Program PWSCF v.5.1.1 starts on 23Jul2015 at 12:18:42 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./CuO2.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 35 20 6 2923 1288 208 Max 36 21 7 2933 1309 217 Sum 1687 997 297 140599 62259 10195 bravais-lattice index = 14 lattice parameter (alat) = 12.9310 a.u. unit-cell volume = 1428.9517 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.930953 celldm(2)= 1.000000 celldm(3)= 1.677596 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.919133 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.919133 0.393948 0.000000 ) a(3) = ( 0.000000 0.000000 1.677596 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 2.333135 -0.000000 ) b(2) = ( 0.000000 2.538409 -0.000000 ) b(3) = ( 0.000000 0.000000 0.596091 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 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 O 6.00 15.99940 O( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) 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 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 370 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 2) = ( 0.0043422 0.0211534 -0.0000000), wk = 0.0027027 k( 3) = ( 0.0086845 0.0423068 -0.0000000), wk = 0.0027027 k( 4) = ( 0.0130267 0.0634602 -0.0000000), wk = 0.0027027 k( 5) = ( 0.0173690 0.0846136 -0.0000000), wk = 0.0027027 k( 6) = ( 0.0217112 0.1057670 -0.0000000), wk = 0.0027027 k( 7) = ( 0.0260534 0.1269204 -0.0000000), wk = 0.0027027 k( 8) = ( 0.0303957 0.1480738 -0.0000000), wk = 0.0027027 k( 9) = ( 0.0347379 0.1692272 -0.0000000), wk = 0.0027027 k( 10) = ( 0.0390802 0.1903806 -0.0000000), wk = 0.0027027 k( 11) = ( 0.0434224 0.2115341 -0.0000000), wk = 0.0027027 k( 12) = ( 0.0477646 0.2326875 -0.0000000), wk = 0.0027027 k( 13) = ( 0.0521069 0.2538409 -0.0000000), wk = 0.0027027 k( 14) = ( 0.0564491 0.2749942 -0.0000000), wk = 0.0027027 k( 15) = ( 0.0607913 0.2961476 -0.0000000), wk = 0.0027027 k( 16) = ( 0.0651336 0.3173011 -0.0000000), wk = 0.0027027 k( 17) = ( 0.0694758 0.3384545 -0.0000000), wk = 0.0027027 k( 18) = ( 0.0738181 0.3596079 -0.0000000), wk = 0.0027027 k( 19) = ( 0.0781603 0.3807613 -0.0000000), wk = 0.0027027 k( 20) = ( 0.0825025 0.4019147 -0.0000000), wk = 0.0027027 k( 21) = ( 0.0868448 0.4230681 -0.0000000), wk = 0.0027027 k( 22) = ( 0.0911870 0.4442215 -0.0000000), wk = 0.0027027 k( 23) = ( 0.0955292 0.4653749 -0.0000000), wk = 0.0027027 k( 24) = ( 0.0998715 0.4865283 -0.0000000), wk = 0.0027027 k( 25) = ( 0.1042137 0.5076817 -0.0000000), wk = 0.0027027 k( 26) = ( 0.1085560 0.5288351 -0.0000000), wk = 0.0027027 k( 27) = ( 0.1128982 0.5499885 -0.0000000), wk = 0.0027027 k( 28) = ( 0.1172404 0.5711419 -0.0000000), wk = 0.0027027 k( 29) = ( 0.1215827 0.5922953 -0.0000000), wk = 0.0027027 k( 30) = ( 0.1259249 0.6134487 -0.0000000), wk = 0.0027027 k( 31) = ( 0.1302672 0.6346021 -0.0000000), wk = 0.0027027 k( 32) = ( 0.1346094 0.6557555 -0.0000000), wk = 0.0027027 k( 33) = ( 0.1389516 0.6769089 -0.0000000), wk = 0.0027027 k( 34) = ( 0.1432939 0.6980623 -0.0000000), wk = 0.0027027 k( 35) = ( 0.1476361 0.7192158 -0.0000000), wk = 0.0027027 k( 36) = ( 0.1519784 0.7403692 -0.0000000), wk = 0.0027027 k( 37) = ( 0.1563206 0.7615226 -0.0000000), wk = 0.0027027 k( 38) = ( 0.1606628 0.7826760 -0.0000000), wk = 0.0027027 k( 39) = ( 0.1650051 0.8038293 -0.0000000), wk = 0.0027027 k( 40) = ( 0.1693473 0.8249828 -0.0000000), wk = 0.0027027 k( 41) = ( 0.1736895 0.8461362 -0.0000000), wk = 0.0027027 k( 42) = ( 0.1780318 0.8672896 -0.0000000), wk = 0.0027027 k( 43) = ( 0.1823740 0.8884430 -0.0000000), wk = 0.0027027 k( 44) = ( 0.1867163 0.9095964 -0.0000000), wk = 0.0027027 k( 45) = ( 0.1910585 0.9307498 -0.0000000), wk = 0.0027027 k( 46) = ( 0.1954008 0.9519032 -0.0000000), wk = 0.0027027 k( 47) = ( 0.1997430 0.9730566 -0.0000000), wk = 0.0027027 k( 48) = ( 0.2040852 0.9942100 -0.0000000), wk = 0.0027027 k( 49) = ( 0.2084275 1.0153634 -0.0000000), wk = 0.0027027 k( 50) = ( 0.2127697 1.0365168 -0.0000000), wk = 0.0027027 k( 51) = ( 0.2171119 1.0576702 -0.0000000), wk = 0.0027027 k( 52) = ( 0.2214542 1.0788236 -0.0000000), wk = 0.0027027 k( 53) = ( 0.2257964 1.0999770 -0.0000000), wk = 0.0027027 k( 54) = ( 0.2301387 1.1211304 -0.0000000), wk = 0.0027027 k( 55) = ( 0.2344809 1.1422839 -0.0000000), wk = 0.0027027 k( 56) = ( 0.2388231 1.1634372 -0.0000000), wk = 0.0027027 k( 57) = ( 0.2431654 1.1845906 -0.0000000), wk = 0.0027027 k( 58) = ( 0.2475076 1.2057440 -0.0000000), wk = 0.0027027 k( 59) = ( 0.2518498 1.2268974 -0.0000000), wk = 0.0027027 k( 60) = ( 0.2561921 1.2480509 -0.0000000), wk = 0.0027027 k( 61) = ( 0.2605343 1.2692043 -0.0000000), wk = 0.0027027 k( 62) = ( 0.2605343 1.2692043 -0.0000000), wk = 0.0027027 k( 63) = ( 0.2388231 1.2692042 -0.0000000), wk = 0.0027027 k( 64) = ( 0.2171119 1.2692043 -0.0000000), wk = 0.0027027 k( 65) = ( 0.1954008 1.2692043 -0.0000000), wk = 0.0027027 k( 66) = ( 0.1736895 1.2692043 -0.0000000), wk = 0.0027027 k( 67) = ( 0.1519784 1.2692043 -0.0000000), wk = 0.0027027 k( 68) = ( 0.1302672 1.2692042 -0.0000000), wk = 0.0027027 k( 69) = ( 0.1085560 1.2692043 -0.0000000), wk = 0.0027027 k( 70) = ( 0.0868448 1.2692043 -0.0000000), wk = 0.0027027 k( 71) = ( 0.0651336 1.2692043 -0.0000000), wk = 0.0027027 k( 72) = ( 0.0434224 1.2692043 -0.0000000), wk = 0.0027027 k( 73) = ( 0.0217112 1.2692043 -0.0000000), wk = 0.0027027 k( 74) = ( 0.0000000 1.2692043 -0.0000000), wk = 0.0027027 k( 75) = ( 0.0000000 1.2692043 -0.0000000), wk = 0.0027027 k( 76) = ( 0.0000000 1.2692043 0.0212890), wk = 0.0027027 k( 77) = ( 0.0000000 1.2692043 0.0425779), wk = 0.0027027 k( 78) = ( 0.0000000 1.2692043 0.0638669), wk = 0.0027027 k( 79) = ( 0.0000000 1.2692043 0.0851558), wk = 0.0027027 k( 80) = ( 0.0000000 1.2692043 0.1064448), wk = 0.0027027 k( 81) = ( 0.0000000 1.2692043 0.1277338), wk = 0.0027027 k( 82) = ( 0.0000000 1.2692043 0.1490227), wk = 0.0027027 k( 83) = ( 0.0000000 1.2692043 0.1703117), wk = 0.0027027 k( 84) = ( 0.0000000 1.2692043 0.1916007), wk = 0.0027027 k( 85) = ( 0.0000000 1.2692043 0.2128896), wk = 0.0027027 k( 86) = ( 0.0000000 1.2692043 0.2341786), wk = 0.0027027 k( 87) = ( 0.0000000 1.2692043 0.2554675), wk = 0.0027027 k( 88) = ( 0.0000000 1.2692043 0.2767565), wk = 0.0027027 k( 89) = ( 0.0000000 1.2692043 0.2980455), wk = 0.0027027 k( 90) = ( 0.0000000 1.2692043 0.2980455), wk = 0.0027027 k( 91) = ( 0.0217112 1.2692043 0.2980455), wk = 0.0027027 k( 92) = ( 0.0434224 1.2692043 0.2980455), wk = 0.0027027 k( 93) = ( 0.0651336 1.2692043 0.2980455), wk = 0.0027027 k( 94) = ( 0.0868448 1.2692043 0.2980455), wk = 0.0027027 k( 95) = ( 0.1085560 1.2692043 0.2980455), wk = 0.0027027 k( 96) = ( 0.1302672 1.2692042 0.2980455), wk = 0.0027027 k( 97) = ( 0.1519784 1.2692043 0.2980455), wk = 0.0027027 k( 98) = ( 0.1736895 1.2692043 0.2980455), wk = 0.0027027 k( 99) = ( 0.1954008 1.2692043 0.2980455), wk = 0.0027027 k( 100) = ( 0.2171119 1.2692043 0.2980455), wk = 0.0027027 k( 101) = ( 0.2388231 1.2692042 0.2980455), wk = 0.0027027 k( 102) = ( 0.2605343 1.2692043 0.2980455), wk = 0.0027027 k( 103) = ( 0.2605343 1.2692043 0.2980455), wk = 0.0027027 k( 104) = ( 0.2561921 1.2480509 0.2980455), wk = 0.0027027 k( 105) = ( 0.2518498 1.2268974 0.2980455), wk = 0.0027027 k( 106) = ( 0.2475076 1.2057440 0.2980455), wk = 0.0027027 k( 107) = ( 0.2431654 1.1845906 0.2980455), wk = 0.0027027 k( 108) = ( 0.2388231 1.1634372 0.2980455), wk = 0.0027027 k( 109) = ( 0.2344809 1.1422839 0.2980455), wk = 0.0027027 k( 110) = ( 0.2301387 1.1211304 0.2980455), wk = 0.0027027 k( 111) = ( 0.2257964 1.0999770 0.2980455), wk = 0.0027027 k( 112) = ( 0.2214542 1.0788236 0.2980455), wk = 0.0027027 k( 113) = ( 0.2171119 1.0576702 0.2980455), wk = 0.0027027 k( 114) = ( 0.2127697 1.0365168 0.2980455), wk = 0.0027027 k( 115) = ( 0.2084275 1.0153634 0.2980455), wk = 0.0027027 k( 116) = ( 0.2040852 0.9942100 0.2980455), wk = 0.0027027 k( 117) = ( 0.1997430 0.9730566 0.2980455), wk = 0.0027027 k( 118) = ( 0.1954008 0.9519032 0.2980455), wk = 0.0027027 k( 119) = ( 0.1910585 0.9307498 0.2980455), wk = 0.0027027 k( 120) = ( 0.1867163 0.9095964 0.2980455), wk = 0.0027027 k( 121) = ( 0.1823740 0.8884430 0.2980455), wk = 0.0027027 k( 122) = ( 0.1780318 0.8672896 0.2980455), wk = 0.0027027 k( 123) = ( 0.1736895 0.8461362 0.2980455), wk = 0.0027027 k( 124) = ( 0.1693473 0.8249828 0.2980455), wk = 0.0027027 k( 125) = ( 0.1650051 0.8038293 0.2980455), wk = 0.0027027 k( 126) = ( 0.1606628 0.7826760 0.2980455), wk = 0.0027027 k( 127) = ( 0.1563206 0.7615226 0.2980455), wk = 0.0027027 k( 128) = ( 0.1519784 0.7403692 0.2980455), wk = 0.0027027 k( 129) = ( 0.1476361 0.7192158 0.2980455), wk = 0.0027027 k( 130) = ( 0.1432939 0.6980623 0.2980455), wk = 0.0027027 k( 131) = ( 0.1389516 0.6769089 0.2980455), wk = 0.0027027 k( 132) = ( 0.1346094 0.6557555 0.2980455), wk = 0.0027027 k( 133) = ( 0.1302672 0.6346021 0.2980455), wk = 0.0027027 k( 134) = ( 0.1259249 0.6134487 0.2980455), wk = 0.0027027 k( 135) = ( 0.1215827 0.5922953 0.2980455), wk = 0.0027027 k( 136) = ( 0.1172404 0.5711419 0.2980455), wk = 0.0027027 k( 137) = ( 0.1128982 0.5499885 0.2980455), wk = 0.0027027 k( 138) = ( 0.1085560 0.5288351 0.2980455), wk = 0.0027027 k( 139) = ( 0.1042137 0.5076817 0.2980455), wk = 0.0027027 k( 140) = ( 0.0998715 0.4865283 0.2980455), wk = 0.0027027 k( 141) = ( 0.0955292 0.4653749 0.2980455), wk = 0.0027027 k( 142) = ( 0.0911870 0.4442215 0.2980455), wk = 0.0027027 k( 143) = ( 0.0868448 0.4230681 0.2980455), wk = 0.0027027 k( 144) = ( 0.0825025 0.4019147 0.2980455), wk = 0.0027027 k( 145) = ( 0.0781603 0.3807613 0.2980455), wk = 0.0027027 k( 146) = ( 0.0738181 0.3596079 0.2980455), wk = 0.0027027 k( 147) = ( 0.0694758 0.3384545 0.2980455), wk = 0.0027027 k( 148) = ( 0.0651336 0.3173011 0.2980455), wk = 0.0027027 k( 149) = ( 0.0607913 0.2961476 0.2980455), wk = 0.0027027 k( 150) = ( 0.0564491 0.2749942 0.2980455), wk = 0.0027027 k( 151) = ( 0.0521069 0.2538409 0.2980455), wk = 0.0027027 k( 152) = ( 0.0477646 0.2326875 0.2980455), wk = 0.0027027 k( 153) = ( 0.0434224 0.2115341 0.2980455), wk = 0.0027027 k( 154) = ( 0.0390802 0.1903806 0.2980455), wk = 0.0027027 k( 155) = ( 0.0347379 0.1692272 0.2980455), wk = 0.0027027 k( 156) = ( 0.0303957 0.1480738 0.2980455), wk = 0.0027027 k( 157) = ( 0.0260534 0.1269204 0.2980455), wk = 0.0027027 k( 158) = ( 0.0217112 0.1057670 0.2980455), wk = 0.0027027 k( 159) = ( 0.0173690 0.0846136 0.2980455), wk = 0.0027027 k( 160) = ( 0.0130267 0.0634602 0.2980455), wk = 0.0027027 k( 161) = ( 0.0086845 0.0423068 0.2980455), wk = 0.0027027 k( 162) = ( 0.0043422 0.0211534 0.2980455), wk = 0.0027027 k( 163) = ( 0.0000000 0.0000000 0.2980455), wk = 0.0027027 k( 164) = ( 0.0000000 0.0000000 0.2980455), wk = 0.0027027 k( 165) = ( 0.0000000 0.0000000 0.2767565), wk = 0.0027027 k( 166) = ( 0.0000000 0.0000000 0.2554675), wk = 0.0027027 k( 167) = ( 0.0000000 0.0000000 0.2341786), wk = 0.0027027 k( 168) = ( 0.0000000 0.0000000 0.2128896), wk = 0.0027027 k( 169) = ( 0.0000000 0.0000000 0.1916007), wk = 0.0027027 k( 170) = ( 0.0000000 0.0000000 0.1703117), wk = 0.0027027 k( 171) = ( 0.0000000 0.0000000 0.1490227), wk = 0.0027027 k( 172) = ( 0.0000000 0.0000000 0.1277338), wk = 0.0027027 k( 173) = ( 0.0000000 0.0000000 0.1064448), wk = 0.0027027 k( 174) = ( 0.0000000 0.0000000 0.0851558), wk = 0.0027027 k( 175) = ( 0.0000000 0.0000000 0.0638669), wk = 0.0027027 k( 176) = ( 0.0000000 0.0000000 0.0425779), wk = 0.0027027 k( 177) = ( 0.0000000 0.0000000 0.0212890), wk = 0.0027027 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 180) = ( -0.0208333 0.0042765 0.0000000), wk = 0.0027027 k( 181) = ( -0.0416667 0.0085531 0.0000000), wk = 0.0027027 k( 182) = ( -0.0625000 0.0128296 0.0000000), wk = 0.0027027 k( 183) = ( -0.0833333 0.0171061 0.0000000), wk = 0.0027027 k( 184) = ( -0.1041667 0.0213827 0.0000000), wk = 0.0027027 k( 185) = ( -0.1250000 0.0256592 0.0000000), wk = 0.0027027 k( 186) = ( -0.1458333 0.0299358 0.0000000), wk = 0.0027027 k( 187) = ( -0.1666667 0.0342123 0.0000000), wk = 0.0027027 k( 188) = ( -0.1875000 0.0384888 0.0000000), wk = 0.0027027 k( 189) = ( -0.2083333 0.0427654 0.0000000), wk = 0.0027027 k( 190) = ( -0.2291667 0.0470419 0.0000000), wk = 0.0027027 k( 191) = ( -0.2500000 0.0513184 0.0000000), wk = 0.0027027 k( 192) = ( -0.2708333 0.0555950 0.0000000), wk = 0.0027027 k( 193) = ( -0.2916667 0.0598715 0.0000000), wk = 0.0027027 k( 194) = ( -0.3125000 0.0641480 0.0000000), wk = 0.0027027 k( 195) = ( -0.3333333 0.0684246 0.0000000), wk = 0.0027027 k( 196) = ( -0.3541667 0.0727011 0.0000000), wk = 0.0027027 k( 197) = ( -0.3750000 0.0769777 0.0000000), wk = 0.0027027 k( 198) = ( -0.3958333 0.0812542 0.0000000), wk = 0.0027027 k( 199) = ( -0.4166667 0.0855307 0.0000000), wk = 0.0027027 k( 200) = ( -0.4375000 0.0898073 0.0000000), wk = 0.0027027 k( 201) = ( -0.4583333 0.0940838 0.0000000), wk = 0.0027027 k( 202) = ( -0.4791667 0.0983603 0.0000000), wk = 0.0027027 k( 203) = ( -0.5000000 0.1026369 0.0000000), wk = 0.0027027 k( 204) = ( -0.5000000 0.1026369 0.0000000), wk = 0.0027027 k( 205) = ( -0.4956461 0.1238472 -0.0000000), wk = 0.0027027 k( 206) = ( -0.4912922 0.1450575 -0.0000000), wk = 0.0027027 k( 207) = ( -0.4869382 0.1662678 -0.0000000), wk = 0.0027027 k( 208) = ( -0.4825843 0.1874782 -0.0000000), wk = 0.0027027 k( 209) = ( -0.4782304 0.2086885 -0.0000000), wk = 0.0027027 k( 210) = ( -0.4738765 0.2298988 -0.0000000), wk = 0.0027027 k( 211) = ( -0.4695225 0.2511091 -0.0000000), wk = 0.0027027 k( 212) = ( -0.4651686 0.2723194 -0.0000000), wk = 0.0027027 k( 213) = ( -0.4608147 0.2935297 -0.0000000), wk = 0.0027027 k( 214) = ( -0.4564608 0.3147400 -0.0000000), wk = 0.0027027 k( 215) = ( -0.4521069 0.3359503 -0.0000000), wk = 0.0027027 k( 216) = ( -0.4477529 0.3571607 -0.0000000), wk = 0.0027027 k( 217) = ( -0.4433990 0.3783710 -0.0000000), wk = 0.0027027 k( 218) = ( -0.4390451 0.3995813 -0.0000000), wk = 0.0027027 k( 219) = ( -0.4346912 0.4207916 -0.0000000), wk = 0.0027027 k( 220) = ( -0.4303373 0.4420019 -0.0000000), wk = 0.0027027 k( 221) = ( -0.4259833 0.4632122 -0.0000000), wk = 0.0027027 k( 222) = ( -0.4216294 0.4844226 -0.0000000), wk = 0.0027027 k( 223) = ( -0.4172755 0.5056329 -0.0000000), wk = 0.0027027 k( 224) = ( -0.4129216 0.5268432 -0.0000000), wk = 0.0027027 k( 225) = ( -0.4085677 0.5480535 -0.0000000), wk = 0.0027027 k( 226) = ( -0.4042137 0.5692638 -0.0000000), wk = 0.0027027 k( 227) = ( -0.3998598 0.5904742 -0.0000000), wk = 0.0027027 k( 228) = ( -0.3955059 0.6116845 -0.0000000), wk = 0.0027027 k( 229) = ( -0.3911520 0.6328948 -0.0000000), wk = 0.0027027 k( 230) = ( -0.3867981 0.6541051 -0.0000000), wk = 0.0027027 k( 231) = ( -0.3824441 0.6753154 -0.0000000), wk = 0.0027027 k( 232) = ( -0.3780902 0.6965257 -0.0000000), wk = 0.0027027 k( 233) = ( -0.3737363 0.7177361 -0.0000000), wk = 0.0027027 k( 234) = ( -0.3693824 0.7389464 -0.0000000), wk = 0.0027027 k( 235) = ( -0.3650284 0.7601567 -0.0000000), wk = 0.0027027 k( 236) = ( -0.3606745 0.7813670 -0.0000000), wk = 0.0027027 k( 237) = ( -0.3563206 0.8025773 -0.0000000), wk = 0.0027027 k( 238) = ( -0.3519667 0.8237876 -0.0000000), wk = 0.0027027 k( 239) = ( -0.3476128 0.8449980 -0.0000000), wk = 0.0027027 k( 240) = ( -0.3432588 0.8662083 -0.0000000), wk = 0.0027027 k( 241) = ( -0.3389049 0.8874186 -0.0000000), wk = 0.0027027 k( 242) = ( -0.3345510 0.9086289 -0.0000000), wk = 0.0027027 k( 243) = ( -0.3301971 0.9298392 -0.0000000), wk = 0.0027027 k( 244) = ( -0.3258432 0.9510495 -0.0000000), wk = 0.0027027 k( 245) = ( -0.3214892 0.9722598 -0.0000000), wk = 0.0027027 k( 246) = ( -0.3171353 0.9934701 -0.0000000), wk = 0.0027027 k( 247) = ( -0.3127814 1.0146805 -0.0000000), wk = 0.0027027 k( 248) = ( -0.3084275 1.0358908 -0.0000000), wk = 0.0027027 k( 249) = ( -0.3040735 1.0571011 -0.0000000), wk = 0.0027027 k( 250) = ( -0.2997196 1.0783114 -0.0000000), wk = 0.0027027 k( 251) = ( -0.2953657 1.0995217 -0.0000000), wk = 0.0027027 k( 252) = ( -0.2910118 1.1207320 -0.0000000), wk = 0.0027027 k( 253) = ( -0.2866579 1.1419424 -0.0000000), wk = 0.0027027 k( 254) = ( -0.2823039 1.1631527 -0.0000000), wk = 0.0027027 k( 255) = ( -0.2779500 1.1843630 -0.0000000), wk = 0.0027027 k( 256) = ( -0.2735961 1.2055733 -0.0000000), wk = 0.0027027 k( 257) = ( -0.2692422 1.2267836 -0.0000000), wk = 0.0027027 k( 258) = ( -0.2648882 1.2479939 -0.0000000), wk = 0.0027027 k( 259) = ( -0.2605343 1.2692043 -0.0000000), wk = 0.0027027 k( 260) = ( -0.2605343 1.2692043 -0.0000000), wk = 0.0027027 k( 261) = ( -0.2605343 1.2692043 0.0212890), wk = 0.0027027 k( 262) = ( -0.2605343 1.2692043 0.0425779), wk = 0.0027027 k( 263) = ( -0.2605343 1.2692043 0.0638669), wk = 0.0027027 k( 264) = ( -0.2605343 1.2692043 0.0851558), wk = 0.0027027 k( 265) = ( -0.2605343 1.2692043 0.1064448), wk = 0.0027027 k( 266) = ( -0.2605343 1.2692043 0.1277338), wk = 0.0027027 k( 267) = ( -0.2605343 1.2692043 0.1490227), wk = 0.0027027 k( 268) = ( -0.2605343 1.2692043 0.1703117), wk = 0.0027027 k( 269) = ( -0.2605343 1.2692043 0.1916007), wk = 0.0027027 k( 270) = ( -0.2605343 1.2692043 0.2128896), wk = 0.0027027 k( 271) = ( -0.2605343 1.2692043 0.2341786), wk = 0.0027027 k( 272) = ( -0.2605343 1.2692043 0.2554675), wk = 0.0027027 k( 273) = ( -0.2605343 1.2692043 0.2767565), wk = 0.0027027 k( 274) = ( -0.2605343 1.2692043 0.2980455), wk = 0.0027027 k( 275) = ( -0.2605343 1.2692043 0.2980455), wk = 0.0027027 k( 276) = ( -0.2648882 1.2479939 0.2980455), wk = 0.0027027 k( 277) = ( -0.2692422 1.2267836 0.2980455), wk = 0.0027027 k( 278) = ( -0.2735961 1.2055733 0.2980455), wk = 0.0027027 k( 279) = ( -0.2779500 1.1843630 0.2980455), wk = 0.0027027 k( 280) = ( -0.2823039 1.1631527 0.2980455), wk = 0.0027027 k( 281) = ( -0.2866579 1.1419424 0.2980455), wk = 0.0027027 k( 282) = ( -0.2910118 1.1207320 0.2980455), wk = 0.0027027 k( 283) = ( -0.2953657 1.0995217 0.2980455), wk = 0.0027027 k( 284) = ( -0.2997196 1.0783114 0.2980455), wk = 0.0027027 k( 285) = ( -0.3040735 1.0571011 0.2980455), wk = 0.0027027 k( 286) = ( -0.3084275 1.0358908 0.2980455), wk = 0.0027027 k( 287) = ( -0.3127814 1.0146805 0.2980455), wk = 0.0027027 k( 288) = ( -0.3171353 0.9934701 0.2980455), wk = 0.0027027 k( 289) = ( -0.3214892 0.9722598 0.2980455), wk = 0.0027027 k( 290) = ( -0.3258432 0.9510495 0.2980455), wk = 0.0027027 k( 291) = ( -0.3301971 0.9298392 0.2980455), wk = 0.0027027 k( 292) = ( -0.3345510 0.9086289 0.2980455), wk = 0.0027027 k( 293) = ( -0.3389049 0.8874186 0.2980455), wk = 0.0027027 k( 294) = ( -0.3432588 0.8662083 0.2980455), wk = 0.0027027 k( 295) = ( -0.3476128 0.8449980 0.2980455), wk = 0.0027027 k( 296) = ( -0.3519667 0.8237876 0.2980455), wk = 0.0027027 k( 297) = ( -0.3563206 0.8025773 0.2980455), wk = 0.0027027 k( 298) = ( -0.3606745 0.7813670 0.2980455), wk = 0.0027027 k( 299) = ( -0.3650284 0.7601567 0.2980455), wk = 0.0027027 k( 300) = ( -0.3693824 0.7389464 0.2980455), wk = 0.0027027 k( 301) = ( -0.3737363 0.7177361 0.2980455), wk = 0.0027027 k( 302) = ( -0.3780902 0.6965257 0.2980455), wk = 0.0027027 k( 303) = ( -0.3824441 0.6753154 0.2980455), wk = 0.0027027 k( 304) = ( -0.3867981 0.6541051 0.2980455), wk = 0.0027027 k( 305) = ( -0.3911520 0.6328948 0.2980455), wk = 0.0027027 k( 306) = ( -0.3955059 0.6116845 0.2980455), wk = 0.0027027 k( 307) = ( -0.3998598 0.5904742 0.2980455), wk = 0.0027027 k( 308) = ( -0.4042137 0.5692638 0.2980455), wk = 0.0027027 k( 309) = ( -0.4085677 0.5480535 0.2980455), wk = 0.0027027 k( 310) = ( -0.4129216 0.5268432 0.2980455), wk = 0.0027027 k( 311) = ( -0.4172755 0.5056329 0.2980455), wk = 0.0027027 k( 312) = ( -0.4216294 0.4844226 0.2980455), wk = 0.0027027 k( 313) = ( -0.4259833 0.4632122 0.2980455), wk = 0.0027027 k( 314) = ( -0.4303373 0.4420019 0.2980455), wk = 0.0027027 k( 315) = ( -0.4346912 0.4207916 0.2980455), wk = 0.0027027 k( 316) = ( -0.4390451 0.3995813 0.2980455), wk = 0.0027027 k( 317) = ( -0.4433990 0.3783710 0.2980455), wk = 0.0027027 