5.1733 6.5751 6.5751 6.6313 6.6313 7.8227 7.8227 7.8308 7.8308 8.2596 8.2596 k = 0.3913-0.0000 0.5496 ( 8714 PWs) bands (ev): -3.1540 -3.1540 -3.1520 -3.1520 -3.1179 -3.1179 -3.1101 -3.1101 -3.1076 -3.1076 -3.0990 -3.0990 -3.0795 -3.0795 -3.0711 -3.0711 -3.0523 -3.0523 -3.0469 -3.0469 -3.0121 -3.0121 -3.0109 -3.0109 -1.4990 -1.4990 -1.4830 -1.4830 -1.3986 -1.3986 -1.3983 -1.3983 -1.3814 -1.3814 -1.3666 -1.3666 -1.2944 -1.2944 -1.2845 -1.2845 -1.2711 -1.2711 -1.2389 -1.2389 -1.1841 -1.1841 -1.1644 -1.1644 -1.1195 -1.1195 -1.1074 -1.1074 -1.0864 -1.0864 -1.0779 -1.0779 -1.0264 -1.0264 -0.9746 -0.9746 -0.2777 -0.2777 -0.2756 -0.2756 0.9662 0.9662 0.9716 0.9716 2.6120 2.6120 2.6141 2.6141 5.1261 5.1261 5.1415 5.1415 6.7083 6.7083 6.7676 6.7676 7.7858 7.7858 7.8144 7.8144 8.2918 8.2918 k = 0.4130-0.0000 0.5496 ( 8708 PWs) bands (ev): -3.1542 -3.1542 -3.1520 -3.1520 -3.1175 -3.1175 -3.1104 -3.1104 -3.1066 -3.1066 -3.0992 -3.0992 -3.0794 -3.0794 -3.0709 -3.0709 -3.0529 -3.0529 -3.0472 -3.0472 -3.0121 -3.0121 -3.0109 -3.0109 -1.4988 -1.4988 -1.4832 -1.4832 -1.3983 -1.3983 -1.3979 -1.3979 -1.3806 -1.3806 -1.3690 -1.3690 -1.2955 -1.2955 -1.2796 -1.2796 -1.2711 -1.2711 -1.2413 -1.2413 -1.1852 -1.1852 -1.1658 -1.1658 -1.1154 -1.1154 -1.1037 -1.1037 -1.0857 -1.0857 -1.0786 -1.0786 -1.0286 -1.0286 -0.9744 -0.9744 -0.2552 -0.2552 -0.2537 -0.2537 0.9195 0.9195 0.9262 0.9262 2.6205 2.6205 2.6234 2.6234 5.0995 5.0995 5.1148 5.1148 6.8381 6.8381 6.8993 6.8993 7.7344 7.7344 7.7852 7.7852 8.3237 8.3237 k = 0.4348-0.0000 0.5496 ( 8704 PWs) bands (ev): -3.1542 -3.1542 -3.1520 -3.1520 -3.1170 -3.1170 -3.1107 -3.1107 -3.1056 -3.1056 -3.0996 -3.0996 -3.0793 -3.0793 -3.0708 -3.0708 -3.0533 -3.0533 -3.0475 -3.0475 -3.0122 -3.0122 -3.0109 -3.0109 -1.4988 -1.4988 -1.4834 -1.4834 -1.3979 -1.3979 -1.3976 -1.3976 -1.3797 -1.3797 -1.3711 -1.3711 -1.2965 -1.2965 -1.2749 -1.2749 -1.2710 -1.2710 -1.2442 -1.2442 -1.1861 -1.1861 -1.1668 -1.1668 -1.1121 -1.1121 -1.1004 -1.1004 -1.0850 -1.0850 -1.0795 -1.0795 -1.0306 -1.0306 -0.9743 -0.9743 -0.2360 -0.2360 -0.2352 -0.2352 0.8814 0.8814 0.8891 0.8891 2.6273 2.6273 2.6309 2.6309 5.0784 5.0784 5.0936 5.0936 6.9619 6.9619 7.0232 7.0232 7.6709 7.6709 7.7434 7.7434 8.3550 8.3550 k = 0.4565-0.0000 0.5496 ( 8686 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1165 -3.1165 -3.1110 -3.1110 -3.1047 -3.1047 -3.1001 -3.1001 -3.0792 -3.0792 -3.0706 -3.0706 -3.0537 -3.0537 -3.0477 -3.0477 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4836 -1.4836 -1.3976 -1.3976 -1.3975 -1.3975 -1.3790 -1.3790 -1.3727 -1.3727 -1.2973 -1.2973 -1.2708 -1.2708 -1.2705 -1.2705 -1.2472 -1.2472 -1.1868 -1.1868 -1.1676 -1.1676 -1.1096 -1.1096 -1.0976 -1.0976 -1.0843 -1.0843 -1.0804 -1.0804 -1.0322 -1.0322 -0.9742 -0.9742 -0.2212 -0.2212 -0.2211 -0.2211 0.8530 0.8530 0.8616 0.8616 2.6323 2.6323 2.6363 2.6363 5.0632 5.0632 5.0783 5.0783 7.0755 7.0755 7.1333 7.1333 7.5998 7.5998 7.6930 7.6930 8.3846 8.3846 k = 0.4783-0.0000 0.5496 ( 8690 