k( 318) = ( -0.4477529 0.3571607 0.2980455), wk = 0.0027027 k( 319) = ( -0.4521069 0.3359503 0.2980455), wk = 0.0027027 k( 320) = ( -0.4564608 0.3147400 0.2980455), wk = 0.0027027 k( 321) = ( -0.4608147 0.2935297 0.2980455), wk = 0.0027027 k( 322) = ( -0.4651686 0.2723194 0.2980455), wk = 0.0027027 k( 323) = ( -0.4695225 0.2511091 0.2980455), wk = 0.0027027 k( 324) = ( -0.4738765 0.2298988 0.2980455), wk = 0.0027027 k( 325) = ( -0.4782304 0.2086885 0.2980455), wk = 0.0027027 k( 326) = ( -0.4825843 0.1874782 0.2980455), wk = 0.0027027 k( 327) = ( -0.4869382 0.1662678 0.2980455), wk = 0.0027027 k( 328) = ( -0.4912922 0.1450575 0.2980455), wk = 0.0027027 k( 329) = ( -0.4956461 0.1238472 0.2980455), wk = 0.0027027 k( 330) = ( -0.5000000 0.1026369 0.2980455), wk = 0.0027027 k( 331) = ( -0.5000000 0.1026369 0.2980455), wk = 0.0027027 k( 332) = ( -0.5000000 0.1026369 0.2767565), wk = 0.0027027 k( 333) = ( -0.5000000 0.1026369 0.2554675), wk = 0.0027027 k( 334) = ( -0.5000000 0.1026369 0.2341786), wk = 0.0027027 k( 335) = ( -0.5000000 0.1026369 0.2128896), wk = 0.0027027 k( 336) = ( -0.5000000 0.1026369 0.1916007), wk = 0.0027027 k( 337) = ( -0.5000000 0.1026369 0.1703117), wk = 0.0027027 k( 338) = ( -0.5000000 0.1026369 0.1490227), wk = 0.0027027 k( 339) = ( -0.5000000 0.1026369 0.1277338), wk = 0.0027027 k( 340) = ( -0.5000000 0.1026369 0.1064448), wk = 0.0027027 k( 341) = ( -0.5000000 0.1026369 0.0851558), wk = 0.0027027 k( 342) = ( -0.5000000 0.1026369 0.0638669), wk = 0.0027027 k( 343) = ( -0.5000000 0.1026369 0.0425779), wk = 0.0027027 k( 344) = ( -0.5000000 0.1026369 0.0212890), wk = 0.0027027 k( 345) = ( -0.5000000 0.1026369 0.0000000), wk = 0.0027027 k( 346) = ( 0.0000000 0.0000000 0.2980455), wk = 0.0027027 k( 347) = ( -0.0208333 0.0042765 0.2980455), wk = 0.0027027 k( 348) = ( -0.0416667 0.0085531 0.2980455), wk = 0.0027027 k( 349) = ( -0.0625000 0.0128296 0.2980455), wk = 0.0027027 k( 350) = ( -0.0833333 0.0171061 0.2980455), wk = 0.0027027 k( 351) = ( -0.1041667 0.0213827 0.2980455), wk = 0.0027027 k( 352) = ( -0.1250000 0.0256592 0.2980455), wk = 0.0027027 k( 353) = ( -0.1458333 0.0299358 0.2980455), wk = 0.0027027 k( 354) = ( -0.1666667 0.0342123 0.2980455), wk = 0.0027027 k( 355) = ( -0.1875000 0.0384888 0.2980455), wk = 0.0027027 k( 356) = ( -0.2083333 0.0427654 0.2980455), wk = 0.0027027 k( 357) = ( -0.2291667 0.0470419 0.2980455), wk = 0.0027027 k( 358) = ( -0.2500000 0.0513184 0.2980455), wk = 0.0027027 k( 359) = ( -0.2708333 0.0555950 0.2980455), wk = 0.0027027 k( 360) = ( -0.2916667 0.0598715 0.2980455), wk = 0.0027027 k( 361) = ( -0.3125000 0.0641480 0.2980455), wk = 0.0027027 k( 362) = ( -0.3333333 0.0684246 0.2980455), wk = 0.0027027 k( 363) = ( -0.3541667 0.0727011 0.2980455), wk = 0.0027027 k( 364) = ( -0.3750000 0.0769777 0.2980455), wk = 0.0027027 k( 365) = ( -0.3958333 0.0812542 0.2980455), wk = 0.0027027 k( 366) = ( -0.4166667 0.0855307 0.2980455), wk = 0.0027027 k( 367) = ( -0.4375000 0.0898073 0.2980455), wk = 0.0027027 k( 368) = ( -0.4583333 0.0940838 0.2980455), wk = 0.0027027 k( 369) = ( -0.4791667 0.0983603 0.2980455), wk = 0.0027027 k( 370) = ( -0.5000000 0.1026369 0.2980455), wk = 0.0027027 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 2) = ( 0.0043422 0.0043422 0.0000000), wk = 0.0027027 k( 3) = ( 0.0086845 0.0086845 0.0000000), wk = 0.0027027 k( 4) = ( 0.0130267 0.0130267 0.0000000), wk = 0.0027027 k( 5) = ( 0.0173690 0.0173690 0.0000000), wk = 0.0027027 k( 6) = ( 0.0217112 0.0217112 -0.0000000), wk = 0.0027027 k( 7) = ( 0.0260534 0.0260534 -0.0000000), wk = 0.0027027 k( 8) = ( 0.0303957 0.0303957 0.0000000), wk = 0.0027027 k( 9) = ( 0.0347379 0.0347379 0.0000000), wk = 0.0027027 k( 10) = ( 0.0390802 0.0390802 0.0000000), wk = 0.0027027 k( 11) = ( 0.0434224 0.0434224 0.0000000), wk = 0.0027027 k( 12) = ( 0.0477646 0.0477646 0.0000000), wk = 0.0027027 k( 13) = ( 0.0521069 0.0521069 0.0000000), wk = 0.0027027 k( 14) = ( 0.0564491 0.0564491 -0.0000000), wk = 0.0027027 k( 15) = ( 0.0607913 0.0607913 0.0000000), wk = 0.0027027 k( 16) = ( 0.0651336 0.0651336 0.0000000), wk = 0.0027027 k( 17) = ( 0.0694758 0.0694758 0.0000000), wk = 0.0027027 k( 18) = ( 0.0738181 0.0738181 0.0000000), wk = 0.0027027 k( 19) = ( 0.0781603 0.0781603 0.0000000), wk = 0.0027027 k( 20) = ( 0.0825025 0.0825025 0.0000000), wk = 0.0027027 k( 21) = ( 0.0868448 0.0868448 0.0000000), wk = 0.0027027 k( 22) = ( 0.0911870 0.0911870 0.0000000), wk = 0.0027027 k( 23) = ( 0.0955292 0.0955292 0.0000000), wk = 0.0027027 k( 24) = ( 0.0998715 0.0998715 -0.0000000), wk = 0.0027027 k( 25) = ( 0.1042137 0.1042137 0.0000000), wk = 0.0027027 k( 26) = ( 0.1085560 0.1085560 0.0000000), wk = 0.0027027 k( 27) = ( 0.1128982 0.1128982 0.0000000), wk = 0.0027027 k( 28) = ( 0.1172404 0.1172404 -0.0000000), wk = 0.0027027 k( 29) = ( 0.1215827 0.1215827 -0.0000000), wk = 0.0027027 k( 30) = ( 0.1259249 0.1259249 -0.0000000), wk = 0.0027027 k( 31) = ( 0.1302672 0.1302672 0.0000000), wk = 0.0027027 k( 32) = ( 0.1346094 0.1346094 0.0000000), wk = 0.0027027 k( 33) = ( 0.1389516 0.1389516 0.0000000), wk = 0.0027027 k( 34) = ( 0.1432939 0.1432939 -0.0000000), wk = 0.0027027 k( 35) = ( 0.1476361 0.1476361 0.0000000), wk = 0.0027027 k( 36) = ( 0.1519784 0.1519784 -0.0000000), wk = 0.0027027 k( 37) = ( 0.1563206 0.1563206 0.0000000), wk = 0.0027027 k( 38) = ( 0.1606628 0.1606628 -0.0000000), wk = 0.0027027 k( 39) = ( 0.1650051 0.1650051 0.0000000), wk = 0.0027027 k( 40) = ( 0.1693473 0.1693473 -0.0000000), wk = 0.0027027 k( 41) = ( 0.1736895 0.1736895 0.0000000), wk = 0.0027027 k( 42) = ( 0.1780318 0.1780318 -0.0000000), wk = 0.0027027 k( 43) = ( 0.1823740 0.1823740 0.0000000), wk = 0.0027027 k( 44) = ( 0.1867163 0.1867163 0.0000000), wk = 0.0027027 k( 45) = ( 0.1910585 0.1910585 0.0000000), wk = 0.0027027 k( 46) = ( 0.1954008 0.1954008 0.0000000), wk = 0.0027027 k( 47) = ( 0.1997430 0.1997430 -0.0000000), wk = 0.0027027 k( 48) = ( 0.2040852 0.2040852 0.0000000), wk = 0.0027027 k( 49) = ( 0.2084275 0.2084275 0.0000000), wk = 0.0027027 k( 50) = ( 0.2127697 0.2127697 -0.0000000), wk = 0.0027027 k( 51) = ( 0.2171119 0.2171119 0.0000000), wk = 0.0027027 k( 52) = ( 0.2214542 0.2214542 0.0000000), wk = 0.0027027 k( 53) = ( 0.2257964 0.2257964 0.0000000), wk = 0.0027027 k( 54) = ( 0.2301387 0.2301387 0.0000000), wk = 0.0027027 k( 55) = ( 0.2344809 0.2344809 -0.0000000), wk = 0.0027027 k( 56) = ( 0.2388231 0.2388231 -0.0000000), wk = 0.0027027 k( 57) = ( 0.2431654 0.2431654 0.0000000), wk = 0.0027027 k( 58) = ( 0.2475076 0.2475076 0.0000000), wk = 0.0027027 k( 59) = ( 0.2518498 0.2518498 0.0000000), wk = 0.0027027 k( 60) = ( 0.2561921 0.2561921 -0.0000000), wk = 0.0027027 k( 61) = ( 0.2605343 0.2605343 0.0000000), wk = 0.0027027 k( 62) = ( 0.2605343 0.2605343 0.0000000), wk = 0.0027027 k( 63) = ( 0.2388231 0.2804898 -0.0000000), wk = 0.0027027 k( 64) = ( 0.2171119 0.3004453 -0.0000000), wk = 0.0027027 k( 65) = ( 0.1954008 0.3204008 -0.0000000), wk = 0.0027027 k( 66) = ( 0.1736895 0.3403562 0.0000000), wk = 0.0027027 k( 67) = ( 0.1519784 0.3603117 0.0000000), wk = 0.0027027 k( 68) = ( 0.1302672 0.3802672 -0.0000000), wk = 0.0027027 k( 69) = ( 0.1085560 0.4002226 -0.0000000), wk = 0.0027027 k( 70) = ( 0.0868448 0.4201781 0.0000000), wk = 0.0027027 k( 71) = ( 0.0651336 0.4401336 0.0000000), wk = 0.0027027 k( 72) = ( 0.0434224 0.4600890 0.0000000), wk = 0.0027027 k( 73) = ( 0.0217112 0.4800445 -0.0000000), wk = 0.0027027 k( 74) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027027 k( 75) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0027027 k( 76) = ( 0.0000000 0.5000000 0.0357143), wk = 0.0027027 k( 77) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0027027 k( 78) = ( 0.0000000 0.5000000 0.1071429), wk = 0.0027027 k( 79) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0027027 k( 80) = ( 0.0000000 0.5000000 0.1785714), wk = 0.0027027 k( 81) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0027027 k( 82) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027027 k( 83) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0027027 k( 84) = ( 0.0000000 0.5000000 0.3214286), wk = 0.0027027 k( 85) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0027027 k( 86) = ( 0.0000000 0.5000000 0.3928571), wk = 0.0027027 k( 87) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0027027 k( 88) = ( 0.0000000 0.5000000 0.4642857), wk = 0.0027027 k( 89) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027027 k( 90) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027027 k( 91) = ( 0.0217112 0.4800445 0.5000000), wk = 0.0027027 k( 92) = ( 0.0434224 0.4600890 0.5000000), wk = 0.0027027 k( 93) = ( 0.0651336 0.4401336 0.5000000), wk = 0.0027027 k( 94) = ( 0.0868448 0.4201781 0.5000000), wk = 0.0027027 k( 95) = ( 0.1085560 0.4002226 0.5000000), wk = 0.0027027 k( 96) = ( 0.1302672 0.3802672 0.5000000), wk = 0.0027027 k( 97) = ( 0.1519784 0.3603117 0.5000000), wk = 0.0027027 k( 98) = ( 0.1736895 0.3403562 0.5000000), wk = 0.0027027 k( 99) = ( 0.1954008 0.3204008 0.5000000), wk = 0.0027027 k( 100) = ( 0.2171119 0.3004453 0.5000000), wk = 0.0027027 k( 101) = ( 0.2388231 0.2804898 0.5000000), wk = 0.0027027 k( 102) = ( 0.2605343 0.2605343 0.5000000), wk = 0.0027027 k( 103) = ( 0.2605343 0.2605343 0.5000000), wk = 0.0027027 k( 104) = ( 0.2561921 0.2561921 0.5000000), wk = 0.0027027 k( 105) = ( 0.2518498 0.2518498 0.5000000), wk = 0.0027027 k( 106) = ( 0.2475076 0.2475076 0.5000000), wk = 0.0027027 k( 107) = ( 0.2431654 0.2431654 0.5000000), wk = 0.0027027 k( 108) = ( 0.2388231 0.2388231 0.5000000), wk = 0.0027027 k( 109) = ( 0.2344809 0.2344809 0.5000000), wk = 0.0027027 k( 110) = ( 0.2301387 0.2301387 0.5000000), wk = 0.0027027 k( 111) = ( 0.2257964 0.2257964 0.5000000), wk = 0.0027027 k( 112) = ( 0.2214542 0.2214542 0.5000000), wk = 0.0027027 k( 113) = ( 0.2171119 0.2171119 0.5000000), wk = 0.0027027 k( 114) = ( 0.2127697 0.2127697 0.5000000), wk = 0.0027027 k( 115) = ( 0.2084275 0.2084275 0.5000000), wk = 0.0027027 k( 116) = ( 0.2040852 0.2040852 0.5000000), wk = 0.0027027 k( 117) = ( 0.1997430 0.1997430 0.5000000), wk = 0.0027027 k( 118) = ( 0.1954008 0.1954008 0.5000000), wk = 0.0027027 k( 119) = ( 0.1910585 0.1910585 0.5000000), wk = 0.0027027 k( 120) = ( 0.1867163 0.1867163 0.5000000), wk = 0.0027027 k( 121) = ( 0.1823740 0.1823740 0.5000000), wk = 0.0027027 k( 122) = ( 0.1780318 0.1780318 0.5000000), wk = 0.0027027 k( 123) = ( 0.1736895 0.1736895 0.5000000), wk = 0.0027027 k( 124) = ( 0.1693473 0.1693473 0.5000000), wk = 0.0027027 k( 125) = ( 0.1650051 0.1650051 0.5000000), wk = 0.0027027 k( 126) = ( 0.1606628 0.1606628 0.5000000), wk = 0.0027027 k( 127) = ( 0.1563206 0.1563206 0.5000000), wk = 0.0027027 k( 128) = ( 0.1519784 0.1519784 0.5000000), wk = 0.0027027 k( 129) = ( 0.1476361 0.1476361 0.5000000), wk = 0.0027027 k( 130) = ( 0.1432939 0.1432939 0.5000000), wk = 0.0027027 k( 131) = ( 0.1389516 0.1389516 0.5000000), wk = 0.0027027 k( 132) = ( 0.1346094 0.1346094 0.5000000), wk = 0.0027027 k( 133) = ( 0.1302672 0.1302672 0.5000000), wk = 0.0027027 k( 134) = ( 0.1259249 0.1259249 0.5000000), wk = 0.0027027 k( 135) = ( 0.1215827 0.1215827 0.5000000), wk = 0.0027027 k( 136) = ( 0.1172404 0.1172404 0.5000000), wk = 0.0027027 k( 137) = ( 0.1128982 0.1128982 0.5000000), wk = 0.0027027 k( 138) = ( 0.1085560 0.1085560 0.5000000), wk = 0.0027027 k( 139) = ( 0.1042137 0.1042137 0.5000000), wk = 0.0027027 k( 140) = ( 0.0998715 0.0998715 0.5000000), wk = 0.0027027 k( 141) = ( 0.0955292 0.0955292 0.5000000), wk = 0.0027027 k( 142) = ( 0.0911870 0.0911870 0.5000000), wk = 0.0027027 k( 143) = ( 0.0868448 0.0868448 0.5000000), wk = 0.0027027 k( 144) = ( 0.0825025 0.0825025 0.5000000), wk = 0.0027027 k( 145) = ( 0.0781603 0.0781603 0.5000000), wk = 0.0027027 k( 146) = ( 0.0738181 0.0738181 0.5000000), wk = 0.0027027 k( 147) = ( 0.0694758 0.0694758 0.5000000), wk = 0.0027027 k( 148) = ( 0.0651336 0.0651336 0.5000000), wk = 0.0027027 k( 149) = ( 0.0607913 0.0607913 0.5000000), wk = 0.0027027 k( 150) = ( 0.0564491 0.0564491 0.5000000), wk = 0.0027027 k( 151) = ( 0.0521069 0.0521069 0.5000000), wk = 0.0027027 k( 152) = ( 0.0477646 0.0477646 0.5000000), wk = 0.0027027 k( 153) = ( 0.0434224 0.0434224 0.5000000), wk = 0.0027027 k( 154) = ( 0.0390802 0.0390802 0.5000000), wk = 0.0027027 k( 155) = ( 0.0347379 0.0347379 0.5000000), wk = 0.0027027 k( 156) = ( 0.0303957 0.0303957 0.5000000), wk = 0.0027027 k( 157) = ( 0.0260534 0.0260534 0.5000000), wk = 0.0027027 k( 158) = ( 0.0217112 0.0217112 0.5000000), wk = 0.0027027 k( 159) = ( 0.0173690 0.0173690 0.5000000), wk = 0.0027027 k( 160) = ( 0.0130267 0.0130267 0.5000000), wk = 0.0027027 k( 161) = ( 0.0086845 0.0086845 0.5000000), wk = 0.0027027 k( 162) = ( 0.0043422 0.0043422 0.5000000), wk = 0.0027027 k( 163) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027027 k( 164) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027027 k( 165) = ( 0.0000000 0.0000000 0.4642857), wk = 0.0027027 k( 166) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0027027 k( 167) = ( 0.0000000 0.0000000 0.3928571), wk = 0.0027027 k( 168) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0027027 k( 169) = ( 0.0000000 0.0000000 0.3214286), wk = 0.0027027 k( 170) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0027027 k( 171) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027027 k( 172) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0027027 k( 173) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0027027 k( 174) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0027027 k( 175) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0027027 k( 176) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0027027 k( 177) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0027027 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027027 k( 180) = ( -0.0208333 0.0208333 0.0000000), wk = 0.0027027 k( 181) = ( -0.0416667 0.0416667 0.0000000), wk = 0.0027027 k( 182) = ( -0.0625000 0.0625000 0.0000000), wk = 0.0027027 k( 183) = ( -0.0833333 0.0833333 0.0000000), wk = 0.0027027 k( 184) = ( -0.1041667 0.1041667 0.0000000), wk = 0.0027027 k( 185) = ( -0.1250000 0.1250000 0.0000000), wk = 0.0027027 k( 186) = ( -0.1458333 0.1458333 0.0000000), wk = 0.0027027 k( 187) = ( -0.1666667 0.1666667 -0.0000000), wk = 0.0027027 k( 188) = ( -0.1875000 0.1875000 0.0000000), wk = 0.0027027 k( 189) = ( -0.2083333 0.2083333 0.0000000), wk = 0.0027027 k( 190) = ( -0.2291667 0.2291667 -0.0000000), wk = 0.0027027 k( 191) = ( -0.2500000 0.2500000 0.0000000), wk = 0.0027027 k( 192) = ( -0.2708333 0.2708333 0.0000000), wk = 0.0027027 k( 193) = ( -0.2916667 0.2916667 0.0000000), wk = 0.0027027 k( 194) = ( -0.3125000 0.3125000 0.0000000), wk = 0.0027027 k( 195) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0027027 k( 196) = ( -0.3541667 0.3541667 0.0000000), wk = 0.0027027 k( 197) = ( -0.3750000 0.3750000 0.0000000), wk = 0.0027027 k( 198) = ( -0.3958333 0.3958333 0.0000000), wk = 0.0027027 k( 199) = ( -0.4166667 0.4166667 0.0000000), wk = 0.0027027 k( 200) = ( -0.4375000 0.4375000 0.0000000), wk = 0.0027027 k( 201) = ( -0.4583333 0.4583333 0.0000000), wk = 0.0027027 k( 202) = ( -0.4791667 0.4791667 0.0000000), wk = 0.0027027 k( 203) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0027027 k( 204) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0027027 k( 205) = ( -0.4956461 0.5043539 0.0000000), wk = 0.0027027 k( 206) = ( -0.4912922 0.5087078 0.0000000), wk = 0.0027027 k( 207) = ( -0.4869382 0.5130618 0.0000000), wk = 0.0027027 k( 208) = ( -0.4825843 0.5174157 0.0000000), wk = 0.0027027 k( 209) = ( -0.4782304 0.5217696 0.0000000), wk = 0.0027027 k( 210) = ( -0.4738765 0.5261235 0.0000000), wk = 0.0027027 k( 211) = ( -0.4695225 0.5304775 0.0000000), wk = 0.0027027 k( 212) = ( -0.4651686 0.5348314 0.0000000), wk = 0.0027027 k( 213) = ( -0.4608147 0.5391853 0.0000000), wk = 0.0027027 k( 214) = ( -0.4564608 0.5435392 0.0000000), wk = 0.0027027 k( 215) = ( -0.4521069 0.5478931 -0.0000000), wk = 0.0027027 k( 216) = ( -0.4477529 0.5522471 0.0000000), wk = 0.0027027 k( 217) = ( -0.4433990 0.5566010 0.0000000), wk = 0.0027027 k( 218) = ( -0.4390451 0.5609549 0.0000000), wk = 0.0027027 k( 219) = ( -0.4346912 0.5653088 0.0000000), wk = 0.0027027 k( 220) = ( -0.4303373 0.5696627 0.0000000), wk = 0.0027027 k( 221) = ( -0.4259833 0.5740167 0.0000000), wk = 0.0027027 k( 222) = ( -0.4216294 0.5783706 0.0000000), wk = 0.0027027 k( 223) = ( -0.4172755 0.5827245 0.0000000), wk = 0.0027027 k( 224) = ( -0.4129216 0.5870784 0.0000000), wk = 0.0027027 k( 225) = ( -0.4085677 0.5914324 0.0000000), wk = 0.0027027 k( 226) = ( -0.4042137 0.5957863 0.0000000), wk = 0.0027027 k( 227) = ( -0.3998598 0.6001402 -0.0000000), wk = 0.0027027 k( 228) = ( -0.3955059 0.6044941 -0.0000000), wk = 0.0027027 k( 229) = ( -0.3911520 0.6088480 0.0000000), wk = 0.0027027 k( 230) = ( -0.3867981 0.6132020 0.0000000), wk = 0.0027027 k( 231) = ( -0.3824441 0.6175559 0.0000000), wk = 0.0027027 k( 232) = ( -0.3780902 0.6219098 0.0000000), wk = 0.0027027 k( 233) = ( -0.3737363 0.6262637 0.0000000), wk = 0.0027027 k( 234) = ( -0.3693824 0.6306176 -0.0000000), wk = 0.0027027 k( 235) = ( -0.3650284 0.6349716 0.0000000), wk = 0.0027027 k( 236) = ( -0.3606745 0.6393255 0.0000000), wk = 0.0027027 k( 237) = ( -0.3563206 0.6436794 0.0000000), wk = 0.0027027 k( 238) = ( -0.3519667 0.6480333 0.0000000), wk = 0.0027027 k( 239) = ( -0.3476128 0.6523872 0.0000000), wk = 0.0027027 k( 240) = ( -0.3432588 0.6567412 0.0000000), wk = 0.0027027 k( 241) = ( -0.3389049 0.6610951 0.0000000), wk = 0.0027027 k( 242) = ( -0.3345510 0.6654490 0.0000000), wk = 0.0027027 k( 243) = ( -0.3301971 0.6698029 0.0000000), wk = 0.0027027 k( 244) = ( -0.3258432 0.6741569 0.0000000), wk = 0.0027027 k( 245) = ( -0.3214892 0.6785108 0.0000000), wk = 0.0027027 k( 246) = ( -0.3171353 0.6828647 0.0000000), wk = 0.0027027 k( 247) = ( -0.3127814 0.6872186 0.0000000), wk = 0.0027027 k( 248) = ( -0.3084275 0.6915725 0.0000000), wk = 0.0027027 k( 249) = ( -0.3040735 0.6959265 0.0000000), wk = 0.0027027 k( 250) = ( -0.2997196 0.7002804 0.0000000), wk = 0.0027027 k( 251) = ( -0.2953657 0.7046343 0.0000000), wk = 0.0027027 k( 252) = ( -0.2910118 0.7089882 0.0000000), wk = 0.0027027 k( 253) = ( -0.2866579 0.7133421 0.0000000), wk = 0.0027027 k( 254) = ( -0.2823039 0.7176961 -0.0000000), wk = 0.0027027 k( 255) = ( -0.2779500 0.7220500 0.0000000), wk = 0.0027027 k( 256) = ( -0.2735961 0.7264039 0.0000000), wk = 0.0027027 k( 257) = ( -0.2692422 0.7307578 0.0000000), wk = 0.0027027 k( 258) = ( -0.2648882 0.7351118 0.0000000), wk = 0.0027027 k( 259) = ( -0.2605343 0.7394657 0.0000000), wk = 0.0027027 k( 260) = ( -0.2605343 0.7394657 0.0000000), wk = 0.0027027 k( 261) = ( -0.2605343 0.7394657 0.0357143), wk = 0.0027027 k( 262) = ( -0.2605343 0.7394657 0.0714286), wk = 0.0027027 k( 263) = ( -0.2605343 0.7394657 0.1071429), wk = 0.0027027 k( 264) = ( -0.2605343 0.7394657 0.1428571), wk = 0.0027027 k( 265) = ( -0.2605343 0.7394657 0.1785714), wk = 0.0027027 k( 266) = ( -0.2605343 0.7394657 0.2142857), wk = 0.0027027 k( 267) = ( -0.2605343 0.7394657 0.2500000), wk = 0.0027027 k( 268) = ( -0.2605343 0.7394657 0.2857143), wk = 0.0027027 k( 269) = ( -0.2605343 0.7394657 0.3214286), wk = 0.0027027 k( 270) = ( -0.2605343 0.7394657 0.3571429), wk = 0.0027027 k( 271) = ( -0.2605343 0.7394657 0.3928571), wk = 0.0027027 k( 272) = ( -0.2605343 0.7394657 0.4285714), wk = 0.0027027 k( 273) = ( -0.2605343 0.7394657 0.4642857), wk = 0.0027027 k( 274) = ( -0.2605343 0.7394657 0.5000000), wk = 0.0027027 k( 275) = ( -0.2605343 0.7394657 0.5000000), wk = 0.0027027 k( 276) = ( -0.2648882 0.7351118 0.5000000), wk = 0.0027027 k( 277) = ( -0.2692422 0.7307578 0.5000000), wk = 0.0027027 k( 278) = ( -0.2735961 0.7264039 0.5000000), wk = 0.0027027 k( 279) = ( -0.2779500 0.7220500 0.5000000), wk = 0.0027027 k( 280) = ( -0.2823039 0.7176961 