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1162 -3.1162 -3.1113 -3.1113 -3.1040 -3.1040 -3.1006 -3.1006 -3.0791 -3.0791 -3.0705 -3.0705 -3.0539 -3.0539 -3.0478 -3.0478 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4837 -1.4837 -1.3975 -1.3975 -1.3973 -1.3973 -1.3785 -1.3785 -1.3737 -1.3737 -1.2978 -1.2978 -1.2707 -1.2707 -1.2671 -1.2671 -1.2499 -1.2499 -1.1873 -1.1873 -1.1681 -1.1681 -1.1080 -1.1080 -1.0957 -1.0957 -1.0838 -1.0838 -1.0813 -1.0813 -1.0332 -1.0332 -0.9741 -0.9741 -0.2121 -0.2121 -0.2120 -0.2120 0.8355 0.8355 0.8446 0.8446 2.6353 2.6353 2.6396 2.6396 5.0539 5.0539 5.0691 5.0691 7.1680 7.1680 7.2173 7.2173 7.5327 7.5327 7.6451 7.6451 8.4092 8.4092 k = 0.5000-0.0000 0.5496 ( 8680 PWs) bands (ev): -3.1543 -3.1543 -3.1520 -3.1520 -3.1161 -3.1161 -3.1114 -3.1114 -3.1037 -3.1037 -3.1008 -3.1008 -3.0791 -3.0791 -3.0705 -3.0705 -3.0540 -3.0540 -3.0479 -3.0479 -3.0122 -3.0122 -3.0109 -3.0109 -1.4987 -1.4987 -1.4838 -1.4838 -1.3974 -1.3974 -1.3972 -1.3972 -1.3784 -1.3784 -1.3741 -1.3741 -1.2980 -1.2980 -1.2707 -1.2707 -1.2656 -1.2656 -1.2511 -1.2511 -1.1875 -1.1875 -1.1683 -1.1683 -1.1075 -1.1075 -1.0950 -1.0950 -1.0837 -1.0837 -1.0816 -1.0816 -1.0336 -1.0336 -0.9741 -0.9741 -0.2091 -0.2091 -0.2088 -0.2088 0.8296 0.8296 0.8389 0.8389 2.6363 2.6363 2.6407 2.6407 5.0508 5.0508 5.0660 5.0660 7.2090 7.2090 7.2514 7.2514 7.5001 7.5001 7.6232 7.6232 8.4202 8.4202 Writing output data file Hg.save init_run : 0.65s CPU 0.85s WALL ( 1 calls) electrons : 644.05s CPU 649.46s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.07s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 644.04s CPU 649.44s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.14s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 228 calls) cegterg : 614.70s CPU 619.53s WALL ( 620 calls) Called by sum_band: Called by *egterg: h_psi : 316.68s CPU 321.13s WALL ( 11039 calls) s_psi : 15.25s CPU 15.14s WALL ( 11039 calls) g_psi : 0.41s CPU 0.44s WALL ( 10191 calls) cdiaghg : 245.65s CPU 246.23s WALL ( 10419 calls) cegterg:over : 26.31s CPU 26.29s WALL ( 10191 calls) cegterg:upda : 17.58s CPU 17.47s WALL ( 10191 calls) cegterg:last : 10.48s CPU 10.57s WALL ( 1524 calls) cdiaghg:chol : 8.77s CPU 9.12s WALL ( 10419 calls) cdiaghg:inve : 6.86s CPU 6.77s WALL ( 10419 calls) cdiaghg:para : 14.86s CPU 14.65s WALL ( 20838 calls) Called by h_psi: h_psi:vloc : 282.42s CPU 286.88s WALL ( 11039 calls) h_psi:vnl : 33.62s CPU 33.71s WALL ( 11039 calls) add_vuspsi : 17.42s CPU 17.50s WALL ( 11039 calls) General routines calbec : 16.14s CPU 16.17s WALL ( 11039 calls) fft : 0.03s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 267.23s CPU 271.88s WALL ( 1444100 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.19s CPU 0.23s WALL ( 456 calls) Parallel routines fft_scatter : 192.18s CPU 195.60s WALL ( 1444123 calls) PWSCF : 11m36.72s CPU 11m57.99s WALL This run was terminated on: 23:34:22 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=