0.5000000), wk = 0.0027027 k( 281) = ( -0.2866579 0.7133421 0.5000000), wk = 0.0027027 k( 282) = ( -0.2910118 0.7089882 0.5000000), wk = 0.0027027 k( 283) = ( -0.2953657 0.7046343 0.5000000), wk = 0.0027027 k( 284) = ( -0.2997196 0.7002804 0.5000000), wk = 0.0027027 k( 285) = ( -0.3040735 0.6959265 0.5000000), wk = 0.0027027 k( 286) = ( -0.3084275 0.6915725 0.5000000), wk = 0.0027027 k( 287) = ( -0.3127814 0.6872186 0.5000000), wk = 0.0027027 k( 288) = ( -0.3171353 0.6828647 0.5000000), wk = 0.0027027 k( 289) = ( -0.3214892 0.6785108 0.5000000), wk = 0.0027027 k( 290) = ( -0.3258432 0.6741569 0.5000000), wk = 0.0027027 k( 291) = ( -0.3301971 0.6698029 0.5000000), wk = 0.0027027 k( 292) = ( -0.3345510 0.6654490 0.5000000), wk = 0.0027027 k( 293) = ( -0.3389049 0.6610951 0.5000000), wk = 0.0027027 k( 294) = ( -0.3432588 0.6567412 0.5000000), wk = 0.0027027 k( 295) = ( -0.3476128 0.6523872 0.5000000), wk = 0.0027027 k( 296) = ( -0.3519667 0.6480333 0.5000000), wk = 0.0027027 k( 297) = ( -0.3563206 0.6436794 0.5000000), wk = 0.0027027 k( 298) = ( -0.3606745 0.6393255 0.5000000), wk = 0.0027027 k( 299) = ( -0.3650284 0.6349716 0.5000000), wk = 0.0027027 k( 300) = ( -0.3693824 0.6306176 0.5000000), wk = 0.0027027 k( 301) = ( -0.3737363 0.6262637 0.5000000), wk = 0.0027027 k( 302) = ( -0.3780902 0.6219098 0.5000000), wk = 0.0027027 k( 303) = ( -0.3824441 0.6175559 0.5000000), wk = 0.0027027 k( 304) = ( -0.3867981 0.6132020 0.5000000), wk = 0.0027027 k( 305) = ( -0.3911520 0.6088480 0.5000000), wk = 0.0027027 k( 306) = ( -0.3955059 0.6044941 0.5000000), wk = 0.0027027 k( 307) = ( -0.3998598 0.6001402 0.5000000), wk = 0.0027027 k( 308) = ( -0.4042137 0.5957863 0.5000000), wk = 0.0027027 k( 309) = ( -0.4085677 0.5914324 0.5000000), wk = 0.0027027 k( 310) = ( -0.4129216 0.5870784 0.5000000), wk = 0.0027027 k( 311) = ( -0.4172755 0.5827245 0.5000000), wk = 0.0027027 k( 312) = ( -0.4216294 0.5783706 0.5000000), wk = 0.0027027 k( 313) = ( -0.4259833 0.5740167 0.5000000), wk = 0.0027027 k( 314) = ( -0.4303373 0.5696627 0.5000000), wk = 0.0027027 k( 315) = ( -0.4346912 0.5653088 0.5000000), wk = 0.0027027 k( 316) = ( -0.4390451 0.5609549 0.5000000), wk = 0.0027027 k( 317) = ( -0.4433990 0.5566010 0.5000000), wk = 0.0027027 k( 318) = ( -0.4477529 0.5522471 0.5000000), wk = 0.0027027 k( 319) = ( -0.4521069 0.5478931 0.5000000), wk = 0.0027027 k( 320) = ( -0.4564608 0.5435392 0.5000000), wk = 0.0027027 k( 321) = ( -0.4608147 0.5391853 0.5000000), wk = 0.0027027 k( 322) = ( -0.4651686 0.5348314 0.5000000), wk = 0.0027027 k( 323) = ( -0.4695225 0.5304775 0.5000000), wk = 0.0027027 k( 324) = ( -0.4738765 0.5261235 0.5000000), wk = 0.0027027 k( 325) = ( -0.4782304 0.5217696 0.5000000), wk = 0.0027027 k( 326) = ( -0.4825843 0.5174157 0.5000000), wk = 0.0027027 k( 327) = ( -0.4869382 0.5130618 0.5000000), wk = 0.0027027 k( 328) = ( -0.4912922 0.5087078 0.5000000), wk = 0.0027027 k( 329) = ( -0.4956461 0.5043539 0.5000000), wk = 0.0027027 k( 330) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0027027 k( 331) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0027027 k( 332) = ( -0.5000000 0.5000000 0.4642857), wk = 0.0027027 k( 333) = ( -0.5000000 0.5000000 0.4285714), wk = 0.0027027 k( 334) = ( -0.5000000 0.5000000 0.3928571), wk = 0.0027027 k( 335) = ( -0.5000000 0.5000000 0.3571429), wk = 0.0027027 k( 336) = ( -0.5000000 0.5000000 0.3214286), wk = 0.0027027 k( 337) = ( -0.5000000 0.5000000 0.2857143), wk = 0.0027027 k( 338) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0027027 k( 339) = ( -0.5000000 0.5000000 0.2142857), wk = 0.0027027 k( 340) = ( -0.5000000 0.5000000 0.1785714), wk = 0.0027027 k( 341) = ( -0.5000000 0.5000000 0.1428571), wk = 0.0027027 k( 342) = ( -0.5000000 0.5000000 0.1071429), wk = 0.0027027 k( 343) = ( -0.5000000 0.5000000 0.0714286), wk = 0.0027027 k( 344) = ( -0.5000000 0.5000000 0.0357143), wk = 0.0027027 k( 345) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0027027 k( 346) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027027 k( 347) = ( -0.0208333 0.0208333 0.5000000), wk = 0.0027027 k( 348) = ( -0.0416667 0.0416667 0.5000000), wk = 0.0027027 k( 349) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0027027 k( 350) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0027027 k( 351) = ( -0.1041667 0.1041667 0.5000000), wk = 0.0027027 k( 352) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0027027 k( 353) = ( -0.1458333 0.1458333 0.5000000), wk = 0.0027027 k( 354) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0027027 k( 355) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0027027 k( 356) = ( -0.2083333 0.2083333 0.5000000), wk = 0.0027027 k( 357) = ( -0.2291667 0.2291667 0.5000000), wk = 0.0027027 k( 358) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0027027 k( 359) = ( -0.2708333 0.2708333 0.5000000), wk = 0.0027027 k( 360) = ( -0.2916667 0.2916667 0.5000000), wk = 0.0027027 k( 361) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0027027 k( 362) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0027027 k( 363) = ( -0.3541667 0.3541667 0.5000000), wk = 0.0027027 k( 364) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0027027 k( 365) = ( -0.3958333 0.3958333 0.5000000), wk = 0.0027027 k( 366) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0027027 k( 367) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0027027 k( 368) = ( -0.4583333 0.4583333 0.5000000), wk = 0.0027027 k( 369) = ( -0.4791667 0.4791667 0.5000000), wk = 0.0027027 k( 370) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0027027 Dense grid: 140599 G-vectors FFT dimensions: ( 75, 75, 125) Smooth grid: 62259 G-vectors FFT dimensions: ( 60, 60, 96) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.28 Mb ( 332, 56) NL pseudopotentials 0.31 Mb ( 166, 124) Each V/rho on FFT grid 0.26 Mb ( 16875) Each G-vector array 0.02 Mb ( 2932) G-vector shells 0.01 Mb ( 1467) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.13 Mb ( 332, 224) Each subspace H/S matrix 0.77 Mb ( 224, 224) Each matrix 0.21 Mb ( 124, 2, 56) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CuO2.save/charge-density.dat negative rho (up, down): 3.120E-05 0.000E+00 Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 43.4 secs Computing kpt #: 2 total cpu time spent up to now is 45.9 secs Computing kpt #: 3 total cpu time spent up to now is 48.2 secs Computing kpt #: 4 total cpu time spent up to now is 50.6 secs Computing kpt #: 5 total cpu time spent up to now is 53.0 secs Computing kpt #: 6 total cpu time spent up to now is 55.4 secs Computing kpt #: 7 total cpu time spent up to now is 57.7 secs Computing kpt #: 8 total cpu time spent up to now is 60.2 secs Computing kpt #: 9 total cpu time spent up to now is 63.0 secs Computing kpt #: 10 total cpu time spent up to now is 65.4 secs Computing kpt #: 11 total cpu time spent up to now is 67.9 secs Computing kpt #: 12 total cpu time spent up to now is 70.3 secs Computing kpt #: 13 total cpu time spent up to now is 73.1 secs Computing kpt #: 14 total cpu time spent up to now is 76.6 secs Computing kpt #: 15 total cpu time spent up to now is 79.5 secs Computing kpt #: 16 total cpu time spent up to now is 82.0 secs Computing kpt #: 17 total cpu time spent up to now is 84.4 secs Computing kpt #: 18 total cpu time spent up to now is 86.9 secs Computing kpt #: 19 total cpu time spent up to now is 91.2 secs Computing kpt #: 20 total cpu time spent up to now is 93.7 secs Computing kpt #: 21 total cpu time spent up to now is 97.0 secs Computing kpt #: 22 total cpu time spent up to now is 99.6 secs Computing kpt #: 23 total cpu time spent up to now is 102.9 secs Computing kpt #: 24 total cpu time spent up to now is 105.4 secs Computing kpt #: 25 total cpu time spent up to now is 108.1 secs Computing kpt #: 26 total cpu time spent up to now is 110.8 secs Computing kpt #: 27 total cpu time spent up to now is 113.5 secs Computing kpt #: 28 total cpu time spent up to now is 116.3 secs Computing kpt #: 29 total cpu time spent up to now is 119.2 secs Computing kpt #: 30 total cpu time spent up to now is 122.1 secs Computing kpt #: 31 total cpu time spent up to now is 125.2 secs Computing kpt #: 32 total cpu time spent up to now is 127.8 secs Computing kpt #: 33 total cpu time spent up to now is 130.5 secs Computing kpt #: 34 total cpu time spent up to now is 133.8 secs Computing kpt #: 35 total cpu time spent up to now is 136.5 secs Computing kpt #: 36 total cpu time spent up to now is 139.3 secs Computing kpt #: 37 total cpu time spent up to now is 142.3 secs Computing kpt #: 38 total cpu time spent up to now is 145.2 secs Computing kpt #: 39 total cpu time spent up to now is 148.7 secs Computing kpt #: 40 total cpu time spent up to now is 151.7 secs Computing kpt #: 41 total cpu time spent up to now is 154.7 secs Computing kpt #: 42 total cpu time spent up to now is 157.7 secs Computing kpt #: 43 total cpu time spent up to now is 161.0 secs Computing kpt #: 44 total cpu time spent up to now is 164.2 secs Computing kpt #: 45 total cpu time spent up to now is 167.5 secs Computing kpt #: 46 total cpu time spent up to now is 170.9 secs Computing kpt #: 47 total cpu time spent up to now is 174.7 secs Computing kpt #: 48 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 180.3 secs Computing kpt #: 49 total cpu time spent up to now is 185.4 secs Computing kpt 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secs Computing kpt #: 81 total cpu time spent up to now is 299.2 secs Computing kpt #: 82 total cpu time spent up to now is 302.5 secs Computing kpt #: 83 total cpu time spent up to now is 305.8 secs Computing kpt #: 84 total cpu time spent up to now is 309.3 secs Computing kpt #: 85 total cpu time spent up to now is 312.5 secs Computing kpt #: 86 total cpu time spent up to now is 316.3 secs Computing kpt #: 87 total cpu time spent up to now is 319.6 secs Computing kpt #: 88 total cpu time spent up to now is 322.8 secs Computing kpt #: 89 total cpu time spent up to now is 326.3 secs Computing kpt #: 90 total cpu time spent up to now is 329.4 secs Computing kpt #: 91 total cpu time spent up to now is 333.0 secs Computing kpt #: 92 total cpu time spent up to now is 336.2 secs Computing kpt #: 93 total cpu time spent up to now is 339.6 secs Computing kpt #: 94 total cpu time spent up to now is 342.8 secs Computing kpt #: 95 total cpu time spent up to now is 346.0 secs Computing kpt #: 96 total cpu time spent up to now is 350.1 secs Computing kpt #: 97 total cpu time spent up to now is 353.3 secs Computing kpt #: 98 total cpu time spent up to now is 356.5 secs Computing kpt #: 99 total cpu time spent up to now is 361.2 secs Computing kpt #: 100 total cpu time spent up to now is 364.2 secs Computing kpt #: 101 total cpu time spent up to now is 367.7 secs Computing kpt #: 102 total cpu time spent up to now is 371.0 secs Computing kpt #: 103 total cpu time spent up to now is 374.0 secs Computing kpt #: 104 total cpu time spent up to now is 377.9 secs Computing kpt #: 105 total cpu time spent up to now is 381.7 secs Computing kpt #: 106 total cpu time spent up to now is 385.7 secs Computing kpt #: 107 total cpu time spent up to now is 388.9 secs Computing kpt #: 108 total cpu time spent up to now is 392.2 secs Computing kpt #: 109 total cpu time spent up to now is 395.5 secs Computing kpt #: 110 total cpu time spent up to now is 399.0 secs Computing kpt #: 111 total cpu 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is 490.8 secs Computing kpt #: 142 total cpu time spent up to now is 493.2 secs Computing kpt #: 143 total cpu time spent up to now is 495.7 secs Computing kpt #: 144 total cpu time spent up to now is 498.7 secs Computing kpt #: 145 total cpu time spent up to now is 501.2 secs Computing kpt #: 146 total cpu time spent up to now is 503.6 secs Computing kpt #: 147 total cpu time spent up to now is 506.2 secs Computing kpt #: 148 total cpu time spent up to now is 509.4 secs Computing kpt #: 149 total cpu time spent up to now is 511.7 secs Computing kpt #: 150 total cpu time spent up to now is 514.9 secs Computing kpt #: 151 total cpu time spent up to now is 517.7 secs Computing kpt #: 152 total cpu time spent up to now is 520.0 secs Computing kpt #: 153 total cpu time spent up to now is 522.3 secs Computing kpt #: 154 total cpu time spent up to now is 524.8 secs Computing kpt #: 155 total cpu time spent up to now is 527.2 secs Computing kpt #: 156 total cpu time spent up to now is 529.5 secs Computing kpt #: 157 total cpu time spent up to now is 531.8 secs Computing kpt #: 158 total cpu time spent up to now is 534.3 secs Computing kpt #: 159 total cpu time spent up to now is 536.4 secs Computing kpt #: 160 total cpu time spent up to now is 538.4 secs Computing kpt #: 161 total cpu time spent up to now is 540.7 secs Computing kpt #: 162 total cpu time spent up to now is 542.8 secs Computing kpt #: 163 total cpu time spent up to now is 545.1 secs Computing kpt #: 164 total cpu time spent up to now is 547.5 secs Computing kpt #: 165 total cpu time spent up to now is 550.5 secs Computing kpt #: 166 total cpu time spent up to now is 552.8 secs Computing kpt #: 167 total cpu time spent up to now is 555.1 secs Computing kpt #: 168 total cpu time spent up to now is 557.9 secs Computing kpt #: 169 total cpu time spent up to now is 560.2 secs Computing kpt #: 170 total cpu time spent up to now is 562.6 secs Computing kpt #: 171 total cpu time spent up to now is 564.9 secs Computing kpt #: 172 total cpu time spent up to now is 567.5 secs Computing kpt #: 173 total cpu time spent up to now is 570.3 secs Computing kpt #: 174 total cpu time spent up to now is 572.7 secs Computing kpt #: 175 total cpu time spent up to now is 575.6 secs Computing kpt #: 176 total cpu time spent up to now is 578.2 secs Computing kpt #: 177 total cpu time spent up to now is 580.6 secs Computing kpt #: 178 total cpu time spent up to now is 583.3 secs Computing kpt #: 179 total cpu time spent up to now is 585.9 secs Computing kpt #: 180 total cpu time spent up to now is 588.3 secs Computing kpt #: 181 total cpu time spent up to now is 591.0 secs Computing kpt #: 182 total cpu time spent up to now is 593.5 secs Computing kpt #: 183 total cpu time spent up to now is 596.0 secs Computing kpt #: 184 total cpu time spent up to now is 599.5 secs Computing kpt #: 185 total cpu time spent up to now is 602.1 secs Computing kpt #: 186 total cpu time spent up to now is 604.9 secs Computing kpt #: 187 total cpu time spent up to now is 607.6 secs Computing kpt #: 188 total cpu time spent up to now is 610.3 secs Computing kpt #: 189 total cpu time spent up to now is 613.2 secs Computing kpt #: 190 total cpu time spent up to now is 616.1 secs Computing kpt #: 191 total cpu time spent up to now is 619.1 secs Computing kpt #: 192 total cpu time spent up to now is 622.1 secs Computing kpt #: 193 total cpu time spent up to now is 625.3 secs Computing kpt #: 194 total cpu time spent up to now is 628.5 secs Computing kpt #: 195 total cpu time spent up to now is 631.6 secs Computing kpt #: 196 total cpu time spent up to now is 634.6 secs Computing kpt #: 197 total cpu time spent up to now is 637.6 secs Computing kpt #: 198 total cpu time spent up to now is 641.3 secs Computing kpt #: 199 total cpu time spent up to now is 646.0 secs Computing kpt #: 200 total cpu time spent up to now is 649.6 secs Computing kpt #: 201 total cpu time spent up to now is 653.8 secs Computing kpt #: 202 total cpu time spent up to now is 657.2 secs Computing kpt #: 203 total cpu time spent up to now is 661.0 secs Computing kpt #: 204 total cpu time spent up to now is 664.4 secs Computing kpt #: 205 total cpu time spent up to now is 668.5 secs Computing kpt #: 206 total cpu time spent up to now is 672.4 secs Computing kpt #: 207 total cpu time spent up to now is 675.7 secs Computing kpt #: 208 total cpu time spent up to now is 679.2 secs Computing kpt #: 209 total cpu time spent up to now is 682.8 secs Computing kpt #: 210 total cpu time spent up to now is 685.9 secs Computing kpt #: 211 total cpu time spent up to now is 689.4 secs Computing kpt #: 212 total cpu time spent up to now is 692.9 secs Computing kpt #: 213 total cpu time spent up to now is 696.6 secs Computing kpt #: 214 total cpu time spent up to now is 700.0 secs Computing kpt #: 215 total cpu time spent up to now is 703.6 secs Computing kpt #: 216 total cpu time spent up to now is 707.2 secs Computing kpt #: 217 total cpu time spent up to now is 710.8 secs Computing kpt #: 218 total cpu time spent up to now is 714.3 secs Computing kpt #: 219 total cpu time spent up to now is 718.0 secs Computing kpt #: 220 total cpu time spent up to now is 722.0 secs Computing kpt #: 221 total cpu time spent up to now is 725.7 secs Computing kpt #: 222 total cpu time spent up to now is 730.4 secs Computing kpt #: 223 total cpu time spent up to now is 734.4 secs Computing kpt #: 224 total cpu time spent up to now is 738.4 secs Computing kpt #: 225 total cpu time spent up to now is 743.6 secs Computing kpt #: 226 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 749.4 secs Computing kpt #: 227 total cpu time spent up to now is 754.1 secs Computing kpt #: 228 total cpu time spent up to now is 757.7 secs Computing kpt #: 229 total cpu time spent up to now is 761.4 secs Computing kpt #: 230 total cpu time spent up to now is 765.4 secs Computing kpt #: 231 total cpu time spent up to now is 769.1 secs Computing kpt #: 232 total cpu time spent up to now is 772.6 secs Computing kpt #: 233 total cpu time spent up to now is 776.2 secs Computing kpt #: 234 total cpu time spent up to now is 779.5 secs Computing kpt #: 235 total cpu time spent up to now is 783.2 secs Computing kpt #: 236 total cpu time spent up to now is 787.1 secs Computing kpt #: 237 total cpu time spent up to now is 790.0 secs Computing kpt #: 238 total cpu time spent up to now is 793.2 secs Computing kpt #: 239 total cpu time spent up to now is 796.5 secs Computing kpt #: 240 total cpu time spent up to now is 799.8 secs Computing kpt #: 241 total cpu time spent up to now is 802.7 secs Computing kpt #: 242 total cpu time spent up to now is 805.9 secs Computing kpt #: 243 total cpu time spent up to now is 808.6 secs Computing kpt #: 244 total cpu time spent up to now is 811.3 secs Computing kpt #: 245 total cpu time spent up to now is 814.1 secs Computing kpt #: 246 total cpu time spent up to now is 816.7 secs Computing kpt #: 247 total cpu time spent up to now is 819.3 secs Computing kpt #: 248 total cpu time spent up to now is 822.0 secs Computing kpt #: 249 total cpu time spent up to now is 824.9 secs Computing kpt #: 250 total cpu time spent up to now is 828.2 secs Computing kpt #: 251 total cpu time spent up to now is 831.1 secs Computing kpt #: 252 total cpu time spent up to now is 833.9 secs Computing kpt #: 253 total cpu time spent up to now is 837.6 secs Computing kpt #: 254 total cpu time spent up to now is 840.9 secs Computing kpt #: 255 total cpu time spent up to now is 843.9 secs Computing kpt #: 256 total cpu time spent up to now is 847.2 secs Computing kpt #: 257 total cpu time spent up to now is 850.2 secs Computing kpt #: 258 total cpu time spent up to now is 853.2 secs Computing kpt #: 259 total cpu time spent up to now is 856.6 secs Computing kpt #: 260 total cpu time spent up to now is 859.8 secs Computing kpt #: 261 total cpu time spent up to now is 863.0 secs Computing kpt #: 262 total cpu time spent up to now is 866.0 secs Computing kpt #: 263 total cpu time spent up to now is 869.2 secs Computing kpt #: 264 total cpu time spent up to now is 872.4 secs Computing kpt #: 265 total cpu time spent up to now is 875.4 secs Computing kpt #: 266 total cpu time spent up to now is 878.7 secs Computing kpt #: 267 total cpu time spent up to now is 881.7 secs Computing kpt #: 268 total cpu time spent up to now is 885.1 secs Computing kpt #: 269 total cpu time spent up to now is 888.4 secs Computing kpt #: 270 total cpu time spent up to now is 891.4 secs Computing kpt #: 271 total cpu time spent up to now is 894.4 secs Computing kpt #: 272 total cpu time spent up to now is 897.7 secs Computing kpt #: 273 total cpu time spent up to now is 900.9 secs Computing kpt #: 274 total cpu time spent up to now is 904.0 secs Computing kpt #: 275 total cpu time spent up to now is 907.1 secs Computing kpt #: 276 total cpu time spent up to now is 910.0 secs Computing kpt #: 277 total cpu 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up to now is 956.2 secs Computing kpt #: 293 total cpu time spent up to now is 959.1 secs Computing kpt #: 294 total cpu time spent up to now is 961.7 secs Computing kpt #: 295 total cpu time spent up to now is 964.2 secs Computing kpt #: 296 total cpu time spent up to now is 966.8 secs Computing kpt #: 297 total cpu time spent up to now is 969.4 secs Computing kpt #: 298 total cpu time spent up to now is 972.0 secs Computing kpt #: 299 total cpu time spent up to now is 975.6 secs Computing kpt #: 300 total cpu time spent up to now is 978.6 secs Computing kpt #: 301 total cpu time spent up to now is 982.3 secs Computing kpt #: 302 total cpu time spent up to now is 985.3 secs Computing kpt #: 303 total cpu time spent up to now is 988.1 secs Computing kpt #: 304 total cpu time spent up to now is 991.2 secs Computing kpt #: 305 total cpu time spent up to now is 994.6 secs Computing kpt #: 306 total cpu time spent up to now is 997.5 secs Computing kpt #: 307 total cpu time spent up to now is 1000.5 secs Computing kpt #: 308 total cpu time spent up to now is 1003.5 secs Computing kpt #: 309 total cpu time spent up to now is 1006.5 secs Computing kpt #: 310 total cpu time spent up to now is 1009.4 secs Computing kpt #: 311 total cpu time spent up to now is 1012.8 secs Computing kpt #: 312 total cpu time spent up to now is 1015.8 secs Computing kpt #: 313 total cpu time spent up to now is 1018.8 secs Computing kpt #: 314 total cpu time spent up to now is 1022.2 secs Computing kpt #: 315 total cpu time spent up to now is 1025.4 secs Computing kpt #: 316 total cpu time spent up to now is 1028.5 secs Computing kpt #: 317 total cpu time spent up to now is 1031.5 secs Computing kpt #: 318 total cpu time spent up to now is 1034.6 secs Computing kpt #: 319 total cpu time spent up to now is 1038.9 secs Computing kpt #: 320 total cpu time spent up to now is 1045.5 secs Computing kpt #: 321 total cpu time spent up to now is 1049.0 secs Computing kpt #: 322 total cpu time spent up to 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up to now is 1110.4 secs Computing kpt #: 338 total cpu time spent up to now is 1113.8 secs Computing kpt #: 339 total cpu time spent up to now is 1117.7 secs Computing kpt #: 340 total cpu time spent up to now is 1121.1 secs Computing kpt #: 341 total cpu time spent up to now is 1124.4 secs Computing kpt #: 342 total cpu time spent up to now is 1127.8 secs Computing kpt #: 343 total cpu time spent up to now is 1131.2 secs Computing kpt #: 344 total cpu time spent up to now is 1134.5 secs Computing kpt #: 345 total cpu time spent up to now is 1137.5 secs Computing kpt #: 346 total cpu time spent up to now is 1139.7 secs Computing kpt #: 347 total cpu time spent up to now is 1142.2 secs Computing kpt #: 348 total cpu time spent up to now is 1145.2 secs Computing kpt #: 349 total cpu time spent up to now is 1148.7 secs Computing kpt #: 350 total cpu time spent up to now is 1151.1 secs Computing kpt #: 351 total cpu time spent up to now is 1153.5 secs Computing kpt #: 352 total cpu time spent up to now is 1156.6 secs Computing kpt #: 353 total cpu time spent up to now is 1159.1 secs Computing kpt #: 354 total cpu time spent up to now is 1161.6 secs Computing kpt #: 355 total cpu time spent up to now is 1164.2 secs Computing kpt #: 356 total cpu time spent up to now is 1166.8 secs Computing kpt #: 357 total cpu time spent up to now is 1169.5 secs Computing kpt #: 358 total cpu time spent up to now is 1172.2 secs Computing kpt #: 359 total cpu time spent up to now is 1175.0 secs Computing kpt #: 360 total cpu time spent up to now is 1179.2 secs Computing kpt #: 361 total cpu time spent up to now is 1182.5 secs Computing kpt #: 362 total cpu time spent up to now is 1185.4 secs Computing kpt #: 363 total cpu time spent up to now is 1188.3 secs Computing kpt #: 364 total cpu time spent up to now is 1191.3 secs Computing kpt #: 365 total cpu time spent up to now is 1194.8 secs Computing kpt #: 366 total cpu time spent up to now is 1197.9 secs Computing kpt #: 367 total cpu time spent up to now is 1200.9 secs Computing kpt #: 368 total cpu time spent up to now is 1204.9 secs Computing kpt #: 369 total cpu time spent up to now is 1208.5 secs Computing kpt #: 370 total cpu time spent up to now is 1212.0 secs ethr = 2.17E-11, avg # of iterations = 38.0 total cpu time spent up to now is 1212.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7777 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5818 -8.5818 -8.4239 -8.4239 -8.2503 -8.2503 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0840 -6.0840 -6.0756 -6.0756 -5.5328 -5.5328 -5.4493 -5.4493 -4.9056 -4.9056 -4.6932 -4.6932 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6586 -3.6586 -3.5675 -3.5675 -1.5639 -1.5639 -1.5620 -1.5620 1.5857 1.5857 2.2943 2.2943 k = 0.0043 0.0212-0.0000 ( 7779 PWs) bands (ev): -20.8519 -20.8519 -20.8125 -20.8125 -19.8882 -19.8882 -19.8340 -19.8340 -8.5808 -8.5808 -8.4230 -8.4230 -8.2502 -8.2502 -8.2377 -8.2377 -7.0375 -7.0375 -7.0183 -7.0183 -6.2330 -6.2330 -6.2240 -6.2240 -6.0873 -6.0873 -6.0784 -6.0784 -5.5287 -5.5287 -5.4455 -5.4455 -4.9068 -4.9068 -4.6959 -4.6959 -4.5721 -4.5721 -4.2827 -4.2827 -4.2774 -4.2774 -3.9787 -3.9787 -3.6588 -3.6588 -3.5677 -3.5677 -1.5666 -1.5666 -1.5640 -1.5640 1.5878 1.5878 2.2961 2.2961 k = 0.0087 0.0423-0.0000 ( 7787 PWs) bands (ev): -20.8502 -20.8502 -20.8108 -20.8108 -19.8879 -19.8879 -19.8338 -19.8338 -8.5778 -8.5778 -8.4205 -8.4205 -8.2499 -8.2499 -8.2375 -8.2375 -7.0362 -7.0362 -7.0171 -7.0171 -6.2366 -6.2366 -6.2278 -6.2278 -6.0967 -6.0967 -6.0867 -6.0867 -5.5168 -5.5168 -5.4346 -5.4346 -4.9105 -4.9105 -4.7042 -4.7042 -4.5696 -4.5696 -4.2857 -4.2857 -4.2748 -4.2748 -3.9781 -3.9781 -3.6595 -3.6595 -3.5685 -3.5685 -1.5744 -1.5744 -1.5700 -1.5700 1.5940 1.5940 2.3014 2.3014 k = 0.0130 0.0635-0.0000 ( 7783 PWs) bands (ev): -20.8474 -20.8474 -20.8081 -20.8081 -19.8874 -19.8874 -19.8334 -19.8334 -8.5729 -8.5729 -8.4163 -8.4163 -8.2493 -8.2493 -8.2371 -8.2371 -7.0340 -7.0340 -7.0149 -7.0149 -6.2427 -6.2427 -6.2341 -6.2341 -6.1114 -6.1114 -6.0997 -6.0997 -5.4978 -5.4978 -5.4170 -5.4170 -4.9166 -4.9166 -4.7174 -4.7174 -4.5656 -4.5656 -4.2902 -4.2902 -4.2712 -4.2712 -3.9770 -3.9770 -3.6607 -3.6607 -3.5699 -3.5699 -1.5870 -1.5870 -1.5800 -1.5800 1.6044 1.6044 2.3102 2.3102 k = 0.0174 0.0846-0.0000 ( 7787 PWs) bands (ev): -20.8435 -20.8435 -20.8042 -20.8042 -19.8868 -19.8868 -19.8328 -19.8328 -8.5661 -8.5661 -8.4104 -8.4104 -8.2484 -8.2484 -8.2365 -8.2365 -7.0309 -7.0309 -7.0119 -7.0119 -6.2516 -6.2516 -6.2433 -6.2433 -6.1301 -6.1301 -6.1165 -6.1165 -5.4728 -5.4728 -5.3936 -5.3936 -4.9250 -4.9250 -4.7353 -4.7353 -4.5600 -4.5600 -4.2961 -4.2961 -4.2668 -4.2668 -3.9756 -3.9756 -3.6623 -3.6623 -3.5717 -3.5717 -1.6044 -1.6044 -1.5941 -1.5941 1.6189 1.6189 2.3224 2.3224 k = 0.0217 0.1058-0.0000 ( 7795 PWs) bands (ev): -20.8385 -20.8385 -20.7992 -20.7992 -19.8860 -19.8860 -19.8321 -19.8321 -8.5573 -8.5573 -8.4030 -8.4030 -8.2473 -8.2473 -8.2355 -8.2355 -7.0270 -7.0270 -7.0081 -7.0081 -6.2635 -6.2635 -6.2556 -6.2556 -6.1516 -6.1516 -6.1360 -6.1360 -5.4429 -5.4429 -5.3653 -5.3653 -4.9358 -4.9358 -4.7570 -4.7570 -4.5531 -4.5531 -4.3035 -4.3035 -4.2620 -4.2620 -3.9739 -3.9739 -3.6644 -3.6644 -3.5741 -3.5741 -1.6264 -1.6264 -1.6120 -1.6120 1.6374 1.6374 2.3381 2.3381 k = 0.0261 0.1269-0.0000 ( 7797 PWs) bands (ev): -20.8323 -20.8323 -20.7931 -20.7931 -19.8849 -19.8849 -19.8313 -19.8313 -8.5466 -8.5466 -8.3941 -8.3941 -8.2458 -8.2458 -8.2340 -8.2340 -7.0222 -7.0222 -7.0035 -7.0035 -6.2788 -6.2788 -6.2711 -6.2711 -6.1745 -6.1745 -6.1573 -6.1573 -5.4091 -5.4091 -5.3329 -5.3329 -4.9488 -4.9488 -4.7821 -4.7821 -4.5449 -4.5449 -4.3122 -4.3122 -4.2572 -4.2572 -3.9721 -3.9721 -3.6670 -3.6670 -3.5770 -3.5770 -1.6529 -1.6529 -1.6335 -1.6335 1.6598 1.6598 2.3572 2.3572 k = 0.0304 0.1481-0.0000 ( 7789 PWs) bands (ev): -20.8251 -20.8251 -20.7859 -20.7859 -19.8837 -19.8837 -19.8303 -19.8303 -8.5340 -8.5340 -8.3839 -8.3839 -8.2440 -8.2440 -8.2320 -8.2320 -7.0166 -7.0166 -6.9980 -6.9980 -6.2976 -6.2976 -6.2899 -6.2899 -6.1980 -6.1980 -6.1796 -6.1796 -5.3722 -5.3722 -5.2973 -5.2973 -4.9639 -4.9639 -4.8100 -4.8100 -4.5355 -4.5355 -4.3219 -4.3219 -4.2527 -4.2527 -3.9703 -3.9703 -3.6700 -3.6700 -3.5805 -3.5805 -1.6835 -1.6835 -1.6582 -1.6582 1.6861 1.6861 2.3796 2.3796 k = 0.0347 0.1692-0.0000 ( 7777 PWs) bands (ev): -20.8168 -20.8168 -20.7777 -20.7777 -19.8824 -19.8824 -19.8292 -19.8292 -8.5196 -8.5196 -8.3725 -8.3725 -8.2417 -8.2417 -8.2291 -8.2291 -7.0101 -7.0101 -6.9918 -6.9918 -6.3201 -6.3201 -6.3121 -6.3121 -6.2217 -6.2217 -6.2025 -6.2025 -5.3329 -5.3329 -5.2591 -5.2591 -4.9808 -4.9808 -4.8400 -4.8400 -4.5251 -4.5251 -4.3327 -4.3327 -4.2487 -4.2487 -3.9687 -3.9687 -3.6735 -3.6735 -3.5844 -3.5844 -1.7181 -1.7181 -1.6860 -1.6860 1.7161 1.7161 2.4052 2.4052 k = 0.0391 0.1904-0.0000 ( 7787 PWs) bands (ev): -20.8075 -20.8075 -20.7684 -20.7684 -19.8808 -19.8808 -19.8279 -19.8279 -8.5033 -8.5033 -8.3603 -8.3603 -8.2390 -8.2390 -8.2250 -8.2250 -7.0029 -7.0029 -6.9848 -6.9848 -6.3457 -6.3457 -6.3373 -6.3373 -6.2455 -6.2455 -6.2262 -6.2262 -5.2919 -5.2919 -5.2188 -5.2188 -4.9993 -4.9993 -4.8714 -4.8714 -4.5140 -4.5140 -4.3442 -4.3442 -4.2455 -4.2455 -3.9675 -3.9675 -3.6775 -3.6775 -3.5889 -3.5889 -1.7563 -1.7563 -1.7164 -1.7164 1.7498 1.7498 2.4340 2.4340 k = 0.0434 0.2115-0.0000 ( 7797 PWs) bands (ev): -20.7971 -20.7971 -20.7582 -20.7582 -19.8791 -19.8791 -19.8265 -19.8265 -8.4853 -8.4853 -8.3477 -8.3477 -8.2357 -8.2357 -8.2194 -8.2194 -6.9949 -6.9949 -6.9771 -6.9771 -6.3740 -6.3740 -6.3649 -6.3649 -6.2699 -6.2699 -6.2506 -6.2506 -5.2496 -5.2496 -5.1769 -5.1769 -5.0189 -5.0189 -4.9038 -4.9038 -4.5022 -4.5022 -4.3565 -4.3565 -4.2433 -4.2433 -3.9670 -3.9670 -3.6819 -3.6819 -3.5939 -3.5939 -1.7978 -1.7978 -1.7492 -1.7492 1.7869 1.7869 2.4659 2.4659 k = 0.0478 0.2327-0.0000 ( 7811 PWs) bands (ev): -20.7857 -20.7857 -20.7469 -20.7469 -19.8773 -19.8773 -19.8250 -19.8250 -8.4656 -8.4656 -8.3350 -8.3350 -8.2318 -8.2318 -8.2118 -8.2118 -6.9862 -6.9862 -6.9687 -6.9687 -6.4042 -6.4042 -6.3945 -6.3945 -6.2954 -6.2954 -6.2764 -6.2764 -5.2070 -5.2070 -5.1341 -5.1341 -5.0388 -5.0388 -4.9363 -4.9363 -4.4900 -4.4900 -4.3692 -4.3692 -4.2421 -4.2421 -3.9673 -3.9673 -3.6868 -3.6868 -3.5995 -3.5995 -1.8421 -1.8421 -1.7838 -1.7838 1.8275 1.8275 2.5007 2.5007 k = 0.0521 0.2538-0.0000 ( 7799 PWs) bands (ev): -20.7733 -20.7733 -20.7346 -20.7346 -19.8753 -19.8753 -19.8233 -19.8233 -8.4443 -8.4443 -8.3228 -8.3228 -8.2271 -8.2271 -8.2015 -8.2015 -6.9768 -6.9768 -6.9596 -6.9596 -6.4355 -6.4355 -6.4253 -6.4253 -6.3225 -6.3225 -6.3038 -6.3038 -5.1662 -5.1662 -5.0917 -5.0917 -5.0568 -5.0568 -4.9672 -4.9672 -4.4778 -4.4778 -4.3824 -4.3824 -4.2421 -4.2421 -3.9688 -3.9688 -3.6922 -3.6922 -3.6055 -3.6055 -1.8889 -1.8889 -1.8198 -1.8198 1.8713 1.8713 2.5385 2.5385 k = 0.0564 0.2750-0.0000 ( 7795 PWs) bands (ev): -20.7600 -20.7600 -20.7214 -20.7214 -19.8731 -19.8731 -19.8216 -19.8216 -8.4215 -8.4215 -8.3116 -8.3116 -8.2216 -8.2216 -8.1881 -8.1881 -6.9668 -6.9668 -6.9500 -6.9500 -6.4677 -6.4677 -6.4570 -6.4570 -6.3516 -6.3516 -6.3333 -6.3333 -5.1361 -5.1361 -5.0646 -5.0646 -5.0556 -5.0556 -4.9899 -4.9899 -4.4658 -4.4658 -4.3960 -4.3960 -4.2433 -4.2433 -3.9719 -3.9719 -3.6980 -3.6980 -3.6120 -3.6120 -1.9376 -1.9376 -1.8567 -1.8567 1.9183 1.9183 2.5791 2.5791 k = 0.0608 0.2961-0.0000 ( 7791 PWs) bands (ev): -20.7457 -20.7457 -20.7073 -20.7073 -19.8708 -19.8708 -19.8197 -19.8197 -8.3973 -8.3973 -8.3015 -8.3015 -8.2150 -8.2150 -8.1713 -8.1713 -6.9563 -6.9563 -6.9399 -6.9399 -6.5002 -6.5002 -6.4893 -6.4893 -6.3831 -6.3831 -6.3651 -6.3651 -5.1346 -5.1346 -5.0560 -5.0560 -5.0411 -5.0411 -4.9768 -4.9768 -4.4543 -4.4543 -4.4098 -4.4098 -4.2458 -4.2458 -3.9768 -3.9768 -3.7042 -3.7042 -3.6191 -3.6191 -1.9879 -1.9879 -1.8940 -1.8940 1.9682 1.9682 2.6224 2.6224 k = 0.0651 0.3173-0.0000 ( 7791 PWs) bands (ev): -20.7306 -20.7306 -20.6923 -20.6923 -19.8684 -19.8684 -19.8177 -19.8177 -8.3721 -8.3721 -8.2926 -8.2926 -8.2071 -8.2071 -8.1511 -8.1511 -6.9454 -6.9454 -6.9295 -6.9295 -6.5328 -6.5328 -6.5218 -6.5218 -6.4172 -6.4172 -6.3994 -6.3994 -5.1513 -5.1513 -5.0802 -5.0802 -5.0010 -5.0010 -4.9361 -4.9361 -4.4438 -4.4438 -4.4238 -4.4238 -4.2495 -4.2495 -3.9840 -3.9840 -3.7110 -3.7110 -3.6266 -3.6266 -2.0390 -2.0390 -1.9313 -1.9313 2.0212 2.0212 2.6683 2.6683 k = 0.0695 0.3385-0.0000 ( 7795 PWs) bands (ev): -20.7146 -20.7146 -20.6764 -20.6764 -19.8658 -19.8658 -19.8156 -19.8156 -8.3461 -8.3461 -8.2846 -8.2846 -8.1975 -8.1975 -8.1278 -8.1278 -6.9342 -6.9342 -6.9190 -6.9190 -6.5652 -6.5652 -6.5542 -6.5542 -6.4540 -6.4540 -6.4363 -6.4363 -5.1723 -5.1723 -5.1085 -5.1085 -4.9552 -4.9552 -4.8899 -4.8899 -4.4394 -4.4394 -4.4334 -4.4334 -4.2546 -4.2546 -3.9937 -3.9937 -3.7181 -3.7181 -3.6346 -3.6346 -2.0906 -2.0906 -1.9678 -1.9678 2.0769 2.0769 2.7168 2.7168 k = 0.0738 0.3596-0.0000 ( 7797 PWs) bands (ev): -20.6977 -20.6977 -20.6598 -20.6598 -19.8631 -19.8631 -19.8134 -19.8134 -8.3199 -8.3199 -8.2772 -8.2772 -8.1857 -8.1857 -8.1016 -8.1016 -6.9230 -6.9230 -6.9086 -6.9086 -6.5971 -6.5971 -6.5863 -6.5863 -6.4935 -6.4935 -6.4757 -6.4757 -5.1942 -5.1942 -5.1366 -5.1366 -4.9075 -4.9075 -4.8421 -4.8421 -4.4533 -4.4533 -4.4267 -4.4267 -4.2610 -4.2610 -4.0065 -4.0065 -3.7257 -3.7257 -3.6431 -3.6431 -2.1420 -2.1420 -2.0032 -2.0032 2.1353 2.1353 2.7678 2.7678 k = 0.0782 0.3808-0.0000 ( 7801 PWs) bands (ev): -20.6801 -20.6801 -20.6423 -20.6423 -19.8603 -19.8603 -19.8111 -19.8111 -8.2940 -8.2940 -8.2700 -8.2700 -8.1712 -8.1712 -8.0729 -8.0729 -6.9123 -6.9123 -6.8989 -6.8989 -6.6280 -6.6280 -6.6177 -6.6177 -6.5354 -6.5354 -6.5175 -6.5175 -5.2159 -5.2159 -5.1634 -5.1634 -4.8589 -4.8589 -4.7935 -4.7935 -4.4681 -4.4681 -4.4216 -4.4216 -4.2687 -4.2687 -4.0226 -4.0226 -3.7337 -3.7337 -3.6520 -3.6520 -2.1926 -2.1926 -2.0368 -2.0368 2.1964 2.1964 2.8211 2.8211 k = 0.0825 0.4019-0.0000 ( 7801 PWs) bands (ev): -20.6617 -20.6617 -20.6241 -20.6241 -19.8575 -19.8575 -19.8087 -19.8087 -8.2694 -8.2694 -8.2627 -8.2627 -8.1529 -8.1529 -8.0420 -8.0420 -6.9026 -6.9026 -6.8906 -6.8906 -6.6575 -6.6575 -6.6480 -6.6480 -6.5793 -6.5793 -6.5612 -6.5612 -5.2368 -5.2368 -5.1885 -5.1885 -4.8098 -4.8098 -4.7444 -4.7444 -4.4833 -4.4833 -4.4193 -4.4193 -4.2777 -4.2777 -4.0424 -4.0424 -3.7422 -3.7422 -3.6614 -3.6614 -2.2417 -2.2417 -2.0682 -2.0682 2.2600 2.2600 2.8768 2.8768 k = 0.0868 0.4231-0.0000 ( 7805 PWs) bands (ev): -20.6426 -20.6426 -20.6053 -20.6053 -19.8545 -19.8545 -19.8063 -19.8063 -8.2552 -8.2552 -8.2465 -8.2465 -8.1304 -8.1304 -8.0090 -8.0090 -6.8953 -6.8953 -6.8852 -6.8852 -6.6847 -6.6847 -6.6764 -6.6764 -6.6246 -6.6246 -6.6063 -6.6063 -5.2566 -5.2566 -5.2118 -5.2118 -4.7605 -4.7605 -4.6950 -4.6950 -4.4988 -4.4988 -4.4203 -4.4203 -4.2880 -4.2880 -4.0663 -4.0663 -3.7510 -3.7510 -3.6713 -3.6713 -2.2887 -2.2887 -2.0969 -2.0969 2.3261 2.3261 2.9347 2.9347 k = 0.0912 0.4442-0.0000 ( 7799 PWs) bands (ev): -20.6229 -20.6229 -20.5857 -20.5857 -19.8514 -19.8514 -19.8038 -19.8038 -8.2471 -8.2471 -8.2258 -8.2258 -8.1034 -8.1034 -7.9743 -7.9743 -6.8925 -6.8925 -6.8848 -6.8848 -6.7087 -6.7087 -6.7017 -6.7017 -6.6694 -6.6694 -6.6518 -6.6518 -5.2753 -5.2753 -5.2333 -5.2333 -4.7112 -4.7112 -4.6456 -4.6456 -4.5144 -4.5144 -4.4251 -4.4251 -4.2995 -4.2995 -4.0943 -4.0943 -3.7603 -3.7603 -3.6815 -3.6815 -2.3331 -2.3331 -2.1226 -2.1226 2.3946 2.3946 2.9948 2.9948 k = 0.0955 0.4654-0.0000 ( 7783 PWs) bands (ev): -20.6025 -20.6025 -20.5656 -20.5656 -19.8483 -19.8483 -19.8013 -19.8013 -8.2383 -8.2383 -8.2068 -8.2068 -8.0723 -8.0723 -7.9379 -7.9379 -6.8983 -6.8983 -6.8920 -6.8920 -6.7323 -6.7323 -6.7225 -6.7225 -6.7084 -6.7084 -6.6942 -6.6942 -5.2926 -5.2926 -5.2528 -5.2528 -4.6624 -4.6624 -4.5962 -4.5962 -4.5299 -4.5299 -4.4343 -4.4343 -4.3123 -4.3123 -4.1267 -4.1267 -3.7699 -3.7699 -3.6922 -3.6922 -2.3741 -2.3741 -2.1449 -2.1449 2.4654 2.4654 3.0571 3.0571 k = 0.0999 0.4865-0.0000 ( 7787 PWs) bands (ev): -20.5816 -20.5816 -20.5450 -20.5450 -19.8451 -19.8451 -19.7986 -19.7986 -8.2287 -8.2287 -8.1890 -8.1890 -8.0377 -8.0377 -7.9003 -7.9003 -6.9177 -6.9177 -6.9089 -6.9089 -6.7670 -6.7670 -6.7497 -6.7497 -6.7276 -6.7276 -6.7179 -6.7179 -5.3086 -5.3086 -5.2706 -5.2706 -4.6159 -4.6159 -4.5477 -4.5477 -4.5432 -4.5432 -4.4482 -4.4482 -4.3262 -4.3262 -4.1635 -4.1635 -3.7799 -3.7799 -3.7033 -3.7033 -2.4112 -2.4112 -2.1637 -2.1637 2.5386 2.5386 3.1214 3.1214 k = 0.1042 0.5077-0.0000 ( 7793 PWs) bands (ev): -20.5602 -20.5602 -20.5238 -20.5238 -19.8418 -19.8418 -19.7960 -19.7960 -8.2182 -8.2182 -8.1717 -8.1717 -8.0004 -8.0004 -7.8615 -7.8615 -6.9509 -6.9509 -6.9372 -6.9372 -6.8049 -6.8049 -6.7878 -6.7878 -6.7302 -6.7302 -6.7201 -6.7201 -5.3232 -5.3232 -5.2866 -5.2866 -4.5859 -4.5859 -4.5418 -4.5418 -4.4997 -4.4997 -4.4663 -4.4663 -4.3412 -4.3412 -4.2048 -4.2048 -3.7903 -3.7903 -3.7147 -3.7147 -2.4439 -2.4439 -2.1788 -2.1788 2.6139 2.6139 3.1877 3.1877 k = 0.1086 0.5288-0.0000 ( 7783 PWs) bands (ev): -20.5384 -20.5384 -20.5022 -20.5022 -19.8385 -19.8385 -19.7933 -19.7933 -8.2066 -8.2066 -8.1543 -8.1543 -7.9611 -7.9611 -7.8218 -7.8218 -6.9948 -6.9948 -6.9760 -6.9760 -6.8403 -6.8403 -6.8242 -6.8242 -6.7246 -6.7246 -6.7136 -6.7136 -5.3365 -5.3365 -5.3009 -5.3009 -4.5928 -4.5928 -4.5037 -4.5037 -4.4947 -4.4947 -4.4489 -4.4489 -4.3564 -4.3564 -4.2504 -4.2504 -3.8010 -3.8010 -3.7265 -3.7265 -2.4719 -2.4719 -2.1902 -2.1902 2.6914 2.6914 3.2559 3.2559 k = 0.1129 0.5500-0.0000 ( 7775 PWs) bands (ev): -20.5161 -20.5161 -20.4802 -20.4802 -19.8352 -19.8352 -19.7906 -19.7906 -8.1940 -8.1940 -8.1366 -8.1366 -7.9203 -7.9203 -7.7817 -7.7817 -7.0456 -7.0456 -7.0224 -7.0224 -6.8729 -6.8729 -6.8576 -6.8576 -6.7140 -6.7140 -6.7025 -6.7025 -5.3487 -5.3487 -5.3137 -5.3137 -4.6097 -4.6097 -4.5245 -4.5245 -4.4568 -4.4568 -4.4097 -4.4097 -4.3659 -4.3659 -4.3000 -4.3000 -3.8120 -3.8120 -3.7387 -3.7387 -2.4948 -2.4948 -2.1979 -2.1979 2.7711 2.7711 3.3260 3.3260 k = 0.1172 0.5711-0.0000 ( 7777 PWs) bands (ev): -20.4935 -20.4935 -20.4579 -20.4579 -19.8318 -19.8318 -19.7879 -19.7879 -8.1802 -8.1802 -8.1182 -8.1182 -7.8785 -7.8785 -7.7417 -7.7417 -7.1005 -7.1005 -7.0732 -7.0732 -6.9032 -6.9032 -6.8885 -6.8885 -6.7002 -6.7002 -6.6887 -6.6887 -5.3597 -5.3597 -5.3251 -5.3251 -4.6289 -4.6289 -4.5606 -4.5606 -4.4104 -4.4104 -4.4055 -4.4055 -4.3529 -4.3529 -4.3404 -4.3404 -3.8233 -3.8233 -3.7511 -3.7511 -2.5125 -2.5125 -2.2021 -2.2021 2.8529 2.8529 3.3980 3.3980 k = 0.1216 0.5923-0.0000 ( 7769 PWs) bands (ev): -20.4707 -20.4707 -20.4354 -20.4354 -19.8284 -19.8284 -19.7852 -19.7852 -8.1650 -8.1650 -8.0989 -8.0989 -7.8367 -7.8367 -7.7028 -7.7028 -7.1569 -7.1569 -7.1256 -7.1256 -6.9318 -6.9318 -6.9175 -6.9175 -6.6844 -6.6844 -6.6731 -6.6731 -5.3697 -5.3697 -5.3353 -5.3353 -4.6498 -4.6498 -4.6022 -4.6022 -4.4271 -4.4271 -4.4091 -4.4091 -4.3590 -4.3590 -4.2960 -4.2960 -3.8349 -3.8349 -3.7638 -3.7638 -2.5251 -2.5251 -2.2030 -2.2030 2.9367 2.9367 3.4718 3.4718 k = 0.1259 0.6134-0.0000 ( 7765 PWs) bands (ev): -20.4476 -20.4476 -20.4126 -20.4126 -19.8250 -19.8250 -19.7825 -19.7825 -8.1487 -8.1487 -8.0787 -8.0787 -7.7957 -7.7957 -7.6665 -7.6665 -7.2128 -7.2128 -7.1771 -7.1771 -6.9591 -6.9591 -6.9449 -6.9449 -6.6673 -6.6673 -6.6562 -6.6562 -5.3788 -5.3788 -5.3444 -5.3444 -4.6739 -4.6739 -4.6475 -4.6475 -4.4748 -4.4748 -4.4426 -4.4426 -4.3116 -4.3116 -4.2495 -4.2495 -3.8467 -3.8467 -3.7768 -3.7768 -2.5327 -2.5327 -2.2009 -2.2009 3.0226 3.0226 3.5473 3.5473 k = 0.1303 0.6346-0.0000 ( 7769 PWs) bands (ev): -20.4244 -20.4244 -20.3898 -20.3898 -19.8216 -19.8216 -19.7798 -19.7798 -8.1310 -8.1310 -8.0574 -8.0574 -7.7572 -7.7572 -7.6356 -7.6356 -7.2656 -7.2656 -7.2241 -7.2241 -6.9850 -6.9850 -6.9709 -6.9709 -6.6492 -6.6492 -6.6385 -6.6385 -5.3872 -5.3872 -5.3525 -5.3525 -4.7116 -4.7116 -4.6858 -4.6858 -4.5370 -4.5370 -4.4667 -4.4667 -4.2642 -4.2642 -4.2029 -4.2029 -3.8587 -3.8587 -3.7900 -3.7900 -2.5354 -2.5354 -2.1959 -2.1959 3.1105 3.1105 3.6245 3.6245 k = 0.1346 0.6558-0.0000 ( 7773 PWs) bands (ev): -20.4012 -20.4012 -20.3668 -20.3668 -19.8183 -19.8183 -19.7771 -19.7771 -8.1119 -8.1119 -8.0350 -8.0350 -7.7240 -7.7240 -7.6150 -7.6150 -7.3117 -7.3117 -7.2619 -7.2619 -7.0098 -7.0098 -6.9955 -6.9955 -6.6305 -6.6305 -6.6201 -6.6201 -5.3950 -5.3950 -5.3597 -5.3597 -4.7666 -4.7666 -4.7134 -4.7134 -4.6017 -4.6017 -4.4916 -4.4916 -4.2173 -4.2173 -4.1568 -4.1568 -3.8709 -3.8709 -3.8034 -3.8034 -2.5336 -2.5336 -2.1885 -2.1885 3.2004 3.2004 3.7033 3.7033 k = 0.1390 0.6769-0.0000 ( 7769 PWs) bands (ev): -20.3779 -20.3779 -20.3439 -20.3439 -19.8149 -19.8149 -19.7744 -19.7744 -8.0913 -8.0913 -8.0115 -8.0115 -7.7005 -7.7005 -7.6109 -7.6109 -7.3461 -7.3461 -7.2836 -7.2836 -7.0334 -7.0334 -7.0186 -7.0186 -6.6112 -6.6112 -6.6014 -6.6014 -5.4023 -5.4023 -5.3662 -5.3662 -4.8284 -4.8284 -4.7423 -4.7423 -4.6662 -4.6662 -4.5176 -4.5176 -4.1711 -4.1711 -4.1115 -4.1115 -3.8832 -3.8832 -3.8169 -3.8169 -2.5278 -2.5278 -2.1789 -2.1789 3.2922 3.2922 3.7837 3.7837 k = 0.1433 0.6981-0.0000 ( 7761 PWs) bands (ev): -20.3547 -20.3547 -20.3210 -20.3210 -19.8116 -19.8116 -19.7718 -19.7718 -8.0695 -8.0695 -7.9870 -7.9870 -7.6928 -7.6928 -7.6274 -7.6274 -7.3630 -7.3630 -7.2848 -7.2848 -7.0558 -7.0558 -7.0398 -7.0398 -6.5917 -6.5917 -6.5823 -6.5823 -5.4093 -5.4093 -5.3722 -5.3722 -4.8946 -4.8946 -4.7813 -4.7813 -4.7233 -4.7233 -4.5448 -4.5448 -4.1256 -4.1256 -4.0669 -4.0669 -3.8956 -3.8956 -3.8305 -3.8305 -2.5182 -2.5182 -2.1674 -2.1674 3.3859 3.3859 3.8656 3.8656 k = 0.1476 0.7192-0.0000 ( 7765 PWs) bands (ev): -20.3316 -20.3316 -20.2983 -20.2983 -19.8084 -19.8084 -19.7692 -19.7692 -8.0462 -8.0462 -7.9617 -7.9617 -7.7049 -7.7049 -7.6612 -7.6612 -7.3594 -7.3594 -7.2679 -7.2679 -7.0766 -7.0766 -7.0585 -7.0585 -6.5720 -6.5720 -6.5631 -6.5631 -5.4162 -5.4162 -5.3777 -5.3777 -4.9643 -4.9643 -4.8395 -4.8395 -4.7635 -4.7635 -4.5731 -4.5731 -4.0810 -4.0810 -4.0235 -4.0235 -3.9078 -3.9078 -3.8442 -3.8442 -2.5055 -2.5055 -2.1543 -2.1543 3.4814 3.4814 3.9490 3.9490 k = 0.1520 0.7404-0.0000 ( 7765 PWs) bands (ev): -20.3088 -20.3088 -20.2758 -20.2758 -19.8052 -19.8052 -19.7666 -19.7666 -8.0217 -8.0217 -7.9363 -7.9363 -7.7340 -7.7340 -7.7052 -7.7052 -7.3381 -7.3381 -7.2410 -7.2410 -7.0956 -7.0956 -7.0729 -7.0729 -6.5523 -6.5523 -6.5439 -6.5439 -5.4231 -5.4231 -5.3829 -5.3829 -5.0369 -5.0369 -4.9099 -4.9099 -4.7939 -4.7939 -4.6024 -4.6024 -4.0375 -4.0375 -3.9818 -3.9818 -3.9193 -3.9193 -3.8579 -3.8579 -2.4900 -2.4900 -2.1400 -2.1400 3.5788 3.5788 4.0337 4.0337 k = 0.1563 0.7615-0.0000 ( 7747 PWs) bands (ev): -20.2862 -20.2862 -20.2536 -20.2536 -19.8020 -19.8020 -19.7641 -19.7641 -7.9964 -7.9964 -7.9127 -7.9127 -7.7721 -7.7721 -7.7534 -7.7534 -7.3057 -7.3057 -7.2134 -7.2134 -7.1117 -7.1117 -7.0788 -7.0788 -6.5325 -6.5325 -6.5246 -6.5246 -5.4301 -5.4301 -5.3878 -5.3878 -5.1119 -5.1119 -4.9850 -4.9850 -4.8215 -4.8215 -4.6328 -4.6328 -3.9951 -3.9951 -3.9485 -3.9485 -3.9234 -3.9234 -3.8714 -3.8714 -2.4722 -2.4722 -2.1246 -2.1246 3.6779 3.6779 4.1198 4.1198 k = 0.1607 0.7827-0.0000 ( 7741 PWs) bands (ev): -20.2640 -20.2640 -20.2317 -20.2317 -19.7989 -19.7989 -19.7617 -19.7617 -7.9712 -7.9712 -7.8992 -7.8992 -7.8098 -7.8098 -7.7977 -7.7977 -7.2698 -7.2698 -7.1959 -7.1959 -7.1223 -7.1223 -7.0685 -7.0685 -6.5129 -6.5129 -6.5055 -6.5055 -5.4376 -5.4376 -5.3928 -5.3928 -5.1887 -5.1887 -5.0624 -5.0624 -4.8483 -4.8483 -4.6640 -4.6640 -3.9544 -3.9544 -3.9502 -3.9502 -3.8937 -3.8937 -3.8843 -3.8843 -2.4525 -2.4525 -2.1085 -2.1085 3.7787 3.7787 4.2071 4.2071 k = 0.1650 0.8038-0.0000 ( 7746 PWs) bands (ev): -20.2422 -20.2422 -20.2103 -20.2103 -19.7960 -19.7960 -19.7594 -19.7594 -7.9510 -7.9510 -7.9157 -7.9157 -7.8502 -7.8502 -7.8052 -7.8052 -7.2397 -7.2397 -7.1938 -7.1938 -7.1211 -7.1211 -7.0388 -7.0388 -6.4935 -6.4935 -6.4865 -6.4865 -5.4457 -5.4457 -5.3979 -5.3979 -5.2669 -5.2669 -5.1413 -5.1413 -4.8747 -4.8747 -4.6960 -4.6960 -3.9615 -3.9615 -3.9189 -3.9189 -3.8932 -3.8932 -3.8557 -3.8557 -2.4314 -2.4314 -2.0919 -2.0919 3.8812 3.8812 4.2955 4.2955 k = 0.1693 0.8250-0.0000 ( 7760 PWs) bands (ev): -20.2209 -20.2209 -20.1894 -20.1894 -19.7931 -19.7931 -19.7571 -19.7571 -7.9625 -7.9625 -7.9488 -7.9488 -7.8693 -7.8693 -7.7836 -7.7836 -7.2265 -7.2265 -7.2016 -7.2016 -7.0990 -7.0990 -6.9961 -6.9961 -6.4744 -6.4744 -6.4679 -6.4679 -5.4547 -5.4547 -5.4033 -5.4033 -5.3461 -5.3461 -5.2211 -5.2211 -4.9010 -4.9010 -4.7286 -4.7286 -3.9735 -3.9735 -3.9164 -3.9164 -3.8701 -3.8701 -3.8180 -3.8180 -2.4091 -2.4091 -2.0750 -2.0750 3.9852 3.9852 4.3849 4.3849 k = 0.1737 0.8461-0.0000 ( 7764 PWs) bands (ev): -20.2002 -20.2002 -20.1690 -20.1690 -19.7903 -19.7903 -19.7549 -19.7549 -8.0097 -8.0097 -7.9874 -7.9874 -7.8523 -7.8523 -7.7528 -7.7528 -7.2286 -7.2286 -7.2134 -7.2134 -7.0582 -7.0582 -6.9468 -6.9468 -6.4556 -6.4556 -6.4496 -6.4496 -5.4650 -5.4650 -5.4260 -5.4260 -5.4088 -5.4088 -5.3015 -5.3015 -4.9270 -4.9270 -4.7618 -4.7618 -3.9856 -3.9856 -3.9282 -3.9282 -3.8340 -3.8340 -3.7815 -3.7815 -2.3861 -2.3861 -2.0580 -2.0580 4.0907 4.0907 4.4752 4.4752 k = 0.1780 0.8673-0.0000 ( 7760 PWs) bands (ev): -20.1801 -20.1801 -20.1494 -20.1494 -19.7876 -19.7876 -19.7528 -19.7528 -8.0598 -8.0598 -8.0345 -8.0345 -7.8223 -7.8223 -7.7181 -7.7181 -7.2376 -7.2376 -7.2265 -7.2265 -7.0079 -7.0079 -6.8940 -6.8940 -6.4373 -6.4373 -6.4317 -6.4317 -5.5069 -5.5069 -5.4759 -5.4759 -5.4155 -5.4155 -5.3819 -5.3819 -4.9525 -4.9525 -4.7952 -4.7952 -3.9975 -3.9975 -3.9408 -3.9408 -3.7983 -3.7983 -3.7465 -3.7465 -2.3627 -2.3627 -2.0411 -2.0411 4.1975 4.1975 4.5663 4.5663 k = 0.1824 0.8884-0.0000 ( 7764 PWs) bands (ev): -20.1608 -20.1608 -20.1304 -20.1304 -19.7850 -19.7850 -19.7508 -19.7508 -8.1094 -8.1094 -8.0826 -8.0826 -7.7880 -7.7880 -7.6811 -7.6811 -7.2489 -7.2489 -7.2399 -7.2399 -6.9531 -6.9531 -6.8392 -6.8392 -6.4196 -6.4196 -6.4144 -6.4144 -5.5868 -5.5868 -5.4912 -5.4912 -5.4607 -5.4607 -5.4229 -5.4229 -4.9773 -4.9773 -4.8287 -4.8287 -4.0092 -4.0092 -3.9533 -3.9533 -3.7639 -3.7639 -3.7129 -3.7129 -2.3391 -2.3391 -2.0244 -2.0244 4.3055 4.3055 4.6580 4.6580 k = 0.1867 0.9096-0.0000 ( 7760 PWs) bands (ev): -20.1423 -20.1423 -20.1122 -20.1122 -19.7825 -19.7825 -19.7489 -19.7489 -8.1576 -8.1576 -8.1297 -8.1297 -7.7512 -7.7512 -7.6423 -7.6423 -7.2608 -7.2608 -7.2530 -7.2530 -6.8960 -6.8960 -6.7830 -6.7830 -6.4024 -6.4024 -6.3977 -6.3977 -5.6666 -5.6666 -5.5460 -5.5460 -5.5015 -5.5015 -5.4314 -5.4314 -5.0011 -5.0011 -4.8620 -4.8620 -4.0206 -4.0206 -3.9656 -3.9656 -3.7311 -3.7311 -3.6810 -3.6810 -2.3157 -2.3157 -2.0082 -2.0082 4.4146 4.4146 4.7501 4.7501 k = 0.1911 0.9307-0.0000 ( 7768 PWs) bands (ev): -20.1246 -20.1246 -20.0949 -20.0949 -19.7802 -19.7802 -19.7471 -19.7471 -8.2037 -8.2037 -8.1750 -8.1750 -7.7126 -7.7126 -7.6022 -7.6022 -7.2724 -7.2724 -7.2655 -7.2655 -6.8375 -6.8375 -6.7261 -6.7261 -6.3860 -6.3860 -6.3817 -6.3817 -5.7458 -5.7458 -5.6249 -5.6249 -5.5198 -5.5198 -5.4413 -5.4413 -5.0237 -5.0237 -4.8948 -4.8948 -4.0316 -4.0316 -3.9774 -3.9774 -3.7000 -3.7000 -3.6508 -3.6508 -2.2926 -2.2926 -1.9926 -1.9926 4.5245 4.5245 4.8424 4.8424 k = 0.1954 0.9519-0.0000 ( 7780 PWs) bands (ev): -20.1079 -20.1079 -20.0785 -20.0785 -19.7780 -19.7780 -19.7454 -19.7454 -8.2475 -8.2475 -8.2181 -8.2181 -7.6724 -7.6724 -7.5609 -7.5609 -7.2833 -7.2833 -7.2773 -7.2773 -6.7782 -6.7782 -6.6689 -6.6689 -6.3703 -6.3703 -6.3664 -6.3664 -5.8240 -5.8240 -5.7039 -5.7039 -5.5399 -5.5399 -5.4529 -5.4529 -5.0448 -5.0448 -4.9268 -4.9268 -4.0422 -4.0422 -3.9888 -3.9888 -3.6706 -3.6706 -3.6224 -3.6224 -2.2702 -2.2702 -1.9776 -1.9776 4.6350 4.6350 4.9347 4.9347 k = 0.1997 0.9731-0.0000 ( 7760 PWs) bands (ev): -20.0922 -20.0922 -20.0631 -20.0631 -19.7759 -19.7759 -19.7438 -19.7438 -8.2887 -8.2887 -8.2586 -8.2586 -7.6310 -7.6310 -7.5187 -7.5187 -7.2931 -7.2931 -7.2881 -7.2881 -6.7183 -6.7183 -6.6114 -6.6114 -6.3555 -6.3555 -6.3519 -6.3519 -5.9010 -5.9010 -5.7820 -5.7820 -5.5625 -5.5625 -5.4666 -5.4666 -5.0642 -5.0642 -4.9574 -4.9574 -4.0523 -4.0523 -3.9996 -3.9996 -3.6432 -3.6432 -3.5959 -3.5959 -2.2486 -2.2486 -1.9635 -1.9635 4.7458 4.7458 5.0266 5.0266 k = 0.2041 0.9942-0.0000 ( 7758 PWs) bands (ev): -20.0775 -20.0775 -20.0488 -20.0488 -19.7740 -19.7740 -19.7424 -19.7424 -8.3270 -8.3270 -8.2964 -8.2964 -7.5886 -7.5886 -7.4764 -7.4764 -7.3016 -7.3016 -7.2978 -7.2978 -6.6581 -6.6581 -6.5542 -6.5542 -6.3416 -6.3416 -6.3384 -6.3384 -5.9763 -5.9763 -5.8587 -5.8587 -5.5881 -5.5881 -5.4827 -5.4827 -5.0816 -5.0816 -4.9864 -4.9864 -4.0617 -4.0617 -4.0098 -4.0098 -3.6177 -3.6177 -3.5713 -3.5713 -2.2280 -2.2280 -1.9503 -1.9503 4.8565 4.8565 5.0687 5.0687 k = 0.2084 1.0154-0.0000 ( 7754 PWs) bands (ev): -20.0640 -20.0640 -20.0355 -20.0355 -19.7723 -19.7723 -19.7410 -19.7410 -8.3623 -8.3623 -8.3313 -8.3313 -7.5456 -7.5456 -7.4350 -7.4350 -7.3083 -7.3083 -7.3058 -7.3058 -6.5980 -6.5980 -6.4974 -6.4974 -6.3287 -6.3287 -6.3259 -6.3259 -6.0494 -6.0494 -5.9338 -5.9338 -5.6167 -5.6167 -5.5013 -5.5013 -5.0970 -5.0970 -5.0133 -5.0133 -4.0706 -4.0706 -4.0194 -4.0194 -3.5942 -3.5942 -3.5487 -3.5487 -2.2087 -2.2087 -1.9380 -1.9380 4.9665 4.9665 5.0867 5.0867 k = 0.2128 1.0365-0.0000 ( 7762 PWs) bands (ev): -20.0516 -20.0516 -20.0234 -20.0234 -19.7707 -19.7707 -19.7398 -19.7398 -8.3945 -8.3945 -8.3631 -8.3631 -7.5025 -7.5025 -7.3973 -7.3973 -7.3143 -7.3143 -7.3081 -7.3081 -6.5381 -6.5381 -6.4416 -6.4416 -6.3171 -6.3171 -6.3145 -6.3145 -6.1197 -6.1197 -6.0068 -6.0068 -5.6483 -5.6483 -5.5227 -5.5227 -5.1103 -5.1103 -5.0379 -5.0379 -4.0788 -4.0788 -4.0281 -4.0281 -3.5729 -3.5729 -3.5282 -3.5282 -2.1908 -2.1908 -1.9268 -1.9268 5.0745 5.0745 5.1025 5.1025 k = 0.2171 1.0577-0.0000 ( 7766 PWs) bands (ev): -20.0405 -20.0405 -20.0125 -20.0125 -19.7693 -19.7693 -19.7387 -19.7387 -8.4235 -8.4235 -8.3917 -8.3917 -7.4604 -7.4604 -7.3705 -7.3705 -7.3193 -7.3193 -7.2978 -7.2978 -6.4787 -6.4787 -6.3873 -6.3873 -6.3069 -6.3069 -6.3046 -6.3046 -6.1859 -6.1859 -6.0771 -6.0771 -5.6828 -5.6828 -5.5468 -5.5468 -5.1216 -5.1216 -5.0598 -5.0598 -4.0862 -4.0862 -4.0361 -4.0361 -3.5537 -3.5537 -3.5098 -3.5098 -2.1745 -2.1745 -1.9168 -1.9168 5.1120 5.1120 5.1834 5.1834 k = 0.2215 1.0788-0.0000 ( 7762 PWs) bands (ev): -20.0306 -20.0306 -20.0029 -20.0029 -19.7680 -19.7680 -19.7378 -19.7378 -8.4491 -8.4491 -8.4170 -8.4170 -7.4211 -7.4211 -7.3602 -7.3602 -7.3208 -7.3208 -7.2708 -7.2708 -6.4201 -6.4201 -6.3364 -6.3364 -6.3012 -6.3012 -6.2963 -6.2963 -6.2429 -6.2429 -6.1436 -6.1436 -5.7200 -5.7200 -5.5733 -5.5733 -5.1309 -5.1309 -5.0789 -5.0789 -4.0928 -4.0928 -4.0433 -4.0433 -3.5368 -3.5368 -3.4936 -3.4936 -2.1598 -2.1598 -1.9079 -1.9079 5.1196 5.1196 5.2355 5.2355 k = 0.2258 1.1000-0.0000 ( 7754 PWs) bands (ev): -20.0220 -20.0220 -19.9945 -19.9945 -19.7669 -19.7669 -19.7370 -19.7370 -8.4712 -8.4712 -8.4389 -8.4389 -7.3896 -7.3896 -7.3592 -7.3592 -7.3147 -7.3147 -7.2352 -7.2352 -6.3632 -6.3632 -6.3255 -6.3255 -6.2959 -6.2959 -6.2893 -6.2893 -6.2596 -6.2596 -6.2037 -6.2037 -5.7598 -5.7598 -5.6019 -5.6019 -5.1384 -5.1384 -5.0952 -5.0952 -4.0986 -4.0986 -4.0495 -4.0495 -3.5222 -3.5222 -3.4796 -3.4796 -2.1469 -2.1469 -1.9002 -1.9002 5.1229 5.1229 5.2418 5.2418 k = 0.2301 1.1211-0.0000 ( 7764 PWs) bands (ev): -20.0148 -20.0148 -19.9875 -19.9875 -19.7660 -19.7660 -19.7363 -19.7363 -8.4898 -8.4898 -8.4573 -8.4573 -7.3723 -7.3723 -7.3609 -7.3609 -7.2956 -7.2956 -7.1987 -7.1987 -6.3726 -6.3726 -6.3108 -6.3108 -6.2941 -6.2941 -6.2800 -6.2800 -6.2526 -6.2526 -6.2198 -6.2198 -5.8016 -5.8016 -5.6315 -5.6315 -5.1441 -5.1441 -5.1087 -5.1087 -4.1035 -4.1035 -4.0548 -4.0548 -3.5099 -3.5099 -3.4678 -3.4678 -2.1360 -2.1360 -1.8938 -1.8938 5.1216 5.1216 5.2440 5.2440 k = 0.2345 1.1423-0.0000 ( 7774 PWs) bands (ev): -20.0090 -20.0090 -19.9818 -19.9818 -19.7652 -19.7652 -19.7357 -19.7357 -8.5048 -8.5048 -8.4722 -8.4722 -7.3668 -7.3668 -7.3631 -7.3631 -7.2674 -7.2674 -7.1652 -7.1652 -6.4162 -6.4162 -6.3317 -6.3317 -6.2789 -6.2789 -6.2738 -6.2738 -6.2360 -6.2360 -6.1803 -6.1803 -5.8450 -5.8450 -5.6609 -5.6609 -5.1483 -5.1483 -5.1196 -5.1196 -4.1075 -4.1075 -4.0591 -4.0591 -3.5000 -3.5000 -3.4584 -3.4584 -2.1271 -2.1271 -1.8886 -1.8886 5.1155 5.1155 5.2419 5.2419 k = 0.2388 1.1634-0.0000 ( 7774 PWs) bands (ev): -20.0046 -20.0046 -19.9775 -19.9775 -19.7647 -19.7647 -19.7353 -19.7353 -8.5162 -8.5162 -8.4834 -8.4834 -7.3661 -7.3661 -7.3647 -7.3647 -7.2392 -7.2392 -7.1373 -7.1373 -6.4513 -6.4513 -6.3732 -6.3732 -6.2712 -6.2712 -6.2697 -6.2697 -6.1889 -6.1889 -6.1434 -6.1434 -5.8889 -5.8889 -5.6878 -5.6878 -5.1510 -5.1510 -5.1279 -5.1279 -4.1106 -4.1106 -4.0623 -4.0623 -3.4926 -3.4926 -3.4512 -3.4512 -2.1203 -2.1203 -1.8847 -1.8847 5.1045 5.1045 5.2353 5.2353 k = 0.2432 1.1846-0.0000 ( 7774 PWs) bands (ev): -20.0016 -20.0016 -19.9745 -19.9745 -19.7643 -19.7643 -19.7350 -19.7350 -8.5239 -8.5239 -8.4910 -8.4910 -7.3671 -7.3671 -7.3653 -7.3653 -7.2168 -7.2168 -7.1170 -7.1170 -6.4754 -6.4754 -6.4057 -6.4057 -6.2677 -6.2677 -6.2668 -6.2668 -6.1421 -6.1421 -6.1147 -6.1147 -5.9309 -5.9309 -5.7095 -5.7095 -5.1526 -5.1526 -5.1336 -5.1336 -4.1127 -4.1127 -4.0646 -4.0646 -3.4875 -3.4875 -3.4464 -3.4464 -2.1157 -2.1157 -1.8820 -1.8820 5.0884 5.0884 5.2240 5.2240 k = 0.2475 1.2057-0.0000 ( 7768 PWs) bands (ev): -20.0001 -20.0001 -19.9730 -19.9730 -19.7641 -19.7641 -19.7349 -19.7349 -8.5279 -8.5279 -8.4949 -8.4949 -7.3679 -7.3679 -7.3656 -7.3656 -7.2040 -7.2040 -7.1061 -7.1061 -6.4878 -6.4878 -6.4243 -6.4243 -6.2660 -6.2660 -6.2654 -6.2654 -6.1074 -6.1074 -6.0981 -6.0981 -5.9632 -5.9632 -5.7222 -5.7222 -5.1532 -5.1532 -5.1367 -5.1367 -4.1138 -4.1138 -4.0657 -4.0657 -3.4850 -3.4850 -3.4440 -3.4440 -2.1133 -2.1133 -1.8806 -1.8806 5.0672 5.0672 5.2082 5.2082 k = 0.2518 1.2269-0.0000 ( 7756 PWs) bands (ev): -19.9999 -19.9999 -19.9729 -19.9729 -19.7641 -19.7641 -19.7348 -19.7348 -8.5281 -8.5281 -8.4952 -8.4952 -7.3679 -7.3679 -7.3657 -7.3657 -7.2031 -7.2031 -7.1053 -7.1053 -6.4887 -6.4887 -6.4256 -6.4256 -6.2659 -6.2659 -6.2653 -6.2653 -6.1045 -6.1045 -6.0967 -6.0967 -5.9660 -5.9660 -5.7231 -5.7231 -5.1532 -5.1532 -5.1368 -5.1368 -4.1139 -4.1139 -4.0658 -4.0658 -3.4849 -3.4849 -3.4439 -3.4439 -2.1131 -2.1131 -1.8805 -1.8805 5.0409 5.0409 5.1876 5.1876 k = 0.2562 1.2481-0.0000 ( 7758 PWs) bands (ev): -20.0013 -20.0013 -19.9742 -19.9742 -19.7642 -19.7642 -19.7350 -19.7350 -8.5247 -8.5247 -8.4918 -8.4918 -7.3673 -7.3673 -7.3654 -7.3654 -7.2142 -7.2142 -7.1148 -7.1148 -6.4780 -6.4780 -6.4094 -6.4094 -6.2673 -6.2673 -6.2665 -6.2665 -6.1359 -6.1359 -6.1114 -6.1114 -5.9365 -5.9365 -5.7119 -5.7119 -5.1526 -5.1526 -5.1342 -5.1342 -4.1130 -4.1130 -4.0648 -4.0648 -3.4873 -3.4873 -3.4461 -3.4461 -2.1152 -2.1152 -1.8817 -1.8817 5.0096 5.0096 5.1625 5.1625 k = 0.2605 1.2692-0.0000 ( 7754 PWs) bands (ev): -20.0041 -20.0041 -19.9769 -19.9769 -19.7646 -19.7646 -19.7352 -19.7352 -8.5175 -8.5175 -8.4847 -8.4847 -7.3662 -7.3662 -7.3649 -7.3649 -7.2354 -7.2354 -7.1337 -7.1337 -6.4556 -6.4556 -6.3787 -6.3787 -6.2705 -6.2705 -6.2691 -6.2691 -6.1818 -6.1818 -6.1385 -6.1385 -5.8951 -5.8951 -5.6913 -5.6913 -5.1511 -5.1511 -5.1288 -5.1288 -4.1111 -4.1111 -4.0628 -4.0628 -3.4922 -3.4922 -3.4507 -3.4507 -2.1194 -2.1194 -1.8842 -1.8842 4.9736 4.9736 5.1330 5.1330 k = 0.2605 1.2692-0.0000 ( 7754 PWs) bands (ev): -20.0041 -20.0041 -19.9769 -19.9769 -19.7646 -19.7646 -19.7352 -19.7352 -8.5175 -8.5175 -8.4847 -8.4847 -7.3662 -7.3662 -7.3649 -7.3649 -7.2354 -7.2354 -7.1337 -7.1337 -6.4556 -6.4556 -6.3787 -6.3787 -6.2705 -6.2705 -6.2691 -6.2691 -6.1818 -6.1818 -6.1385 -6.1385 -5.8951 -5.8951 -5.6913 -5.6913 -5.1511 -5.1511 -5.1288 -5.1288 -4.1111 -4.1111 -4.0628 -4.0628 -3.4922 -3.4922 -3.4507 -3.4507 -2.1194 -2.1194 -1.8842 -1.8842 4.9736 4.9736 5.1330 5.1330 k = 0.2388 1.2692-0.0000 ( 7757 PWs) bands (ev): -20.0034 -20.0034 -19.9763 -19.9763 -19.7645 -19.7645 -19.7352 -19.7352 -8.5193 -8.5193 -8.4864 -8.4864 -7.3665 -7.3665 -7.3651 -7.3651 -7.2304 -7.2304 -7.1292 -7.1292 -6.4611 -6.4611 -6.3859 -6.3859 -6.2697 -6.2697 -6.2685 -6.2685 -6.1720 -6.1720 -6.1322 -6.1322 -5.9039 -5.9039 -5.6960 -5.6960 -5.1515 -5.1515 -5.1300 -5.1300 -4.1116 -4.1116 -4.0633 -4.0633 -3.4910 -3.4910 -3.4496 -3.4496 -2.1184 -2.1184 -1.8836 -1.8836 4.9816 4.9816 5.1396 5.1396 k = 0.2171 1.2692-0.0000 ( 7757 PWs) bands (ev): -20.0028 -20.0028 -19.9757 -19.9757 -19.7644 -19.7644 -19.7351 -19.7351 -8.5209 -8.5209 -8.4880 -8.4880 -7.3666 -7.3666 -7.3652 -7.3652 -7.2258 -7.2258 -7.1250 -7.1250 -6.4661 -6.4661 -6.3926 -6.3926 -6.2690 -6.2690 -6.2679 -6.2679 -6.1624 -6.1624 -6.1263 -6.1263 -5.9125 -5.9125 -5.7005 -5.7005 -5.1519 -5.1519 -5.1312 -5.1312 -4.1120 -4.1120 -4.0638 -4.0638 -3.4899 -3.4899 -3.4486 -3.4486 -2.1175 -2.1175 -1.8830 -1.8830 4.9900 4.9900 5.1463 5.1463 k = 0.1954 1.2692-0.0000 ( 7765 PWs) bands (ev): -20.0022 -20.0022 -19.9751 -19.9751 -19.7644 -19.7644 -19.7351 -19.7351 -8.5223 -8.5223 -8.4895 -8.4895 -7.3669 -7.3669 -7.3653 -7.3653 -7.2215 -7.2215 -7.1211 -7.1211 -6.4706 -6.4706 -6.3989 -6.3989 -6.2684 -6.2684 -6.2674 -6.2674 -6.1531 -6.1531 -6.1208 -6.1208 -5.9209 -5.9209 -5.7047 -5.7047 -5.1522 -5.1522 -5.1324 -5.1324 -4.1124 -4.1124 -4.0642 -4.0642 -3.4889 -3.4889 -3.4477 -3.4477 -2.1166 -2.1166 -1.8825 -1.8825 4.9985 4.9985 5.1529 5.1529 k = 0.1737 1.2692-0.0000 ( 7764 PWs) bands (ev): -20.0017 -20.0017 -19.9746 -19.9746 -19.7643 -19.7643 -19.7350 -19.7350 -8.5236 -8.5236 -8.4907 -8.4907 -7.3671 -7.3671 -7.3654 -7.3654 -7.2176 -7.2176 -7.1177 -7.1177 -6.4747 -6.4747 -6.4046 -6.4046 -6.2678 -6.2678 -6.2669 -6.2669 -6.1441 -6.1441 -6.1157 -6.1157 -5.9291 -5.9291 -5.7086 -5.7086 -5.1524 -5.1524 -5.1333 -5.1333 -4.1127 -4.1127 -4.0645 -4.0645 -3.4880 -3.4880 -3.4468 -3.4468 -2.1158 -2.1158 -1.8821 -1.8821 5.0070 5.0070 5.1594 5.1594 k = 0.1520 1.2692-0.0000 ( 7771 PWs) bands (ev): -20.0013 -20.0013 -19.9742 -19.9742 -19.7642 -19.7642 -19.7350 -19.7350 -8.5247 -8.5247 -8.4919 -8.4919 -7.3673 -7.3673 -7.3655 -7.3655 -7.2140 -7.2140 -7.1146 -7.1146 -6.4782 -6.4782 -6.4097 -6.4097 -6.2673 -6.2673 -6.2665 -6.2665 -6.1355 -6.1355 -6.1112 -6.1112 -5.9369 -5.9369 -5.7121 -5.7121 -5.1526 -5.1526 -5.1342 -5.1342 -4.1130 -4.1130 -4.0649 -4.0649 -3.4873 -3.4873 -3.4461 -3.4461 -2.1151 -2.1151 -1.8817 -1.8817 5.0152 5.0152 5.1656 5.1656 k = 0.1303 1.2692-0.0000 ( 7771 PWs) bands (ev): -20.0009 -20.0009 -19.9738 -19.9738 -19.7642 -19.7642 -19.7349 -19.7349 -8.5257 -8.5257 -8.4928 -8.4928 -7.3675 -7.3675 -7.3656 -7.3656 -7.2109 -7.2109 -7.1119 -7.1119 -6.4813 -6.4813 -6.4142 -6.4142 -6.2669 -6.2669 -6.2662 -6.2662 -6.1275 -6.1275 -6.1071 -6.1071 -5.9443 -5.9443 -5.7152 -5.7152 -5.1528 -5.1528 -5.1350 -5.1350 -4.1133 -4.1133 -4.0651 -4.0651 -3.4866 -3.4866 -3.4455 -3.4455 -2.1146 -2.1146 -1.8814 -1.8814 5.0229 5.0229 5.1712 5.1712 k = 0.1086 1.2692-0.0000 ( 7775 PWs) bands (ev): -20.0006 -20.0006 -19.9735 -19.9735 -19.7642 -19.7642 -19.7349 -19.7349 -8.5266 -8.5266 -8.4937 -8.4937 -7.3676 -7.3676 -7.3656 -7.3656 -7.2082 -7.2082 -7.1096 -7.1096 -6.4839 -6.4839 -6.4182 -6.4182 -6.2665 -6.2665 -6.2658 -6.2658 -6.1201 -6.1201 -6.1036 -6.1036 -5.9512 -5.9512 -5.7179 -5.7179 -5.1530 -5.1530 -5.1356 -5.1356 -4.1135 -4.1135 -4.0654 -4.0654 -3.4860 -3.4860 -3.4449 -3.4449 -2.1141 -2.1141 -1.8811 -1.8811 5.0300 5.0300 5.1762 5.1762 k = 0.0868 1.2692-0.0000 ( 7779 PWs) bands (ev): -20.0003 -20.0003 -19.9733 -19.9733 -19.7641 -19.7641 -19.7349 -19.7349 -8.5273 -8.5273 -8.4943 -8.4943 -7.3678 -7.3678 -7.3657 -7.3657 -7.2060 -7.2060 -7.1078 -7.1078 -6.4860 -6.4860 -6.4214 -6.4214 -6.2662 -6.2662 -6.2656 -6.2656 -6.1136 -6.1136 -6.1008 -6.1008 -5.9573 -5.9573 -5.7201 -5.7201 -5.1531 -5.1531 -5.1362 -5.1362 -4.1136 -4.1136 -4.0656 -4.0656 -3.4855 -3.4855 -3.4445 -3.4445 -2.1137 -2.1137 -1.8809 -1.8809 5.0361 5.0361 5.1804 5.1804 k = 0.0651 1.2692-0.0000 ( 7775 PWs) bands (ev): -20.0001 -20.0001 -19.9731 -19.9731 -19.7641 -19.7641 -19.7349 -19.7349 -8.5278 -8.5278 -8.4949 -8.4949 -7.3679 -7.3679 -7.3657 -7.3657 -7.2042 -7.2042 -7.1063 -7.1063 -6.4876 -6.4876 -6.4240 -6.4240 -6.2660 -6.2660 -6.2654 -6.2654 -6.1082 -6.1082 -6.0984 -6.0984 -5.9624 -5.9624 -5.7219 -5.7219 -5.1532 -5.1532 -5.1366 -5.1366 -4.1138 -4.1138 -4.0657 -4.0657 -3.4851 -3.4851 -3.4441 -3.4441 -2.1133 -2.1133 -1.8807 -1.8807 5.0411 5.0411 5.1838 5.1838 k = 0.0434 1.2692-0.0000 ( 7779 PWs) bands (ev): -19.9999 -19.9999 -19.9729 -19.9729 -19.7641 -19.7641 -19.7348 -19.7348 -8.5282 -8.5282 -8.4952 -8.4952 -7.3679 -7.3679 -7.3658 -7.3658 -7.2030 -7.2030 -7.1052 -7.1052 -6.4888 -6.4888 -6.4258 -6.4258 -6.2658 -6.2658 -6.2653 -6.2653 -6.1041 -6.1041 -6.0967 -6.0967 -5.9663 -5.9663 -5.7232 -5.7232 -5.1533 -5.1533 -5.1369 -5.1369 -4.1139 -4.1139 -4.0658 -4.0658 -3.4849 -3.4849 -3.4439 -3.4439 -2.1131 -2.1131 -1.8806 -1.8806 5.0449 5.0449 5.1863 5.1863 k = 0.0217 1.2692-0.0000 ( 7773 PWs) bands (ev): -19.9998 -19.9998 -19.9728 -19.9728 -19.7641 -19.7641 -19.7348 -19.7348 -8.5284 -8.5284 -8.4955 -8.4955 -7.3680 -7.3680 -7.3658 -7.3658 -7.2022 -7.2022 -7.1046 -7.1046 -6.4895 -6.4895 -6.4269 -6.4269 -6.2657 -6.2657 -6.2652 -6.2652 -6.1016 -6.1016 -6.0956 -6.0956 -5.9688 -5.9688 -5.7240 -5.7240 -5.1533 -5.1533 -5.1371 -5.1371 -4.1139 -4.1139 -4.0659 -4.0659 -3.4847 -3.4847 -3.4437 -3.4437 -2.1130 -2.1130 -1.8805 -1.8805 5.0471 5.0471 5.1878 5.1878 k = 0.0000 1.2692-0.0000 ( 7768 PWs) bands (ev): -19.9998 -19.9998 -19.9728 -19.9728 -19.7641 -19.7641 -19.7348 -19.7348 -8.5285 -8.5285 -8.4956 -8.4956 -7.3680 -7.3680 -7.3658 -7.3658 -7.2019 -7.2019 -7.1044 -7.1044 -6.4897 -6.4897 -6.4273 -6.4273 -6.2657 -6.2657 -6.2652 -6.2652 -6.1007 -6.1007 -6.0951 -6.0951 -5.9697 -5.9697 -5.7242 -5.7242 -5.1533 -5.1533 -5.1371 -5.1371 -4.1139 -4.1139 -4.0659 -4.0659 -3.4847 -3.4847 -3.4437 -3.4437 -2.1129 -2.1129 -1.8805 -1.8805 5.0479 5.0479 5.1883 5.1883 k = 0.0000 1.2692-0.0000 ( 7768 PWs) bands (ev): -19.9998 -19.9998 -19.9728 -19.9728 -19.7641 -19.7641 -19.7348 -19.7348 -8.5285 -8.5285 -8.4956 -8.4956 -7.3680 -7.3680 -7.3658 -7.3658 -7.2019 -7.2019 -7.1044 -7.1044 -6.4897 -6.4897 -6.4273 -6.4273 -6.2657 -6.2657 -6.2652 -6.2652 -6.1007 -6.1007 -6.0951 -6.0951 -5.9697 -5.9697 -5.7242 -5.7242 -5.1533 -5.1533 -5.1371 -5.1371 -4.1139 -4.1139 -4.0659 -4.0659 -3.4847 -3.4847 -3.4437 -3.4437 -2.1129 -2.1129 -1.8805 -1.8805 5.0479 5.0479 5.1883 5.1883 k = 0.0000 1.2692 0.0213 ( 7772 PWs) bands (ev): -19.9997 -19.9997 -19.9729 -19.9729 -19.7640 -19.7640 -19.7349 -19.7349 -8.5284 -8.5284 -8.4957 -8.4957 -7.3680 -7.3680 -7.3658 -7.3658 -7.2017 -7.2017 -7.1047 -7.1047 -6.4897 -6.4897 -6.4276 -6.4276 -6.2657 -6.2657 -6.2652 -6.2652 -6.1007 -6.1007 -6.0952 -6.0952 -5.9688 -5.9688 -5.7249 -5.7249 -5.1533 -5.1533 -5.1372 -5.1372 -4.1138 -4.1138 -4.0661 -4.0661 -3.4845 -3.4845 -3.4438 -3.4438 -2.1122 -2.1122 -1.8812 -1.8812 5.0483 5.0483 5.1878 5.1878 k = 0.0000 1.2692 0.0426 ( 7770 PWs) bands (ev): -19.9995 -19.9995 -19.9732 -19.9732 -19.7636 -19.7636 -19.7352 -19.7352 -8.5281 -8.5281 -8.4960 -8.4960 -7.3679 -7.3679 -7.3658 -7.3658 -7.2008 -7.2008 -7.1056 -7.1056 -6.4895 -6.4895 -6.4284 -6.4284 -6.2657 -6.2657 -6.2652 -6.2652 -6.1006 -6.1006 -6.0952 -6.0952 -5.9661 -5.9661 -5.7269 -5.7269 -5.1532 -5.1532 -5.1374 -5.1374 -4.1134 -4.1134 -4.0665 -4.0665 -3.4841 -3.4841 -3.4441 -3.4441 -2.1099 -2.1099 -1.8833 -1.8833 5.0496 5.0496 5.1864 5.1864 k = 0.0000 1.2692 0.0639 ( 7778 PWs) bands (ev): -19.9991 -19.9991 -19.9737 -19.9737 -19.7631 -19.7631 -19.7356 -19.7356 -8.5276 -8.5276 -8.4965 -8.4965 -7.3679 -7.3679 -7.3658 -7.3658 -7.1994 -7.1994 -7.1072 -7.1072 -6.4892 -6.4892 -6.4299 -6.4299 -6.2657 -6.2657 -6.2652 -6.2652 -6.1004 -6.1004 -6.0953 -6.0953 -5.9617 -5.9617 -5.7302 -5.7302 -5.1530 -5.1530 -5.1377 -5.1377 -4.1127 -4.1127 -4.0673 -4.0673 -3.4834 -3.4834 -3.4447 -3.4447 -2.1063 -2.1063 -1.8869 -1.8869 5.0516 5.0516 5.1841 5.1841 k = 0.0000 1.2692 0.0852 ( 7778 PWs) bands (ev): -19.9986 -19.9986 -19.9743 -19.9743 -19.7624 -19.7624 -19.7361 -19.7361 -8.5269 -8.5269 -8.4973 -8.4973 -7.3678 -7.3678 -7.3658 -7.3658 -7.1974 -7.1974 -7.1094 -7.1094 -6.4887 -6.4887 -6.4318 -6.4318 -6.2657 -6.2657 -6.2652 -6.2652 -6.1001 -6.1001 -6.0953 -6.0953 -5.9557 -5.9557 -5.7349 -5.7349 -5.1528 -5.1528 -5.1381 -5.1381 -4.1117 -4.1117 -4.0684 -4.0684 -3.4825 -3.4825 -3.4455 -3.4455 -2.1012 -2.1012 -1.8917 -1.8917 5.0544 5.0544 5.1809 5.1809 k = 0.0000 1.2692 0.1064 ( 7776 PWs) bands (ev): -19.9980 -19.9980 -19.9751 -19.9751 -19.7616 -19.7616 -19.7369 -19.7369 -8.5260 -8.5260 -8.4982 -8.4982 -7.3677 -7.3677 -7.3658 -7.3658 -7.1949 -7.1949 -7.1121 -7.1121 -6.4880 -6.4880 -6.4342 -6.4342 -6.2657 -6.2657 -6.2652 -6.2652 -6.0997 -6.0997 -6.0954 -6.0954 -5.9482 -5.9482 -5.7408 -5.7408 -5.1525 -5.1525 -5.1387 -5.1387 -4.1105 -4.1105 -4.0698 -4.0698 -3.4813 -3.4813 -3.4466 -3.4466 -2.0948 -2.0948 -1.8979 -1.8979 5.0580 5.0580 5.1769 5.1769 k = 0.0000 1.2692 0.1277 ( 7782 PWs) bands (ev): -19.9972 -19.9972 -19.9761 -19.9761 -19.7605 -19.7605 -19.7377 -19.7377 -8.5250 -8.5250 -8.4993 -8.4993 -7.3676 -7.3676 -7.3659 -7.3659 -7.1919 -7.1919 -7.1154 -7.1154 -6.4871 -6.4871 -6.4370 -6.4370 -6.2656 -6.2656 -6.2652 -6.2652 -6.0994 -6.0994 -6.0955 -6.0955 -5.9393 -5.9393 -5.7479 -5.7479 -5.1522 -5.1522 -5.1393 -5.1393 -4.1090 -4.1090 -4.0715 -4.0715 -3.4799 -3.4799 -3.4478 -3.4478 -2.0871 -2.0871 -1.9054 -1.9054 5.0623 5.0623 5.1720 5.1720 k = 0.0000 1.2692 0.1490 ( 7776 PWs) bands (ev): -19.9962 -19.9962 -19.9772 -19.9772 -19.7593 -19.7593 -19.7387 -19.7387 -8.5238 -8.5238 -8.5005 -8.5005 -7.3675 -7.3675 -7.3659 -7.3659 -7.1884 -7.1884 -7.1192 -7.1192 -6.4858 -6.4858 -6.4403 -6.4403 -6.2656 -6.2656 -6.2652 -6.2652 -6.0991 -6.0991 -6.0957 -6.0957 -5.9291 -5.9291 -5.7562 -5.7562 -5.1517 -5.1517 -5.1401 -5.1401 -4.1073 -4.1073 -4.0733 -4.0733 -3.4782 -3.4782 -3.4493 -3.4493 -2.0783 -2.0783 -1.9139 -1.9139 5.0673 5.0673 5.1665 5.1665 k = 0.0000 1.2692 0.1703 ( 7772 PWs) bands (ev): -19.9952 -19.9952 -19.9784 -19.9784 -19.7580 -19.7580 -19.7399 -19.7399 -8.5225 -8.5225 -8.5019 -8.5019 -7.3674 -7.3674 -7.3659 -7.3659 -7.1845 -7.1845 -7.1234 -7.1234 -6.4843 -6.4843 -6.4438 -6.4438 -6.2656 -6.2656 -6.2653 -6.2653 -6.0987 -6.0987 -6.0958 -6.0958 -5.9179 -5.9179 -5.7655 -5.7655 -5.1512 -5.1512 -5.1409 -5.1409 -4.1054 -4.1054 -4.0754 -4.0754 -3.4764 -3.4764 -3.4509 -3.4509 -2.0684 -2.0684 -1.9235 -1.9235 5.0729 5.0729 5.1604 5.1604 k = 0.0000 1.2692 0.1916 ( 7772 PWs) bands (ev): -19.9941 -19.9941 -19.9798 -19.9798 -19.7566 -19.7566 -19.7411 -19.7411 -8.5210 -8.5210 -8.5035 -8.5035 -7.3672 -7.3672 -7.3660 -7.3660 -7.1802 -7.1802 -7.1280 -7.1280 -6.4823 -6.4823 -6.4476 -6.4476 -6.2656 -6.2656 -6.2653 -6.2653 -6.0984 -6.0984 -6.0959 -6.0959 -5.9058 -5.9058 -5.7758 -5.7758 -5.1506 -5.1506 -5.1418 -5.1418 -4.1032 -4.1032 -4.0777 -4.0777 -3.4745 -3.4745 -3.4527 -3.4527 -2.0576 -2.0576 -1.9340 -1.9340 5.0791 5.0791 5.1537 5.1537 k = 0.0000 1.2692 0.2129 ( 7772 PWs) bands (ev): -19.9928 -19.9928 -19.9812 -19.9812 -19.7551 -19.7551 -19.7425 -19.7425 -8.5194 -8.5194 -8.5051 -8.5051 -7.3671 -7.3671 -7.3660 -7.3660 -7.1755 -7.1755 -7.1329 -7.1329 -6.4800 -6.4800 -6.4515 -6.4515 -6.2656 -6.2656 -6.2653 -6.2653 -6.0981 -6.0981 -6.0961 -6.0961 -5.8930 -5.8930 -5.7871 -5.7871 -5.1499 -5.1499 -5.1427 -5.1427 -4.1010 -4.1010 -4.0802 -4.0802 -3.4724 -3.4724 -3.4546 -3.4546 -2.0461 -2.0461 -1.9453 -1.9453 5.0858 5.0858 5.1466 5.1466 k = 0.0000 1.2692 0.2342 ( 7780 PWs) bands (ev): -19.9915 -19.9915 -19.9826 -19.9826 -19.7535 -19.7535 -19.7439 -19.7439 -8.5177 -8.5177 -8.5069 -8.5069 -7.3669 -7.3669 -7.3661 -7.3661 -7.1705 -7.1705 -7.1381 -7.1381 -6.4773 -6.4773 -6.4555 -6.4555 -6.2656 -6.2656 -6.2653 -6.2653 -6.0978 -6.0978 -6.0963 -6.0963 -5.8796 -5.8796 -5.7991 -5.7991 -5.1492 -5.1492 -5.1437 -5.1437 -4.0985 -4.0985 -4.0827 -4.0827 -3.4702 -3.4702 -3.4567 -3.4567 -2.0340 -2.0340 -1.9573 -1.9573 5.0929 5.0929 5.1392 5.1392 k = 0.0000 1.2692 0.2555 ( 7782 PWs) bands (ev): -19.9901 -19.9901 -19.9841 -19.9841 -19.7519 -19.7519 -19.7454 -19.7454 -8.5160 -8.5160 -8.5087 -8.5087 -7.3668 -7.3668 -7.3663 -7.3663 -7.1653 -7.1653 -7.1435 -7.1435 -6.4743 -6.4743 -6.4596 -6.4596 -6.2655 -6.2655 -6.2654 -6.2654 -6.0975 -6.0975 -6.0965 -6.0965 -5.8660 -5.8660 -5.8117 -5.8117 -5.1484 -5.1484 -5.1446 -5.1446 -4.0960 -4.0960 -4.0853 -4.0853 -3.4680 -3.4680 -3.4589 -3.4589 -2.0214 -2.0214 -1.9697 -1.9697 5.1003 5.1003 5.1315 5.1315 k = 0.0000 1.2692 0.2768 ( 7782 PWs) bands (ev): -19.9886 -19.9886 -19.9856 -19.9856 -19.7503 -19.7503 -19.7470 -19.7470 -8.5142 -8.5142 -8.5105 -8.5105 -7.3666 -7.3666 -7.3664 -7.3664 -7.1600 -7.1600 -7.1489 -7.1489 -6.4709 -6.4709 -6.4635 -6.4635 -6.2655 -6.2655 -6.2654 -6.2654 -6.0972 -6.0972 -6.0967 -6.0967 -5.8522 -5.8522 -5.8249 -5.8249 -5.1475 -5.1475 -5.1456 -5.1456 -4.0934 -4.0934 -4.0880 -4.0880 -3.4657 -3.4657 -3.4611 -3.4611 -2.0085 -2.0085 -1.9825 -1.9825 5.1079 5.1079 5.1236 5.1236 k = 0.0000 1.2692 0.2980 ( 7776 PWs) bands (ev): -19.9872 -19.9872 -19.9871 -19.9871 -19.7486 -19.7486 -19.7486 -19.7486 -8.5123 -8.5123 -8.5123 -8.5123 -7.3665 -7.3665 -7.3665 -7.3665 -7.1545 -7.1545 -7.1545 -7.1545 -6.4673 -6.4673 -6.4673 -6.4673 -6.2655 -6.2655 -6.2654 -6.2654 -6.0969 -6.0969 -6.0969 -6.0969 -5.8385 -5.8385 -5.8384 -5.8384 -5.1466 -5.1466 -5.1466 -5.1466 -4.0907 -4.0907 -4.0907 -4.0907 -3.4634 -3.4634 -3.4634 -3.4634 -1.9955 -1.9955 -1.9955 -1.9955 5.1157 5.1157 5.1158 5.1158 k = 0.0000 1.2692 0.2980 ( 7776 PWs) bands (ev): -19.9872 -19.9872 -19.9871 -19.9871 -19.7486 -19.7486 -19.7486 -19.7486 -8.5123 -8.5123 -8.5123 -8.5123 -7.3665 -7.3665 -7.3665 -7.3665 -7.1545 -7.1545 -7.1545 -7.1545 -6.4673 -6.4673 -6.4673 -6.4673 -6.2655 -6.2655 -6.2654 -6.2654 -6.0969 -6.0969 -6.0969 -6.0969 -5.8385 -5.8385 -5.8384 -5.8384 -5.1466 -5.1466 -5.1466 -5.1466 -4.0907 -4.0907 -4.0907 -4.0907 -3.4634 -3.4634 -3.4634 -3.4634 -1.9955 -1.9955 -1.9955 -1.9955 5.1157 5.1157 5.1158 5.1158 k = 0.0217 1.2692 0.2980 ( 7782 PWs) bands (ev): -19.9872 -19.9872 -19.9871 -19.9871 -19.7486 -19.7486 -19.7486 -19.7486 -8.5123 -8.5123 -8.5123 -8.5123 -7.3665 -7.3665 -7.3665 -7.3665 -7.1547 -7.1547 -7.1547 -7.1547 -6.4670 -6.4670 -6.4670 -6.4670 -6.2655 -6.2655 -6.2655 -6.2655 -6.0974 -6.0974 -6.0974 -6.0974 -5.8381 -5.8381 -5.8380 -5.8380 -5.1465 -5.1465 -5.1465 -5.1465 -4.0907 -4.0907 -4.0907 -4.0907 -3.4634 -3.4634 -3.4634 -3.4634 -1.9955 -1.9955 -1.9955 -1.9955 5.1151 5.1151 5.1151 5.1151 k = 0.0434 1.2692 0.2980 ( 7774 PWs) bands (ev): -19.9873 -19.9873 -19.9872 -19.9872 -19.7487 -19.7487 -19.7486 -19.7486 -8.5120 -8.5120 -8.5120 -8.5120 -7.3664 -7.3664 -7.3664 -7.3664 -7.1554 -7.1554 -7.1554 -7.1554 -6.4661 -6.4661 -6.4661 -6.4661 -6.2656 -6.2656 -6.2656 -6.2656 -6.0987 -6.0987 -6.0987 -6.0987 -5.8369 -5.8369 -5.8368 -5.8368 -5.1464 -5.1464 -5.1464 -5.1464 -4.0906 -4.0906 -4.0906 -4.0906 -3.4636 -3.4636 -3.4636 -3.4636 -1.9957 -1.9957 -1.9956 -1.9956 5.1131 5.1131 5.1131 5.1131 k = 0.0651 1.2692 0.2980 ( 7768 PWs) bands (ev): -19.9874 -19.9874 -19.9874 -19.9874 -19.7487 -19.7487 -19.7486 -19.7486 -8.5117 -8.5117 -8.5117 -8.5117 -7.3663 -7.3663 -7.3663 -7.3663 -7.1566 -7.1566 -7.1566 -7.1566 -6.4646 -6.4646 -6.4646 -6.4646 -6.2657 -6.2657 -6.2657 -6.2657 -6.1010 -6.1010 -6.1010 -6.1010 -5.8349 -5.8349 -5.8349 -5.8349 -5.1463 -5.1463 -5.1462 -5.1462 -4.0905 -4.0905 -4.0905 -4.0905 -3.4638 -3.4638 -3.4638 -3.4638 -1.9958 -1.9958 -1.9958 -1.9958 5.1099 5.1099 5.1100 5.1100 k = 0.0868 1.2692 0.2980 ( 7762 PWs) bands (ev): -19.9876 -19.9876 -19.9876 -19.9876 -19.7487 -19.7487 -19.7486 -19.7486 -8.5111 -8.5111 -8.5111 -8.5111 -7.3663 -7.3663 -7.3663 -7.3663 -7.1583 -7.1583 -7.1583 -7.1583 -6.4625 -6.4625 -6.4625 -6.4625 -6.2659 -6.2659 -6.2659 -6.2659 -6.1040 -6.1040 -6.1040 -6.1040 -5.8322 -5.8322 -5.8322 -5.8322 -5.1460 -5.1460 -5.1460 -5.1460 -4.0904 -4.0904 -4.0904 -4.0904 -3.4642 -3.4642 -3.4642 -3.4642 -1.9961 -1.9961 -1.9960 -1.9960 5.1056 5.1056 5.1056 5.1056 k = 0.1086 1.2692 0.2980 ( 7764 PWs) bands (ev): -19.9879 -19.9879 -19.9878 -19.9878 -19.7487 -19.7487 -19.7487 -19.7487 -8.5104 -8.5104 -8.5104 -8.5104 -7.3662 -7.3662 -7.3662 -7.3662 -7.1604 -7.1604 -7.1604 -7.1604 -6.4598 -6.4598 -6.4598 -6.4598 -6.2662 -6.2662 -6.2662 -6.2662 -6.1079 -6.1079 -6.1078 -6.1078 -5.8288 -5.8288 -5.8288 -5.8288 -5.1457 -5.1457 -5.1457 -5.1457 -4.0902 -4.0902 -4.0902 -4.0902 -3.4647 -3.4647 -3.4646 -3.4646 -1.9964 -1.9964 -1.9964 -1.9964 5.1002 5.1002 5.1003 5.1003 k = 0.1303 1.2692 0.2980 ( 7760 PWs) bands (ev): -19.9882 -19.9882 -19.9882 -19.9882 -19.7488 -19.7488 -19.7487 -19.7487 -8.5096 -8.5096 -8.5096 -8.5096 -7.3660 -7.3660 -7.3660 -7.3660 -7.1630 -7.1630 -7.1630 -7.1630 -6.4566 -6.4566 -6.4566 -6.4566 -6.2665 -6.2665 -6.2665 -6.2665 -6.1124 -6.1124 -6.1124 -6.1124 -5.8248 -5.8248 -5.8248 -5.8248 -5.1453 -5.1453 -5.1453 -5.1453 -4.0900 -4.0900 -4.0900 -4.0900 -3.4652 -3.4652 -3.4652 -3.4652 -1.9968 -1.9968 -1.9968 -1.9968 5.0941 5.0941 5.0941 5.0941 k = 0.1520 1.2692 0.2980 ( 7754 PWs) bands (ev): -19.9886 -19.9886 -19.9885 -19.9885 -19.7488 -19.7488 -19.7487 -19.7487 -8.5086 -8.5086 -8.5086 -8.5086 -7.3659 -7.3659 -7.3659 -7.3659 -7.1660 -7.1660 -7.1660 -7.1660 -6.4528 -6.4528 -6.4528 -6.4528 -6.2669 -6.2669 -6.2669 -6.2669 -6.1176 -6.1176 -6.1176 -6.1176 -5.8203 -5.8203 -5.8203 -5.8203 -5.1449 -5.1449 -5.1449 -5.1449 -4.0897 -4.0897 -4.0897 -4.0897 -3.4659 -3.4659 -3.4659 -3.4659 -1.9972 -1.9972 -1.9972 -1.9972 5.0872 5.0872 5.0872 5.0872 k = 0.1737 1.2692 0.2980 ( 7758 PWs) bands (ev): -19.9890 -19.9890 -19.9890 -19.9890 -19.7489 -19.7489 -19.7488 -19.7488 -8.5075 -8.5075 -8.5075 -8.5075 -7.3657 -7.3657 -7.3657 -7.3657 -7.1694 -7.1694 -7.1694 -7.1694 -6.4485 -6.4485 -6.4484 -6.4484 -6.2673 -6.2673 -6.2673 -6.2673 -6.1234 -6.1234 -6.1234 -6.1234 -5.8153 -5.8153 -5.8152 -5.8152 -5.1444 -5.1444 -5.1444 -5.1444 -4.0894 -4.0894 -4.0894 -4.0894 -3.4667 -3.4667 -3.4666 -3.4666 -1.9978 -1.9978 -1.9978 -1.9978 5.0798 5.0798 5.0799 5.0799 k = 0.1954 1.2692 0.2980 ( 7768 PWs) bands (ev): -19.9895 -19.9895 -19.9895 -19.9895 -19.7489 -19.7489 -19.7489 -19.7489 -8.5062 -8.5062 -8.5062 -8.5062 -7.3655 -7.3655 -7.3655 -7.3655 -7.1733 -7.1733 -7.1733 -7.1733 -6.4436 -6.4436 -6.4436 -6.4436 -6.2679 -6.2679 -6.2679 -6.2679 -6.1298 -6.1298 -6.1298 -6.1298 -5.8098 -5.8098 -5.8098 -5.8098 -5.1438 -5.1438 -5.1438 -5.1438 -4.0891 -4.0891 -4.0891 -4.0891 -3.4675 -3.4675 -3.4675 -3.4675 -1.9984 -1.9984 -1.9984 -1.9984 5.0722 5.0722 5.0723 5.0723 k = 0.2171 1.2692 0.2980 ( 7756 PWs) bands (ev): -19.9901 -19.9901 -19.9900 -19.9900 -19.7490 -19.7490 -19.7489 -19.7489 -8.5048 -8.5048 -8.5048 -8.5048 -7.3653 -7.3653 -7.3653 -7.3653 -7.1775 -7.1775 -7.1775 -7.1775 -6.4383 -6.4383 -6.4383 -6.4383 -6.2684 -6.2684 -6.2684 -6.2684 -6.1366 -6.1366 -6.1365 -6.1365 -5.8039 -5.8039 -5.8039 -5.8039 -5.1431 -5.1431 -5.1431 -5.1431 -4.0887 -4.0887 -4.0887 -4.0887 -3.4685 -3.4685 -3.4684 -3.4684 -1.9990 -1.9990 -1.9990 -1.9990 5.0645 5.0645 5.0645 5.0645 k = 0.2388 1.2692 0.2980 ( 7756 PWs) bands (ev): -19.9907 -19.9907 -19.9906 -19.9906 -19.7490 -19.7490 -19.7490 -19.7490 -8.5032 -8.5032 -8.5032 -8.5032 -7.3651 -7.3651 -7.3651 -7.3651 -7.1820 -7.1820 -7.1820 -7.1820 -6.4325 -6.4325 -6.4324 -6.4324 -6.2691 -6.2691 -6.2691 -6.2691 -6.1438 -6.1438 -6.1437 -6.1437 -5.7978 -5.7978 -5.7978 -5.7978 -5.1424 -5.1424 -5.1424 -5.1424 -4.0883 -4.0883 -4.0882 -4.0882 -3.4695 -3.4695 -3.4695 -3.4695 -1.9998 -1.9998 -1.9998 -1.9998 5.0569 5.0569 5.0569 5.0569 k = 0.2605 1.2692 0.2980 ( 7770 PWs) bands (ev): -19.9914 -19.9914 -19.9913 -19.9913 -19.7491 -19.7491 -19.7491 -19.7491 -8.5015 -8.5015 -8.5015 -8.5015 -7.3649 -7.3649 -7.3649 -7.3649 -7.1870 -7.1870 -7.1869 -7.1869 -6.4262 -6.4262 -6.4262 -6.4262 -6.2698 -6.2698 -6.2698 -6.2698 -6.1513 -6.1513 -6.1513 -6.1513 -5.7913 -5.7913 -5.7913 -5.7913 -5.1416 -5.1416 -5.1416 -5.1416 -4.0878 -4.0878 -4.0878 -4.0878 -3.4707 -3.4707 -3.4706 -3.4706 -2.0006 -2.0006 -2.0006 -2.0006 5.0495 5.0495 5.0495 5.0495 k = 0.2605 1.2692 0.2980 ( 7770 PWs) bands (ev): -19.9914 -19.9914 -19.9913 -19.9913 -19.7491 -19.7491 -19.7491 -19.7491 -8.5015 -8.5015 -8.5015 -8.5015 -7.3649 -7.3649 -7.3649 -7.3649 -7.1870 -7.1870 -7.1869 -7.1869 -6.4262 -6.4262 -6.4262 -6.4262 -6.2698 -6.2698 -6.2698 -6.2698 -6.1513 -6.1513 -6.1513 -6.1513 -5.7913 -5.7913 -5.7913 -5.7913 -5.1416 -5.1416 -5.1416 -5.1416 -4.0878 -4.0878 -4.0878 -4.0878 -3.4707 -3.4707 -3.4706 -3.4706 -2.0006 -2.0006 -2.0006 -2.0006 5.0495 5.0495 5.0495 5.0495 k = 0.2562 1.2481 0.2980 ( 7782 PWs) bands (ev): -19.9886 -19.9886 -19.9886 -19.9886 -19.7488 -19.7488 -19.7488 -19.7488 -8.5086 -8.5086 -8.5086 -8.5086 -7.3659 -7.3659 -7.3659 -7.3659 -7.1662 -7.1662 -7.1662 -7.1662 -6.4526 -6.4526 -6.4526 -6.4526 -6.2670 -6.2670 -6.2670 -6.2670 -6.1180 -6.1180 -6.1180 -6.1180 -5.8200 -5.8200 -5.8200 -5.8200 -5.1449 -5.1449 -5.1449 -5.1449 -4.0897 -4.0897 -4.0897 -4.0897 -3.4660 -3.4660 -3.4659 -3.4659 -1.9973 -1.9973 -1.9973 -1.9973 5.0827 5.0827 5.0827 5.0827 k = 0.2518 1.2269 0.2980 ( 7774 PWs) bands (ev): -19.9873 -19.9873 -19.9872 -19.9872 -19.7487 -19.7487 -19.7486 -19.7486 -8.5120 -8.5120 -8.5120 -8.5120 -7.3664 -7.3664 -7.3664 -7.3664 -7.1555 -7.1555 -7.1555 -7.1555 -6.4660 -6.4660 -6.4660 -6.4660 -6.2656 -6.2656 -6.2656 -6.2656 -6.0990 -6.0990 -6.0990 -6.0990 -5.8367 -5.8367 -5.8366 -5.8366 -5.1464 -5.1464 -5.1464 -5.1464 -4.0906 -4.0906 -4.0906 -4.0906 -3.4636 -3.4636 -3.4636 -3.4636 -1.9957 -1.9957 -1.9957 -1.9957 5.1112 5.1112 5.1112 5.1112 k = 0.2475 1.2057 0.2980 ( 7778 PWs) bands (ev): -19.9874 -19.9874 -19.9873 -19.9873 -19.7487 -19.7487 -19.7486 -19.7486 -8.5117 -8.5117 -8.5117 -8.5117 -7.3663 -7.3663 -7.3663 -7.3663 -7.1564 -7.1564 -7.1564 -7.1564 -6.4649 -6.4649 -6.4649 -6.4649 -6.2657 -6.2657 -6.2657 -6.2657 -6.1005 -6.1005 -6.1005 -6.1005 -5.8353 -5.8353 -5.8353 -5.8353 -5.1463 -5.1463 -5.1463 -5.1463 -4.0905 -4.0905 -4.0905 -4.0905 -3.4637 -3.4637 -3.4637 -3.4637 -1.9958 -1.9958 -1.9958 -1.9958 5.1349 5.1349 5.1349 5.1349 k = 0.2432 1.1846 0.2980 ( 7774 PWs) bands (ev): -19.9889 -19.9889 -19.9889 -19.9889 -19.7488 -19.7488 -19.7488 -19.7488 -8.5078 -8.5078 -8.5078 -8.5078 -7.3657 -7.3657 -7.3657 -7.3657 -7.1687 -7.1687 -7.1687 -7.1687 -6.4494 -6.4494 -6.4494 -6.4494 -6.2673 -6.2673 -6.2673 -6.2673 -6.1221 -6.1221 -6.1221 -6.1221 -5.8165 -5.8165 -5.8165 -5.8165 -5.1446 -5.1446 -5.1446 -5.1446 -4.0894 -4.0894 -4.0894 -4.0894 -3.4662 -3.4662 -3.4662 -3.4662 -1.9977 -1.9977 -1.9977 -1.9977 5.1537 5.1537 5.1537 5.1537 k = 0.2388 1.1634 0.2980 ( 7778 PWs) bands (ev): -19.9919 -19.9919 -19.9918 -19.9918 -19.7492 -19.7492 -19.7491 -19.7491 -8.5001 -8.5001 -8.5001 -8.5001 -7.3646 -7.3646 -7.3646 -7.3646 -7.1908 -7.1908 -7.1908 -7.1908 -6.4214 -6.4214 -6.4214 -6.4214 -6.2704 -6.2704 -6.2704 -6.2704 -6.1570 -6.1570 -6.1570 -6.1570 -5.7867 -5.7867 -5.7866 -5.7866 -5.1412 -5.1412 -5.1412 -5.1412 -4.0873 -4.0873 -4.0872 -4.0872 -3.4711 -3.4711 -3.4711 -3.4711 -2.0013 -2.0013 -2.0013 -2.0013 5.1676 5.1676 5.1676 5.1676 k = 0.2345 1.1423 0.2980 ( 7782 PWs) bands (ev): -19.9962 -19.9962 -19.9962 -19.9962 -19.7497 -19.7497 -19.7496 -19.7496 -8.4888 -8.4888 -8.4888 -8.4888 -7.3635 -7.3635 -7.3635 -7.3635 -7.2200 -7.2200 -7.2200 -7.2200 -6.3841 -6.3841 -6.3841 -6.3841 -6.2753 -6.2753 -6.2753 -6.2753 -6.1979 -6.1979 -6.1979 -6.1979 -5.7517 -5.7517 -5.7516 -5.7516 -5.1360 -5.1360 -5.1360 -5.1360 -4.0841 -4.0841 -4.0841 -4.0841 -3.4784 -3.4784 -3.4784 -3.4784 -2.0066 -2.0066 -2.0066 -2.0066 5.1766 5.1766 5.1766 5.1766 k = 0.2301 1.1211 0.2980 ( 7780 PWs) bands (ev): -20.0020 -20.0020 -20.0019 -20.0019 -19.7503 -19.7503 -19.7503 -19.7503 -8.4739 -8.4739 -8.4739 -8.4739 -7.3632 -7.3632 -7.3632 -7.3632 -7.2532 -7.2532 -7.2532 -7.2532 -6.3452 -6.3452 -6.3451 -6.3451 -6.2839 -6.2839 -6.2839 -6.2839 -6.2344 -6.2344 -6.2343 -6.2343 -5.7150 -5.7150 -5.7150 -5.7150 -5.1289 -5.1289 -5.1289 -5.1289 -4.0800 -4.0800 -4.0800 -4.0800 -3.4880 -3.4880 -3.4880 -3.4880 -2.0135 -2.0135 -2.0135 -2.0135 5.1808 5.1808 5.1808 5.1808 k = 0.2258 1.1000 0.2980 ( 7784 PWs) bands (ev): -20.0091 -20.0091 -20.0091 -20.0091 -19.7512 -19.7512 -19.7511 -19.7511 -8.4554 -8.4554 -8.4554 -8.4554 -7.3667 -7.3667 -7.3667 -7.3667 -7.2855 -7.2855 -7.2855 -7.2855 -6.3379 -6.3379 -6.3378 -6.3378 -6.2930 -6.2930 -6.2930 -6.2930 -6.2363 -6.2363 -6.2362 -6.2362 -5.6787 -5.6787 -5.6787 -5.6787 -5.1198 -5.1198 -5.1198 -5.1198 -4.0750 -4.0750 -4.0749 -4.0749 -3.5000 -3.5000 -3.5000 -3.5000 -2.0221 -2.0221 -2.0221 -2.0221 5.1805 5.1805 5.1805 5.1805 k = 0.2215 1.0788 0.2980 ( 7780 PWs) bands (ev): -20.0176 -20.0176 -20.0175 -20.0175 -19.7521 -19.7521 -19.7521 -19.7521 -8.4334 -8.4334 -8.4334 -8.4334 -7.3813 -7.3813 -7.3812 -7.3812 -7.3082 -7.3082 -7.3082 -7.3082 -6.3791 -6.3791 -6.3790 -6.3790 -6.2975 -6.2975 -6.2974 -6.2974 -6.1923 -6.1923 -6.1923 -6.1923 -5.6438 -5.6438 -5.6437 -5.6437 -5.1085 -5.1085 -5.1085 -5.1085 -4.0690 -4.0690 -4.0690 -4.0690 -3.5143 -3.5143 -3.5142 -3.5142 -2.0322 -2.0322 -2.0322 -2.0322 5.1758 5.1758 5.1758 5.1758 k = 0.2171 1.0577 0.2980 ( 7780 PWs) bands (ev): -20.0273 -20.0273 -20.0273 -20.0273 -19.7532 -19.7532 -19.7532 -19.7532 -8.4080 -8.4080 -8.4079 -8.4079 -7.4115 -7.4115 -7.4115 -7.4115 -7.3157 -7.3157 -7.3156 -7.3156 -6.4318 -6.4318 -6.4317 -6.4317 -6.3057 -6.3057 -6.3057 -6.3057 -6.1316 -6.1316 -6.1315 -6.1315 -5.6110 -5.6110 -5.6110 -5.6110 -5.0949 -5.0949 -5.0949 -5.0949 -4.0622 -4.0622 -4.0622 -4.0622 -3.5308 -3.5308 -3.5307 -3.5307 -2.0438 -2.0438 -2.0438 -2.0438 5.1669 5.1669 5.1669 5.1669 k = 0.2128 1.0365 0.2980 ( 7778 PWs) bands (ev): -20.0383 -20.0383 -20.0383 -20.0383 -19.7545 -19.7545 -19.7545 -19.7545 -8.3792 -8.3792 -8.3792 -8.3792 -7.4504 -7.4504 -7.4504 -7.4504 -7.3139 -7.3139 -7.3139 -7.3139 -6.4877 -6.4877 -6.4877 -6.4877 -6.3159 -6.3159 -6.3159 -6.3159 -6.0645 -6.0645 -6.0645 -6.0645 -5.5809 -5.5809 -5.5808 -5.5808 -5.0790 -5.0790 -5.0790 -5.0790 -4.0546 -4.0546 -4.0545 -4.0545 -3.5494 -3.5494 -3.5494 -3.5494 -2.0569 -2.0569 -2.0568 -2.0568 5.1535 5.1535 5.1535 5.1535 k = 0.2084 1.0154 0.2980 ( 7782 PWs) bands (ev): -20.0505 -20.0505 -20.0505 -20.0505 -19.7559 -19.7559 -19.7559 -19.7559 -8.3472 -8.3472 -8.3472 -8.3472 -7.4924 -7.4924 -7.4924 -7.4924 -7.3081 -7.3081 -7.3081 -7.3081 -6.5451 -6.5451 -6.5451 -6.5451 -6.3274 -6.3274 -6.3274 -6.3274 -5.9938 -5.9938 -5.9938 -5.9938 -5.5535 -5.5535 -5.5535 -5.5535 -5.0606 -5.0606 -5.0606 -5.0606 -4.0462 -4.0462 -4.0462 -4.0462 -3.5703 -3.5703 -3.5702 -3.5702 -2.0712 -2.0712 -2.0712 -2.0712 5.0796 5.0796 5.0796 5.0796 k = 0.2041 0.9942 0.2980 ( 7778 PWs) bands (ev): -20.0639 -20.0639 -20.0639 -20.0639 -19.7575 -19.7575 -19.7574 -19.7574 -8.3121 -8.3121 -8.3121 -8.3121 -7.5352 -7.5352 -7.5352 -7.5352 -7.3002 -7.3002 -7.3002 -7.3002 -6.6033 -6.6033 -6.6032 -6.6032 -6.3400 -6.3400 -6.3400 -6.3400 -5.9206 -5.9206 -5.9206 -5.9206 -5.5291 -5.5291 -5.5290 -5.5290 -5.0399 -5.0399 -5.0399 -5.0399 -4.0372 -4.0372 -4.0371 -4.0371 -3.5931 -3.5931 -3.5931 -3.5931 -2.0868 -2.0868 -2.0867 -2.0867 4.9777 4.9777 4.9777 4.9777 k = 0.1997 0.9731 0.2980 ( 7766 PWs) bands (ev): -20.0784 -20.0784 -20.0784 -20.0784 -19.7592 -19.7592 -19.7591 -19.7591 -8.2741 -8.2741 -8.2741 -8.2741 -7.5778 -7.5778 -7.5777 -7.5777 -7.2909 -7.2909 -7.2909 -7.2909 -6.6618 -6.6618 -6.6618 -6.6618 -6.3537 -6.3537 -6.3537 -6.3537 -5.8455 -5.8455 -5.8455 -5.8455 -5.5073 -5.5073 -5.5073 -5.5073 -5.0170 -5.0170 -5.0170 -5.0170 -4.0275 -4.0275 -4.0274 -4.0274 -3.6180 -3.6180 -3.6180 -3.6180 -2.1034 -2.1034 -2.1034 -2.1034 4.8746 4.8746 4.8746 4.8746 k = 0.1954 0.9519 0.2980 ( 7758 PWs) bands (ev): -20.0940 -20.0940 -20.0939 -20.0939 -19.7610 -19.7610 -19.7610 -19.7610 -8.2333 -8.2333 -8.2332 -8.2332 -7.6196 -7.6196 -7.6196 -7.6196 -7.2804 -7.2804 -7.2804 -7.2804 -6.7203 -6.7203 -6.7203 -6.7203 -6.3684 -6.3684 -6.3683 -6.3683 -5.7693 -5.7693 -5.7692 -5.7692 -5.4880 -5.4880 -5.4880 -5.4880 -4.9923 -4.9923 -4.9922 -4.9922 -4.0173 -4.0173 -4.0172 -4.0172 -3.6448 -3.6448 -3.6447 -3.6447 -2.1210 -2.1210 -2.1210 -2.1210 4.7711 4.7711 4.7711 4.7711 k = 0.1911 0.9307 0.2980 ( 7760 PWs) bands (ev): -20.1105 -20.1105 -20.1105 -20.1105 -19.7630 -19.7630 -19.7629 -19.7629 -8.1899 -8.1899 -8.1899 -8.1899 -7.6603 -7.6603 -7.6603 -7.6603 -7.2690 -7.2690 -7.2690 -7.2690 -6.7786 -6.7786 -6.7786 -6.7786 -6.3838 -6.3838 -6.3838 -6.3838 -5.6925 -5.6925 -5.6924 -5.6924 -5.4706 -5.4706 -5.4705 -5.4705 -4.9659 -4.9659 -4.9659 -4.9659 -4.0066 -4.0066 -4.0065 -4.0065 -3.6734 -3.6734 -3.6733 -3.6733 -2.1394 -2.1394 -2.1394 -2.1394 4.6675 4.6675 4.6675 4.6675 k = 0.1867 0.9096 0.2980 ( 7760 PWs) bands (ev): -20.1280 -20.1280 -20.1279 -20.1279 -19.7650 -19.7650 -19.7650 -19.7650 -8.1443 -8.1443 -8.1442 -8.1442 -7.6997 -7.6997 -7.6996 -7.6996 -7.2568 -7.2568 -7.2568 -7.2568 -6.8364 -6.8364 -6.8364 -6.8364 -6.4001 -6.4001 -6.4001 -6.4001 -5.6163 -5.6163 -5.6162 -5.6162 -5.4539 -5.4539 -5.4538 -5.4538 -4.9382 -4.9382 -4.9382 -4.9382 -3.9955 -3.9955 -3.9954 -3.9954 -3.7037 -3.7037 -3.7036 -3.7036 -2.1585 -2.1585 -2.1585 -2.1585 4.5641 4.5641 4.5642 4.5642 k = 0.1824 0.8884 0.2980 ( 7754 PWs) bands (ev): -20.1463 -20.1463 -20.1463 -20.1463 -19.7672 -19.7672 -19.7672 -19.7672 -8.0968 -8.0968 -8.0968 -8.0968 -7.7373 -7.7373 -7.7372 -7.7372 -7.2442 -7.2442 -7.2442 -7.2442 -6.8931 -6.8931 -6.8931 -6.8931 -6.4170 -6.4170 -6.4170 -6.4170 -5.5438 -5.5438 -5.5436 -5.5436 -5.4350 -5.4350 -5.4349 -5.4349 -4.9095 -4.9095 -4.9095 -4.9095 -3.9842 -3.9842 -3.9841 -3.9841 -3.7356 -3.7356 -3.7355 -3.7355 -2.1781 -2.1781 -2.1780 -2.1780 4.4613 4.4613 4.4614 4.4614 k = 0.1780 0.8673 0.2980 ( 7772 PWs) bands (ev): -20.1654 -20.1654 -20.1654 -20.1654 -19.7695 -19.7695 -19.7695 -19.7695 -8.0482 -8.0482 -8.0481 -8.0481 -7.7727 -7.7727 -7.7727 -7.7727 -7.2316 -7.2316 -7.2316 -7.2316 -6.9482 -6.9482 -6.9482 -6.9482 -6.4346 -6.4346 -6.4346 -6.4346 -5.4850 -5.4850 -5.4848 -5.4848 -5.4037 -5.4037 -5.4035 -5.4035 -4.8802 -4.8802 -4.8802 -4.8802 -3.9729 -3.9729 -3.9728 -3.9728 -3.7688 -3.7688 -3.7687 -3.7687 -2.1979 -2.1979 -2.1979 -2.1979 4.3593 4.3593 4.3593 4.3593 k = 0.1737 0.8461 0.2980 ( 7764 PWs) bands (ev): -20.1853 -20.1853 -20.1853 -20.1853 -19.7720 -19.7720 -19.7719 -19.7719 -7.9998 -7.9998 -7.9997 -7.9997 -7.8048 -7.8048 -7.8047 -7.8047 -7.2199 -7.2199 -7.2199 -7.2199 -7.0005 -7.0005 -7.0005 -7.0005 -6.4526 -6.4526 -6.4526 -6.4526 -5.4533 -5.4533 -5.4532 -5.4532 -5.3465 -5.3465 -5.3463 -5.3463 -4.8505 -4.8505 -4.8504 -4.8504 -3.9618 -3.9618 -3.9617 -3.9617 -3.8030 -3.8030 -3.8028 -3.8028 -2.2179 -2.2179 -2.2178 -2.2178 4.2582 4.2582 4.2582 4.2582 k = 0.1693 0.8250 0.2980 ( 7760 PWs) bands (ev): -20.2058 -20.2058 -20.2058 -20.2058 -19.7745 -19.7745 -19.7744 -19.7744 -7.9559 -7.9559 -7.9558 -7.9558 -7.8296 -7.8296 -7.8295 -7.8295 -7.2111 -7.2111 -7.2111 -7.2111 -7.0475 -7.0475 -7.0474 -7.0474 -6.4711 -6.4711 -6.4711 -6.4711 -5.4377 -5.4377 -5.4376 -5.4376 -5.2747 -5.2747 -5.2746 -5.2746 -4.8205 -4.8205 -4.8204 -4.8204 -3.9520 -3.9520 -3.9518 -3.9518 -3.8373 -3.8373 -3.8371 -3.8371 -2.2376 -2.2376 -2.2376 -2.2376 4.1582 4.1582 4.1582 4.1582 k = 0.1650 0.8038 0.2980 ( 7770 PWs) bands (ev): -20.2269 -20.2269 -20.2269 -20.2269 -19.7771 -19.7771 -19.7770 -19.7770 -7.9308 -7.9308 -7.9306 -7.9306 -7.8335 -7.8335 -7.8334 -7.8334 -7.2106 -7.2106 -7.2106 -7.2106 -7.0835 -7.0835 -7.0835 -7.0835 -6.4900 -6.4900 -6.4900 -6.4900 -5.4274 -5.4274 -5.4273 -5.4273 -5.1992 -5.1992 -5.1992 -5.1992 -4.7904 -4.7904 -4.7903 -4.7903 -3.9459 -3.9459 -3.9456 -3.9456 -3.8690 -3.8690 -3.8687 -3.8687 -2.2570 -2.2570 -2.2570 -2.2570 4.0594 4.0594 4.0594 4.0594 k = 0.1607 0.7827 0.2980 ( 7772 PWs) bands (ev): -20.2485 -20.2485 -20.2485 -20.2485 -19.7797 -19.7797 -19.7797 -19.7797 -7.9379 -7.9379 -7.9377 -7.9377 -7.8040 -7.8040 -7.8038 -7.8038 -7.2258 -7.2258 -7.2258 -7.2258 -7.1002 -7.1002 -7.1002 -7.1002 -6.5092 -6.5092 -6.5092 -6.5092 -5.4192 -5.4192 -5.4191 -5.4191 -5.1235 -5.1235 -5.1234 -5.1234 -4.7602 -4.7602 -4.7601 -4.7601 -3.9526 -3.9526 -3.9523 -3.9523 -3.8891 -3.8891 -3.8887 -3.8887 -2.2758 -2.2758 -2.2757 -2.2757 3.9619 3.9619 3.9619 3.9619 k = 0.1563 0.7615 0.2980 ( 7764 PWs) bands (ev): -20.2705 -20.2705 -20.2705 -20.2705 -19.7825 -19.7825 -19.7825 -19.7825 -7.9596 -7.9596 -7.9595 -7.9595 -7.7599 -7.7599 -7.7598 -7.7598 -7.2549 -7.2549 -7.2549 -7.2549 -7.0981 -7.0981 -7.0981 -7.0981 -6.5286 -6.5286 -6.5286 -6.5286 -5.4120 -5.4120 -5.4120 -5.4120 -5.0487 -5.0487 -5.0487 -5.0487 -4.7298 -4.7298 -4.7298 -4.7298 -3.9793 -3.9793 -3.9791 -3.9791 -3.8902 -3.8902 -3.8899 -3.8899 -2.2936 -2.2936 -2.2935 -2.2935 3.8659 3.8659 3.8659 3.8659 k = 0.1520 0.7404 0.2980 ( 7776 PWs) bands (ev): -20.2929 -20.2929 -20.2929 -20.2929 -19.7853 -19.7853 -19.7853 -19.7853 -7.9845 -7.9845 -7.9844 -7.9844 -7.7152 -7.7152 -7.7151 -7.7151 -7.2873 -7.2873 -7.2873 -7.2873 -7.0857 -7.0857 -7.0857 -7.0857 -6.5481 -6.5481 -6.5481 -6.5481 -5.4054 -5.4054 -5.4053 -5.4053 -4.9761 -4.9761 -4.9761 -4.9761 -4.6991 -4.6991 -4.6991 -4.6991 -4.0164 -4.0164 -4.0162 -4.0162 -3.8820 -3.8820 -3.8819 -3.8819 -2.3101 -2.3101 -2.3101 -2.3101 3.7714 3.7714 3.7714 3.7714 k = 0.1476 0.7192 0.2980 ( 7772 PWs) bands (ev): -20.3156 -20.3156 -20.3155 -20.3155 -19.7882 -19.7882 -19.7882 -19.7882 -8.0096 -8.0096 -8.0095 -8.0095 -7.6772 -7.6772 -7.6771 -7.6771 -7.3135 -7.3135 -7.3135 -7.3135 -7.0684 -7.0684 -7.0684 -7.0684 -6.5676 -6.5676 -6.5675 -6.5675 -5.3989 -5.3989 -5.3989 -5.3989 -4.9066 -4.9066 -4.9066 -4.9066 -4.6676 -4.6676 -4.6676 -4.6676 -4.0573 -4.0573 -4.0572 -4.0572 -3.8711 -3.8711 -3.8709 -3.8709 -2.3251 -2.3251 -2.3250 -2.3250 3.6785 3.6785 3.6785 3.6785 k = 0.1433 0.6981 0.2980 ( 7770 PWs) bands (ev): -20.3385 -20.3385 -20.3384 -20.3384 -19.7911 -19.7911 -19.7911 -19.7911 -8.0339 -8.0339 -8.0338 -8.0338 -7.6528 -7.6528 -7.6528 -7.6528 -7.3254 -7.3254 -7.3254 -7.3254 -7.0483 -7.0483 -7.0483 -7.0483 -6.5870 -6.5870 -6.5870 -6.5870 -5.3925 -5.3925 -5.3925 -5.3925 -4.8414 -4.8414 -4.8414 -4.8414 -4.6347 -4.6347 -4.6347 -4.6347 -4.1003 -4.1003 -4.1002 -4.1002 -3.8591 -3.8591 -3.8590 -3.8590 -2.3381 -2.3381 -2.3381 -2.3381 3.5873 3.5873 3.5873 3.5873 k = 0.1390 0.6769 0.2980 ( 7766 PWs) bands (ev): -20.3615 -20.3615 -20.3615 -20.3615 -19.7941 -19.7941 -19.7941 -19.7941 -8.0571 -8.0571 -8.0571 -8.0571 -7.6480 -7.6480 -7.6479 -7.6479 -7.3169 -7.3169 -7.3169 -7.3169 -7.0264 -7.0264 -7.0264 -7.0264 -6.6063 -6.6063 -6.6062 -6.6062 -5.3858 -5.3858 -5.3858 -5.3858 -4.7820 -4.7820 -4.7820 -4.7820 -4.5993 -4.5993 -4.5993 -4.5993 -4.1446 -4.1446 -4.1445 -4.1445 -3.8468 -3.8468 -3.8467 -3.8467 -2.3489 -2.3489 -2.3489 -2.3489 3.4978 3.4978 3.4978 3.4978 k = 0.1346 0.6558 0.2980 ( 7754 PWs) bands (ev): -20.3846 -20.3846 -20.3846 -20.3846 -19.7971 -19.7971 -19.7971 -19.7971 -8.0792 -8.0792 -8.0791 -8.0791 -7.6622 -7.6622 -7.6621 -7.6621 -7.2884 -7.2884 -7.2884 -7.2884 -7.0030 -7.0030 -7.0029 -7.0029 -6.6252 -6.6252 -6.6252 -6.6252 -5.3787 -5.3787 -5.3787 -5.3787 -4.7299 -4.7299 -4.7299 -4.7299 -4.5605 -4.5605 -4.5605 -4.5605 -4.1900 -4.1900 -4.1899 -4.1899 -3.8343 -3.8343 -3.8343 -3.8343 -2.3570 -2.3570 -2.3570 -2.3570 3.4101 3.4101 3.4101 3.4101 k = 0.1303 0.6346 0.2980 ( 7758 PWs) bands (ev): -20.4077 -20.4077 -20.4077 -20.4077 -19.8001 -19.8001 -19.8001 -19.8001 -8.1000 -8.1000 -8.0999 -8.0999 -7.6897 -7.6897 -7.6896 -7.6896 -7.2460 -7.2460 -7.2460 -7.2460 -6.9783 -6.9783 -6.9783 -6.9783 -6.6437 -6.6437 -6.6437 -6.6437 -5.3711 -5.3711 -5.3711 -5.3711 -4.6858 -4.6858 -4.6858 -4.6858 -4.5181 -4.5181 -4.5181 -4.5181 -4.2361 -4.2361 -4.2360 -4.2360 -3.8219 -3.8219 -3.8218 -3.8218 -2.3622 -2.3622 -2.3621 -2.3621 3.3242 3.3242 3.3242 3.3242 k = 0.1259 0.6134 0.2980 ( 7758 PWs) bands (ev): -20.4307 -20.4307 -20.4307 -20.4307 -19.8032 -19.8032 -19.8032 -19.8032 -8.1195 -8.1195 -8.1195 -8.1195 -7.7248 -7.7248 -7.7247 -7.7247 -7.1957 -7.1957 -7.1957 -7.1957 -6.9523 -6.9523 -6.9523 -6.9523 -6.6616 -6.6616 -6.6616 -6.6616 -5.3628 -5.3628 -5.3628 -5.3628 -4.6492 -4.6492 -4.6492 -4.6492 -4.4730 -4.4730 -4.4730 -4.4730 -4.2828 -4.2828 -4.2827 -4.2827 -3.8095 -3.8095 -3.8095 -3.8095 -2.3639 -2.3639 -2.3639 -2.3639 3.2401 3.2401 3.2402 3.2402 k = 0.1216 0.5923 0.2980 ( 7754 PWs) bands (ev): -20.4536 -20.4536 -20.4536 -20.4536 -19.8062 -19.8062 -19.8062 -19.8062 -8.1379 -8.1379 -8.1378 -8.1378 -7.7636 -7.7636 -7.7635 -7.7635 -7.1418 -7.1418 -7.1418 -7.1418 -6.9250 -6.9250 -6.9250 -6.9250 -6.6786 -6.6786 -6.6786 -6.6786 -5.3537 -5.3537 -5.3537 -5.3537 -4.6189 -4.6189 -4.6189 -4.6189 -4.4275 -4.4275 -4.4274 -4.4274 -4.3294 -4.3294 -4.3294 -4.3294 -3.7973 -3.7973 -3.7973 -3.7973 -2.3620 -2.3620 -2.3620 -2.3620 3.1580 3.1580 3.1580 3.1580 k = 0.1172 0.5711 0.2980 ( 7744 PWs) bands (ev): -20.4763 -20.4763 -20.4763 -20.4763 -19.8093 -19.8093 -19.8093 -19.8093 -8.1551 -8.1551 -8.1550 -8.1550 -7.8041 -7.8041 -7.8041 -7.8041 -7.0871 -7.0871 -7.0871 -7.0871 -6.8962 -6.8962 -6.8962 -6.8962 -6.6943 -6.6943 -6.6943 -6.6943 -5.3436 -5.3436 -5.3436 -5.3436 -4.5933 -4.5933 -4.5933 -4.5933 -4.3930 -4.3930 -4.3930 -4.3930 -4.3661 -4.3661 -4.3661 -4.3661 -3.7854 -3.7854 -3.7853 -3.7853 -2.3561 -2.3561 -2.3561 -2.3561 3.0778 3.0778 3.0779 3.0779 k = 0.1129 0.5500 0.2980 ( 7744 PWs) bands (ev): -20.4987 -20.4987 -20.4987 -20.4987 -19.8123 -19.8123 -19.8123 -19.8123 -8.1712 -8.1712 -8.1712 -8.1712 -7.8451 -7.8451 -7.8450 -7.8450 -7.0342 -7.0342 -7.0341 -7.0341 -6.8657 -6.8657 -6.8656 -6.8656 -6.7081 -6.7081 -6.7081 -6.7081 -5.3324 -5.3324 -5.3323 -5.3323 -4.5716 -4.5716 -4.5716 -4.5716 -4.4291 -4.4291 -4.4291 -4.4291 -4.3346 -4.3346 -4.3345 -4.3345 -3.7736 -3.7736 -3.7736 -3.7736 -2.3460 -2.3460 -2.3460 -2.3460 2.9997 2.9997 2.9997 2.9997 k = 0.1086 0.5288 0.2980 ( 7748 PWs) bands (ev): -20.5208 -20.5208 -20.5208 -20.5208 -19.8154 -19.8154 -19.8153 -19.8153 -8.1863 -8.1863 -8.1863 -8.1863 -7.8857 -7.8857 -7.8857 -7.8857 -6.9854 -6.9854 -6.9854 -6.9854 -6.8328 -6.8328 -6.8327 -6.8327 -6.7189 -6.7189 -6.7189 -6.7189 -5.3199 -5.3199 -5.3199 -5.3199 -4.5540 -4.5540 -4.5540 -4.5540 -4.4751 -4.4751 -4.4751 -4.4751 -4.2953 -4.2953 -4.2952 -4.2952 -3.7622 -3.7622 -3.7621 -3.7621 -2.3316 -2.3316 -2.3315 -2.3315 2.9235 2.9235 2.9236 2.9236 k = 0.1042 0.5077 0.2980 ( 7756 PWs) bands (ev): -20.5426 -20.5426 -20.5425 -20.5425 -19.8184 -19.8184 -19.8183 -19.8183 -8.2006 -8.2006 -8.2005 -8.2005 -7.9255 -7.9255 -7.9255 -7.9255 -6.9440 -6.9440 -6.9440 -6.9440 -6.7969 -6.7969 -6.7969 -6.7969 -6.7250 -6.7250 -6.7249 -6.7249 -5.3062 -5.3062 -5.3062 -5.3062 -4.5491 -4.5491 -4.5491 -4.5491 -4.5114 -4.5114 -4.5114 -4.5114 -4.2593 -4.2593 -4.2592 -4.2592 -3.7510 -3.7510 -3.7510 -3.7510 -2.3128 -2.3128 -2.3127 -2.3127 2.8495 2.8495 2.8495 2.8495 k = 0.0999 0.4865 0.2980 ( 7760 PWs) bands (ev): -20.5639 -20.5639 -20.5638 -20.5638 -19.8213 -19.8213 -19.8213 -19.8213 -8.2140 -8.2140 -8.2140 -8.2140 -7.9641 -7.9641 -7.9641 -7.9641 -6.9133 -6.9133 -6.9133 -6.9133 -6.7588 -6.7588 -6.7588 -6.7588 -6.7227 -6.7227 -6.7226 -6.7226 -5.2910 -5.2910 -5.2910 -5.2910 -4.5838 -4.5838 -4.5837 -4.5837 -4.5104 -4.5104 -4.5103 -4.5103 -4.2273 -4.2273 -4.2272 -4.2272 -3.7402 -3.7402 -3.7402 -3.7402 -2.2896 -2.2896 -2.2896 -2.2896 2.7775 2.7775 2.7776 2.7776 k = 0.0955 0.4654 0.2980 ( 7772 PWs) bands (ev): -20.5846 -20.5846 -20.5846 -20.5846 -19.8242 -19.8242 -19.8242 -19.8242 -8.2270 -8.2270 -8.2269 -8.2269 -8.0012 -8.0012 -8.0011 -8.0011 -6.8952 -6.8952 -6.8951 -6.8951 -6.7270 -6.7270 -6.7270 -6.7270 -6.7021 -6.7021 -6.7021 -6.7021 -5.2743 -5.2743 -5.2743 -5.2743 -4.6310 -4.6310 -4.6310 -4.6310 -4.4984 -4.4984 -4.4984 -4.4984 -4.1996 -4.1996 -4.1995 -4.1995 -3.7297 -3.7297 -3.7297 -3.7297 -2.2624 -2.2624 -2.2623 -2.2623 2.7078 2.7078 2.7078 2.7078 k = 0.0912 0.4442 0.2980 ( 7772 PWs) bands (ev): -20.6049 -20.6049 -20.6048 -20.6048 -19.8271 -19.8271 -19.8270 -19.8270 -8.2395 -8.2395 -8.2395 -8.2395 -8.0363 -8.0363 -8.0363 -8.0363 -6.8886 -6.8886 -6.8886 -6.8886 -6.7050 -6.7050 -6.7049 -6.7049 -6.6612 -6.6612 -6.6611 -6.6611 -5.2561 -5.2561 -5.2561 -5.2561 -4.6798 -4.6798 -4.6798 -4.6798 -4.4863 -4.4863 -4.4862 -4.4862 -4.1762 -4.1762 -4.1761 -4.1761 -3.7196 -3.7196 -3.7196 -3.7196 -2.2312 -2.2312 -2.2312 -2.2312 2.6402 2.6402 2.6402 2.6402 k = 0.0868 0.4231 0.2980 ( 7766 PWs) bands (ev): -20.6245 -20.6245 -20.6245 -20.6245 -19.8299 -19.8299 -19.8298 -19.8298 -8.2520 -8.2520 -8.2519 -8.2519 -8.0692 -8.0692 -8.0692 -8.0692 -6.8903 -6.8903 -6.8902 -6.8902 -6.6804 -6.6804 -6.6803 -6.6803 -6.6159 -6.6159 -6.6159 -6.6159 -5.2364 -5.2364 -5.2363 -5.2363 -4.7291 -4.7291 -4.7291 -4.7291 -4.4749 -4.4749 -4.4748 -4.4748 -4.1569 -4.1569 -4.1568 -4.1568 -3.7099 -3.7099 -3.7099 -3.7099 -2.1965 -2.1965 -2.1965 -2.1965 2.5750 2.5750 2.5750 2.5750 k = 0.0825 0.4019 0.2980 ( 7766 PWs) bands (ev): -20.6435 -20.6435 -20.6435 -20.6435 -19.8326 -19.8326 -19.8325 -19.8325 -8.2648 -8.2648 -8.2647 -8.2647 -8.0995 -8.0995 -8.0994 -8.0994 -6.8967 -6.8967 -6.8967 -6.8967 -6.6526 -6.6526 -6.6525 -6.6525 -6.5707 -6.5707 -6.5707 -6.5707 -5.2152 -5.2152 -5.2151 -5.2151 -4.7783 -4.7783 -4.7783 -4.7783 -4.4644 -4.4644 -4.4643 -4.4643 -4.1416 -4.1416 -4.1414 -4.1414 -3.7006 -3.7006 -3.7006 -3.7006 -2.1589 -2.1589 -2.1588 -2.1588 2.5120 2.5120 2.5120 2.5120 k = 0.0782 0.3808 0.2980 ( 7782 PWs) bands (ev): -20.6618 -20.6618 -20.6617 -20.6617 -19.8352 -19.8352 -19.8352 -19.8352 -8.2782 -8.2782 -8.2781 -8.2781 -8.1268 -8.1268 -8.1267 -8.1267 -6.9057 -6.9057 -6.9057 -6.9057 -6.6227 -6.6227 -6.6226 -6.6226 -6.5269 -6.5269 -6.5269 -6.5269 -5.1927 -5.1927 -5.1927 -5.1927 -4.8274 -4.8274 -4.8274 -4.8274 -4.4546 -4.4546 -4.4546 -4.4546 -4.1298 -4.1298 -4.1297 -4.1297 -3.6918 -3.6918 -3.6918 -3.6918 -2.1187 -2.1187 -2.1187 -2.1187 2.4515 2.4515 2.4515 2.4515 k = 0.0738 0.3596 0.2980 ( 7782 PWs) bands (ev): -20.6793 -20.6793 -20.6793 -20.6793 -19.8377 -19.8377 -19.8377 -19.8377 -8.2926 -8.2926 -8.2925 -8.2925 -8.1506 -8.1506 -8.1506 -8.1506 -6.9160 -6.9160 -6.9159 -6.9159 -6.5915 -6.5915 -6.5915 -6.5915 -6.4851 -6.4851 -6.4851 -6.4851 -5.1692 -5.1692 -5.1691 -5.1691 -4.8760 -4.8760 -4.8760 -4.8760 -4.4456 -4.4456 -4.4456 -4.4456 -4.1213 -4.1213 -4.1212 -4.1212 -3.6833 -3.6833 -3.6833 -3.6833 -2.0765 -2.0765 -2.0765 -2.0765 2.3935 2.3935 2.3935 2.3935 k = 0.0695 0.3385 0.2980 ( 7782 PWs) bands (ev): -20.6961 -20.6961 -20.6960 -20.6960 -19.8402 -19.8402 -19.8401 -19.8401 -8.3083 -8.3083 -8.3082 -8.3082 -8.1708 -8.1708 -8.1708 -8.1708 -6.9267 -6.9267 -6.9267 -6.9267 -6.5595 -6.5595 -6.5595 -6.5595 -6.4457 -6.4457 -6.4457 -6.4457 -5.1451 -5.1451 -5.1450 -5.1450 -4.9238 -4.9238 -4.9237 -4.9237 -4.4372 -4.4372 -4.4371 -4.4371 -4.1158 -4.1158 -4.1156 -4.1156 -3.6753 -3.6753 -3.6753 -3.6753 -2.0330 -2.0330 -2.0330 -2.0330 2.3380 2.3380 2.3380 2.3380 k = 0.0651 0.3173 0.2980 ( 7786 PWs) bands (ev): -20.7120 -20.7120 -20.7120 -20.7120 -19.8425 -19.8425 -19.8425 -19.8425 -8.3253 -8.3253 -8.3252 -8.3252 -8.1875 -8.1875 -8.1874 -8.1874 -6.9376 -6.9376 -6.9376 -6.9376 -6.5272 -6.5272 -6.5271 -6.5271 -6.4089 -6.4089 -6.4089 -6.4089 -5.1214 -5.1214 -5.1213 -5.1213 -4.9699 -4.9699 -4.9698 -4.9698 -4.4291 -4.4291 -4.4291 -4.4291 -4.1128 -4.1128 -4.1127 -4.1127 -3.6678 -3.6678 -3.6678 -3.6678 -1.9887 -1.9887 -1.9887 -1.9887 2.2851 2.2851 2.2851 2.2851 k = 0.0608 0.2961 0.2980 ( 7774 PWs) bands (ev): -20.7271 -20.7271 -20.7270 -20.7270 -19.8447 -19.8447 -19.8447 -19.8447 -8.3431 -8.3431 -8.3431 -8.3431 -8.2007 -8.2007 -8.2007 -8.2007 -6.9482 -6.9482 -6.9482 -6.9482 -6.4946 -6.4946 -6.4946 -6.4946 -6.3747 -6.3747 -6.3747 -6.3747 -5.1014 -5.1014 -5.1014 -5.1014 -5.0112 -5.0112 -5.0112 -5.0112 -4.4213 -4.4213 -4.4213 -4.4213 -4.1121 -4.1121 -4.1119 -4.1119 -3.6607 -3.6607 -3.6607 -3.6607 -1.9442 -1.9442 -1.9442 -1.9442 2.2350 2.2350 2.2350 2.2350 k = 0.0564 0.2750 0.2980 ( 7762 PWs) bands (ev): -20.7413 -20.7413 -20.7412 -20.7412 -19.8468 -19.8468 -19.8468 -19.8468 -8.3615 -8.3615 -8.3615 -8.3615 -8.2112 -8.2112 -8.2111 -8.2111 -6.9585 -6.9585 -6.9585 -6.9585 -6.4622 -6.4622 -6.4622 -6.4622 -6.3430 -6.3430 -6.3430 -6.3430 -5.1002 -5.1002 -5.1001 -5.1001 -5.0331 -5.0331 -5.0330 -5.0330 -4.4136 -4.4136 -4.4135 -4.4135 -4.1134 -4.1134 -4.1132 -4.1132 -3.6541 -3.6541 -3.6540 -3.6540 -1.9001 -1.9001 -1.9001 -1.9001 2.1877 2.1877 2.1877 2.1877 k = 0.0521 0.2538 0.2980 ( 7758 PWs) bands (ev): -20.7545 -20.7545 -20.7545 -20.7545 -19.8488 -19.8488 -19.8488 -19.8488 -8.3799 -8.3799 -8.3798 -8.3798 -8.2194 -8.2194 -8.2193 -8.2193 -6.9683 -6.9683 -6.9683 -6.9683 -6.4302 -6.4302 -6.4302 -6.4302 -6.3137 -6.3137 -6.3137 -6.3137 -5.1307 -5.1307 -5.1307 -5.1307 -5.0226 -5.0226 -5.0225 -5.0225 -4.4057 -4.4057 -4.4057 -4.4057 -4.1163 -4.1163 -4.1162 -4.1162 -3.6479 -3.6479 -3.6479 -3.6479 -1.8570 -1.8570 -1.8570 -1.8570 2.1433 2.1433 2.1433 2.1433 k = 0.0478 0.2327 0.2980 ( 7758 PWs) bands (ev): -20.7668 -20.7668 -20.7668 -20.7668 -19.8506 -19.8506 -19.8506 -19.8506 -8.3978 -8.3978 -8.3978 -8.3978 -8.2258 -8.2258 -8.2258 -8.2258 -6.9775 -6.9775 -6.9775 -6.9775 -6.3991 -6.3991 -6.3991 -6.3991 -6.2864 -6.2864 -6.2864 -6.2864 -5.1718 -5.1718 -5.1718 -5.1718 -5.0013 -5.0013 -5.0013 -5.0013 -4.3975 -4.3975 -4.3975 -4.3975 -4.1208 -4.1208 -4.1207 -4.1207 -3.6422 -3.6422 -3.6422 -3.6422 -1.8153 -1.8153 -1.8153 -1.8153 2.1019 2.1019 2.1020 2.1020 k = 0.0434 0.2115 0.2980 ( 7770 PWs) bands (ev): -20.7782 -20.7782 -20.7782 -20.7782 -19.8523 -19.8523 -19.8523 -19.8523 -8.4149 -8.4149 -8.4149 -8.4149 -8.2308 -8.2308 -8.2308 -8.2308 -6.9861 -6.9861 -6.9861 -6.9861 -6.3694 -6.3694 -6.3694 -6.3694 -6.2608 -6.2608 -6.2608 -6.2608 -5.2143 -5.2143 -5.2143 -5.2143 -4.9786 -4.9786 -4.9785 -4.9785 -4.3889 -4.3889 -4.3889 -4.3889 -4.1266 -4.1266 -4.1264 -4.1264 -3.6371 -3.6371 -3.6370 -3.6370 -1.7755 -1.7755 -1.7755 -1.7755 2.0637 2.0637 2.0637 2.0637 k = 0.0391 0.1904 0.2980 ( 7770 PWs) bands (ev): -20.7885 -20.7885 -20.7885 -20.7885 -19.8539 -19.8539 -19.8538 -19.8538 -8.4308 -8.4308 -8.4308 -8.4308 -8.2348 -8.2348 -8.2347 -8.2347 -6.9940 -6.9940 -6.9939 -6.9939 -6.3415 -6.3415 -6.3415 -6.3415 -6.2364 -6.2364 -6.2364 -6.2364 -5.2563 -5.2563 -5.2563 -5.2563 -4.9564 -4.9564 -4.9563 -4.9563 -4.3797 -4.3797 -4.3797 -4.3797 -4.1335 -4.1335 -4.1333 -4.1333 -3.6324 -3.6324 -3.6323 -3.6323 -1.7380 -1.7380 -1.7380 -1.7380 2.0287 2.0287 2.0287 2.0287 k = 0.0347 0.1692 0.2980 ( 7770 PWs) bands (ev): -20.7978 -20.7978 -20.7978 -20.7978 -19.8553 -19.8553 -19.8553 -19.8553 -8.4454 -8.4454 -8.4454 -8.4454 -8.2378 -8.2378 -8.2378 -8.2378 -7.0011 -7.0011 -7.0011 -7.0011 -6.3161 -6.3161 -6.3161 -6.3161 -6.2127 -6.2127 -6.2127 -6.2127 -5.2970 -5.2970 -5.2970 -5.2970 -4.9357 -4.9357 -4.9356 -4.9356 -4.3698 -4.3698 -4.3698 -4.3698 -4.1414 -4.1414 -4.1412 -4.1412 -3.6282 -3.6282 -3.6281 -3.6281 -1.7034 -1.7034 -1.7034 -1.7034 1.9970 1.9970 1.9970 1.9970 k = 0.0304 0.1481 0.2980 ( 7780 PWs) bands (ev): -20.8061 -20.8061 -20.8060 -20.8060 -19.8565 -19.8565 -19.8565 -19.8565 -8.4586 -8.4586 -8.4585 -8.4585 -8.2403 -8.2403 -8.2402 -8.2402 -7.0074 -7.0074 -7.0074 -7.0074 -6.2939 -6.2939 -6.2939 -6.2939 -6.1893 -6.1893 -6.1893 -6.1893 -5.3357 -5.3357 -5.3357 -5.3357 -4.9169 -4.9169 -4.9168 -4.9168 -4.3593 -4.3593 -4.3593 -4.3593 -4.1501 -4.1501 -4.1499 -4.1499 -3.6244 -3.6244 -3.6244 -3.6244 -1.6719 -1.6719 -1.6719 -1.6719 1.9688 1.9688 1.9688 1.9688 k = 0.0261 0.1269 0.2980 ( 7784 PWs) bands (ev): -20.8132 -20.8132 -20.8132 -20.8132 -19.8576 -19.8576 -19.8576 -19.8576 -8.4701 -8.4701 -8.4701 -8.4701 -8.2421 -8.2421 -8.2421 -8.2421 -7.0130 -7.0130 -7.0130 -7.0130 -6.2751 -6.2751 -6.2750 -6.2750 -6.1664 -6.1664 -6.1664 -6.1664 -5.3719 -5.3719 -5.3719 -5.3719 -4.9004 -4.9004 -4.9003 -4.9003 -4.3482 -4.3482 -4.3482 -4.3482 -4.1594 -4.1594 -4.1593 -4.1593 -3.6212 -3.6212 -3.6212 -3.6212 -1.6440 -1.6440 -1.6440 -1.6440 1.9441 1.9441 1.9441 1.9441 k = 0.0217 0.1058 0.2980 ( 7792 PWs) bands (ev): -20.8194 -20.8194 -20.8193 -20.8193 -19.8585 -19.8585 -19.8585 -19.8585 -8.4800 -8.4800 -8.4800 -8.4800 -8.2436 -8.2436 -8.2436 -8.2436 -7.0177 -7.0177 -7.0177 -7.0177 -6.2597 -6.2597 -6.2597 -6.2597 -6.1443 -6.1443 -6.1443 -6.1443 -5.4049 -5.4049 -5.4049 -5.4049 -4.8863 -4.8863 -4.8861 -4.8861 -4.3368 -4.3368 -4.3367 -4.3367 -4.1692 -4.1692 -4.1690 -4.1690 -3.6185 -3.6185 -3.6185 -3.6185 -1.6198 -1.6198 -1.6198 -1.6198 1.9230 1.9230 1.9230 1.9230 k = 0.0174 0.0846 0.2980 ( 7772 PWs) bands (ev): -20.8244 -20.8244 -20.8243 -20.8243 -19.8593 -19.8593 -19.8593 -19.8593 -8.4882 -8.4882 -8.4881 -8.4881 -8.2446 -8.2446 -8.2446 -8.2446 -7.0215 -7.0215 -7.0215 -7.0215 -6.2477 -6.2477 -6.2477 -6.2477 -6.1238 -6.1238 -6.1238 -6.1238 -5.4340 -5.4340 -5.4340 -5.4340 -4.8747 -4.8747 -4.8746 -4.8746 -4.3253 -4.3253 -4.3253 -4.3253 -4.1791 -4.1791 -4.1789 -4.1789 -3.6163 -3.6163 -3.6162 -3.6162 -1.5996 -1.5996 -1.5996 -1.5996 1.9056 1.9056 1.9057 1.9057 k = 0.0130 0.0635 0.2980 ( 7776 PWs) bands (ev): -20.8283 -20.8283 -20.8283 -20.8283 -19.8599 -19.8599 -19.8599 -19.8599 -8.4945 -8.4945 -8.4945 -8.4945 -8.2453 -8.2453 -8.2453 -8.2453 -7.0246 -7.0246 -7.0246 -7.0246 -6.2387 -6.2387 -6.2387 -6.2387 -6.1061 -6.1061 -6.1061 -6.1061 -5.4581 -5.4581 -5.4581 -5.4581 -4.8657 -4.8657 -4.8656 -4.8656 -4.3144 -4.3144 -4.3144 -4.3144 -4.1886 -4.1886 -4.1884 -4.1884 -3.6145 -3.6145 -3.6145 -3.6145 -1.5837 -1.5837 -1.5837 -1.5837 1.8921 1.8921 1.8921 1.8921 k = 0.0087 0.0423 0.2980 ( 7780 PWs) bands (ev): -20.8311 -20.8311 -20.8311 -20.8311 -19.8603 -19.8603 -19.8603 -19.8603 -8.4991 -8.4991 -8.4991 -8.4991 -8.2459 -8.2459 -8.2459 -8.2459 -7.0267 -7.0267 -7.0267 -7.0267 -6.2325 -6.2325 -6.2325 -6.2325 -6.0923 -6.0923 -6.0923 -6.0923 -5.4764 -5.4764 -5.4764 -5.4764 -4.8593 -4.8593 -4.8591 -4.8591 -4.3050 -4.3050 -4.3050 -4.3050 -4.1970 -4.1970 -4.1968 -4.1968 -3.6133 -3.6133 -3.6133 -3.6133 -1.5723 -1.5723 -1.5723 -1.5723 1.8823 1.8823 1.8823 1.8823 k = 0.0043 0.0212 0.2980 ( 7772 PWs) bands (ev): -20.8328 -20.8328 -20.8327 -20.8327 -19.8606 -19.8606 -19.8606 -19.8606 -8.5019 -8.5019 -8.5018 -8.5018 -8.2461 -8.2461 -8.2461 -8.2461 -7.0280 -7.0280 -7.0280 -7.0280 -6.2289 -6.2289 -6.2289 -6.2289 -6.0835 -6.0835 -6.0835 -6.0835 -5.4878 -5.4878 -5.4878 -5.4878 -4.8555 -4.8555 -4.8553 -4.8553 -4.2983 -4.2983 -4.2983 -4.2983 -4.2030 -4.2030 -4.2028 -4.2028 -3.6125 -3.6125 -3.6125 -3.6125 -1.5653 -1.5653 -1.5653 -1.5653 1.8765 1.8765 1.8765 1.8765 k = 0.0000 0.0000 0.2980 ( 7768 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5027 -8.5027 -8.2462 -8.2462 -8.2462 -8.2462 -7.0285 -7.0285 -7.0285 -7.0285 -6.2277 -6.2277 -6.2277 -6.2277 -6.0804 -6.0804 -6.0804 -6.0804 -5.4917 -5.4917 -5.4917 -5.4917 -4.8542 -4.8542 -4.8540 -4.8540 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6123 -3.6123 -3.6123 -3.6123 -1.5630 -1.5630 -1.5630 -1.5630 1.8745 1.8745 1.8745 1.8745 k = 0.0000 0.0000 0.2980 ( 7768 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5027 -8.5027 -8.2462 -8.2462 -8.2462 -8.2462 -7.0285 -7.0285 -7.0285 -7.0285 -6.2277 -6.2277 -6.2277 -6.2277 -6.0804 -6.0804 -6.0804 -6.0804 -5.4917 -5.4917 -5.4917 -5.4917 -4.8542 -4.8542 -4.8540 -4.8540 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6123 -3.6123 -3.6123 -3.6123 -1.5630 -1.5630 -1.5630 -1.5630 1.8745 1.8745 1.8745 1.8745 k = 0.0000 0.0000 0.2768 ( 7768 PWs) bands (ev): -20.8355 -20.8355 -20.8311 -20.8311 -19.8637 -19.8637 -19.8576 -19.8576 -8.5117 -8.5117 -8.4939 -8.4939 -8.2468 -8.2468 -8.2455 -8.2455 -7.0296 -7.0296 -7.0274 -7.0274 -6.2282 -6.2282 -6.2272 -6.2272 -6.0809 -6.0809 -6.0800 -6.0800 -5.4964 -5.4964 -5.4870 -5.4870 -4.8617 -4.8617 -4.8457 -4.8457 -4.3027 -4.3027 -4.2919 -4.2919 -4.2278 -4.2278 -4.1804 -4.1804 -3.6174 -3.6174 -3.6072 -3.6072 -1.5631 -1.5631 -1.5629 -1.5629 1.8383 1.8383 1.9121 1.9121 k = 0.0000 0.0000 0.2555 ( 7784 PWs) bands (ev): -20.8377 -20.8377 -20.8289 -20.8289 -19.8667 -19.8667 -19.8547 -19.8547 -8.5205 -8.5205 -8.4851 -8.4851 -8.2474 -8.2474 -8.2448 -8.2448 -7.0307 -7.0307 -7.0264 -7.0264 -6.2287 -6.2287 -6.2266 -6.2266 -6.0814 -6.0814 -6.0795 -6.0795 -5.5009 -5.5009 -5.4824 -5.4824 -4.8687 -4.8687 -4.8365 -4.8365 -4.3144 -4.3144 -4.2893 -4.2893 -4.2460 -4.2460 -4.1552 -4.1552 -3.6224 -3.6224 -3.6022 -3.6022 -1.5632 -1.5632 -1.5628 -1.5628 1.8037 1.8037 1.9508 1.9508 k = 0.0000 0.0000 0.2342 ( 7796 PWs) bands (ev): -20.8398 -20.8398 -20.8267 -20.8267 -19.8697 -19.8697 -19.8518 -19.8518 -8.5290 -8.5290 -8.4765 -8.4765 -8.2479 -8.2479 -8.2441 -8.2441 -7.0317 -7.0317 -7.0254 -7.0254 -6.2292 -6.2292 -6.2261 -6.2261 -6.0818 -6.0818 -6.0790 -6.0790 -5.5054 -5.5054 -5.4778 -5.4778 -4.8749 -4.8749 -4.8266 -4.8266 -4.3324 -4.3324 -4.2876 -4.2876 -4.2583 -4.2583 -4.1305 -4.1305 -3.6274 -3.6274 -3.5973 -3.5973 -1.5633 -1.5633 -1.5627 -1.5627 1.7710 1.7710 1.9901 1.9901 k = 0.0000 0.0000 0.2129 ( 7782 PWs) bands (ev): -20.8418 -20.8418 -20.8247 -20.8247 -19.8725 -19.8725 -19.8490 -19.8490 -8.5372 -8.5372 -8.4683 -8.4683 -8.2484 -8.2484 -8.2433 -8.2433 -7.0327 -7.0327 -7.0244 -7.0244 -6.2296 -6.2296 -6.2256 -6.2256 -6.0822 -6.0822 -6.0785 -6.0785 -5.5097 -5.5097 -5.4734 -5.4734 -4.8805 -4.8805 -4.8157 -4.8157 -4.3555 -4.3555 -4.2863 -4.2863 -4.2655 -4.2655 -4.1067 -4.1067 -3.6322 -3.6322 -3.5927 -3.5927 -1.5634 -1.5634 -1.5626 -1.5626 1.7405 1.7405 2.0298 2.0298 k = 0.0000 0.0000 0.1916 ( 7781 PWs) bands (ev): -20.8436 -20.8436 -20.8227 -20.8227 -19.8752 -19.8752 -19.8464 -19.8464 -8.5450 -8.5450 -8.4605 -8.4605 -8.2488 -8.2488 -8.2426 -8.2426 -7.0336 -7.0336 -7.0234 -7.0234 -6.2300 -6.2300 -6.2251 -6.2251 -6.0825 -6.0825 -6.0780 -6.0780 -5.5137 -5.5137 -5.4693 -5.4693 -4.8854 -4.8854 -4.8041 -4.8041 -4.3815 -4.3815 -4.2853 -4.2853 -4.2697 -4.2697 -4.0842 -4.0842 -3.6367 -3.6367 -3.5883 -3.5883 -1.5635 -1.5635 -1.5625 -1.5625 1.7123 1.7123 2.0692 2.0692 k = 0.0000 0.0000 0.1703 ( 7779 PWs) bands (ev): -20.8454 -20.8454 -20.8208 -20.8208 -19.8778 -19.8778 -19.8440 -19.8440 -8.5522 -8.5522 -8.4533 -8.4533 -8.2491 -8.2491 -8.2418 -8.2418 -7.0345 -7.0345 -7.0225 -7.0225 -6.2304 -6.2304 -6.2247 -6.2247 -6.0828 -6.0828 -6.0776 -6.0776 -5.5175 -5.5175 -5.4654 -5.4654 -4.8898 -4.8898 -4.7916 -4.7916 -4.4087 -4.4087 -4.2845 -4.2845 -4.2724 -4.2724 -4.0634 -4.0634 -3.6409 -3.6409 -3.5842 -3.5842 -1.5636 -1.5636 -1.5624 -1.5624 1.6866 1.6866 2.1078 2.1078 k = 0.0000 0.0000 0.1490 ( 7781 PWs) bands (ev): -20.8470 -20.8470 -20.8191 -20.8191 -19.8801 -19.8801 -19.8418 -19.8418 -8.5588 -8.5588 -8.4467 -8.4467 -8.2494 -8.2494 -8.2410 -8.2410 -7.0353 -7.0353 -7.0217 -7.0217 -6.2307 -6.2307 -6.2243 -6.2243 -6.0831 -6.0831 -6.0772 -6.0772 -5.5209 -5.5209 -5.4618 -5.4618 -4.8936 -4.8936 -4.7783 -4.7783 -4.4360 -4.4360 -4.2838 -4.2838 -4.2742 -4.2742 -4.0445 -4.0445 -3.6448 -3.6448 -3.5804 -3.5804 -1.5637 -1.5637 -1.5624 -1.5624 1.6635 1.6635 2.1450 2.1450 k = 0.0000 0.0000 0.1277 ( 7777 PWs) bands (ev): -20.8484 -20.8484 -20.8176 -20.8176 -19.8822 -19.8822 -19.8398 -19.8398 -8.5646 -8.5646 -8.4409 -8.4409 -8.2496 -8.2496 -8.2402 -8.2402 -7.0360 -7.0360 -7.0210 -7.0210 -6.2310 -6.2310 -6.2239 -6.2239 -6.0833 -6.0833 -6.0768 -6.0768 -5.5239 -5.5239 -5.4586 -5.4586 -4.8968 -4.8968 -4.7642 -4.7642 -4.4630 -4.4630 -4.2833 -4.2833 -4.2755 -4.2755 -4.0276 -4.0276 -3.6483 -3.6483 -3.5771 -3.5771 -1.5637 -1.5637 -1.5623 -1.5623 1.6432 1.6432 2.1799 2.1799 k = 0.0000 0.0000 0.1064 ( 7775 PWs) bands (ev): -20.8496 -20.8496 -20.8162 -20.8162 -19.8840 -19.8840 -19.8381 -19.8381 -8.5697 -8.5697 -8.4358 -8.4358 -8.2498 -8.2498 -8.2395 -8.2395 -7.0366 -7.0366 -7.0203 -7.0203 -6.2313 -6.2313 -6.2236 -6.2236 -6.0836 -6.0836 -6.0764 -6.0764 -5.5266 -5.5266 -5.4559 -5.4559 -4.8995 -4.8995 -4.7496 -4.7496 -4.4890 -4.4890 -4.2828 -4.2828 -4.2765 -4.2765 -4.0131 -4.0131 -3.6514 -3.6514 -3.5742 -3.5742 -1.5638 -1.5638 -1.5622 -1.5622 1.6259 1.6259 2.2118 2.2118 k = 0.0000 0.0000 0.0852 ( 7785 PWs) bands (ev): -20.8506 -20.8506 -20.8151 -20.8151 -19.8855 -19.8855 -19.8367 -19.8367 -8.5740 -8.5740 -8.4316 -8.4316 -8.2500 -8.2500 -8.2390 -8.2390 -7.0371 -7.0371 -7.0198 -7.0198 -6.2315 -6.2315 -6.2233 -6.2233 -6.0837 -6.0837 -6.0761 -6.0761 -5.5288 -5.5288 -5.4535 -5.4535 -4.9017 -4.9017 -4.7347 -4.7347 -4.5136 -4.5136 -4.2823 -4.2823 -4.2772 -4.2772 -4.0010 -4.0010 -3.6539 -3.6539 -3.5718 -3.5718 -1.5639 -1.5639 -1.5622 -1.5622 1.6115 1.6115 2.2398 2.2398 k = 0.0000 0.0000 0.0639 ( 7781 PWs) bands (ev): -20.8514 -20.8514 -20.8142 -20.8142 -19.8867 -19.8867 -19.8355 -19.8355 -8.5774 -8.5774 -8.4283 -8.4283 -8.2502 -8.2502 -8.2385 -8.2385 -7.0375 -7.0375 -7.0193 -7.0193 -6.2316 -6.2316 -6.2231 -6.2231 -6.0839 -6.0839 -6.0759 -6.0759 -5.5305 -5.5305 -5.4517 -5.4517 -4.9034 -4.9034 -4.7201 -4.7201 -4.5359 -4.5359 -4.2819 -4.2819 -4.2778 -4.2778 -3.9914 -3.9914 -3.6559 -3.6559 -3.5699 -3.5699 -1.5639 -1.5639 -1.5621 -1.5621 1.6003 1.6003 2.2628 2.2628 k = 0.0000 0.0000 0.0426 ( 7779 PWs) bands (ev): -20.8520 -20.8520 -20.8136 -20.8136 -19.8876 -19.8876 -19.8347 -19.8347 -8.5798 -8.5798 -8.4258 -8.4258 -8.2503 -8.2503 -8.2381 -8.2381 -7.0377 -7.0377 -7.0190 -7.0190 -6.2318 -6.2318 -6.2229 -6.2229 -6.0840 -6.0840 -6.0757 -6.0757 -5.5318 -5.5318 -5.4503 -5.4503 -4.9046 -4.9046 -4.7068 -4.7068 -4.5547 -4.5547 -4.2816 -4.2816 -4.2783 -4.2783 -3.9845 -3.9845 -3.6574 -3.6574 -3.5686 -3.5686 -1.5639 -1.5639 -1.5621 -1.5621 1.5922 1.5922 2.2800 2.2800 k = 0.0000 0.0000 0.0213 ( 7789 PWs) bands (ev): -20.8524 -20.8524 -20.8132 -20.8132 -19.8881 -19.8881 -19.8342 -19.8342 -8.5813 -8.5813 -8.4244 -8.4244 -8.2503 -8.2503 -8.2379 -8.2379 -7.0379 -7.0379 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0841 -6.0841 -6.0756 -6.0756 -5.5325 -5.5325 -5.4495 -5.4495 -4.9054 -4.9054 -4.6970 -4.6970 -4.5680 -4.5680 -4.2814 -4.2814 -4.2786 -4.2786 -3.9804 -3.9804 -3.6583 -3.6583 -3.5677 -3.5677 -1.5639 -1.5639 -1.5621 -1.5621 1.5873 1.5873 2.2907 2.2907 k = 0.0000 0.0000 0.0000 ( 7777 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5818 -8.5818 -8.4239 -8.4239 -8.2503 -8.2503 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0840 -6.0840 -6.0756 -6.0756 -5.5328 -5.5328 -5.4493 -5.4493 -4.9056 -4.9056 -4.6932 -4.6932 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6586 -3.6586 -3.5675 -3.5675 -1.5639 -1.5639 -1.5620 -1.5620 1.5857 1.5857 2.2943 2.2943 k = 0.0000 0.0000 0.0000 ( 7777 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5818 -8.5818 -8.4239 -8.4239 -8.2503 -8.2503 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0840 -6.0840 -6.0756 -6.0756 -5.5328 -5.5328 -5.4493 -5.4493 -4.9056 -4.9056 -4.6932 -4.6932 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6586 -3.6586 -3.5675 -3.5675 -1.5639 -1.5639 -1.5620 -1.5620 1.5857 1.5857 2.2943 2.2943 k =-0.0208 0.0043 0.0000 ( 7779 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2503 -8.2503 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0841 -6.0841 -6.0756 -6.0756 -5.5329 -5.5329 -5.4493 -5.4493 -4.9056 -4.9056 -4.6932 -4.6932 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6586 -3.6586 -3.5675 -3.5675 -1.5639 -1.5639 -1.5620 -1.5620 1.5873 1.5873 2.2956 2.2956 k =-0.0417 0.0086 0.0000 ( 7783 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5818 -8.5818 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2319 -6.2319 -6.2228 -6.2228 -6.0841 -6.0841 -6.0756 -6.0756 -5.5330 -5.5330 -5.4494 -5.4494 -4.9055 -4.9055 -4.6931 -4.6931 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6587 -3.6587 -3.5675 -3.5675 -1.5639 -1.5639 -1.5621 -1.5621 1.5922 1.5922 2.2994 2.2994 k =-0.0625 0.0128 0.0000 ( 7775 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2318 -6.2318 -6.2227 -6.2227 -6.0840 -6.0840 -6.0756 -6.0756 -5.5333 -5.5333 -5.4497 -5.4497 -4.9054 -4.9054 -4.6930 -4.6930 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6588 -3.6588 -3.5675 -3.5675 -1.5639 -1.5639 -1.5621 -1.5621 1.6004 1.6004 2.3057 2.3057 k =-0.0833 0.0171 0.0000 ( 7781 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0380 -7.0380 -7.0188 -7.0188 -6.2318 -6.2318 -6.2227 -6.2227 -6.0841 -6.0841 -6.0756 -6.0756 -5.5337 -5.5337 -5.4500 -5.4500 -4.9054 -4.9054 -4.6929 -4.6929 -4.5729 -4.5729 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6589 -3.6589 -3.5676 -3.5676 -1.5639 -1.5639 -1.5621 -1.5621 1.6118 1.6118 2.3145 2.3145 k =-0.1042 0.0214 0.0000 ( 7793 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0381 -7.0381 -7.0189 -7.0189 -6.2317 -6.2317 -6.2226 -6.2226 -6.0841 -6.0841 -6.0756 -6.0756 -5.5342 -5.5342 -5.4504 -5.4504 -4.9052 -4.9052 -4.6928 -4.6928 -4.5728 -4.5728 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6591 -3.6591 -3.5677 -3.5677 -1.5640 -1.5640 -1.5621 -1.5621 1.6265 1.6265 2.3258 2.3258 k =-0.1250 0.0257 0.0000 ( 7791 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2503 -8.2503 -8.2378 -8.2378 -7.0382 -7.0382 -7.0189 -7.0189 -6.2316 -6.2316 -6.2226 -6.2226 -6.0840 -6.0840 -6.0756 -6.0756 -5.5348 -5.5348 -5.4509 -5.4509 -4.9051 -4.9051 -4.6926 -4.6926 -4.5728 -4.5728 -4.2813 -4.2813 -4.2787 -4.2787 -3.9790 -3.9790 -3.6593 -3.6593 -3.5678 -3.5678 -1.5640 -1.5640 -1.5621 -1.5621 1.6443 1.6443 2.3397 2.3397 k =-0.1458 0.0299 0.0000 ( 7801 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0382 -7.0382 -7.0189 -7.0189 -6.2316 -6.2316 -6.2225 -6.2225 -6.0841 -6.0841 -6.0756 -6.0756 -5.5355 -5.5355 -5.4514 -5.4514 -4.9049 -4.9049 -4.6924 -4.6924 -4.5727 -4.5727 -4.2813 -4.2813 -4.2787 -4.2787 -3.9789 -3.9789 -3.6596 -3.6596 -3.5679 -3.5679 -1.5640 -1.5640 -1.5621 -1.5621 1.6653 1.6653 2.3559 2.3559 k =-0.1667 0.0342 0.0000 ( 7793 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0383 -7.0383 -7.0189 -7.0189 -6.2315 -6.2315 -6.2225 -6.2225 -6.0840 -6.0840 -6.0756 -6.0756 -5.5363 -5.5363 -5.4520 -5.4520 -4.9047 -4.9047 -4.6922 -4.6922 -4.5727 -4.5727 -4.2813 -4.2813 -4.2787 -4.2787 -3.9789 -3.9789 -3.6598 -3.6598 -3.5680 -3.5680 -1.5640 -1.5640 -1.5621 -1.5621 1.6894 1.6894 2.3746 2.3746 k =-0.1875 0.0385 0.0000 ( 7796 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0383 -7.0383 -7.0190 -7.0190 -6.2314 -6.2314 -6.2224 -6.2224 -6.0840 -6.0840 -6.0755 -6.0755 -5.5371 -5.5371 -5.4527 -5.4527 -4.9046 -4.9046 -4.6919 -4.6919 -4.5726 -4.5726 -4.2813 -4.2813 -4.2787 -4.2787 -3.9789 -3.9789 -3.6601 -3.6601 -3.5681 -3.5681 -1.5640 -1.5640 -1.5621 -1.5621 1.7166 1.7166 2.3956 2.3956 k =-0.2083 0.0428 0.0000 ( 7802 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0384 -7.0384 -7.0190 -7.0190 -6.2313 -6.2313 -6.2223 -6.2223 -6.0841 -6.0841 -6.0755 -6.0755 -5.5379 -5.5379 -5.4534 -5.4534 -4.9044 -4.9044 -4.6917 -4.6917 -4.5726 -4.5726 -4.2813 -4.2813 -4.2787 -4.2787 -3.9789 -3.9789 -3.6604 -3.6604 -3.5683 -3.5683 -1.5640 -1.5640 -1.5621 -1.5621 1.7469 1.7469 2.4190 2.4190 k =-0.2292 0.0470 0.0000 ( 7814 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0385 -7.0385 -7.0191 -7.0191 -6.2313 -6.2313 -6.2222 -6.2222 -6.0840 -6.0840 -6.0755 -6.0755 -5.5388 -5.5388 -5.4541 -5.4541 -4.9042 -4.9042 -4.6914 -4.6914 -4.5725 -4.5725 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6608 -3.6608 -3.5684 -3.5684 -1.5640 -1.5640 -1.5621 -1.5621 1.7801 1.7801 2.4447 2.4447 k =-0.2500 0.0513 0.0000 ( 7812 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0385 -7.0385 -7.0191 -7.0191 -6.2312 -6.2312 -6.2221 -6.2221 -6.0840 -6.0840 -6.0755 -6.0755 -5.5397 -5.5397 -5.4548 -5.4548 -4.9039 -4.9039 -4.6911 -4.6911 -4.5725 -4.5725 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6611 -3.6611 -3.5685 -3.5685 -1.5640 -1.5640 -1.5621 -1.5621 1.8162 1.8162 2.4727 2.4727 k =-0.2708 0.0556 0.0000 ( 7810 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0386 -7.0386 -7.0192 -7.0192 -6.2311 -6.2311 -6.2220 -6.2220 -6.0840 -6.0840 -6.0755 -6.0755 -5.5406 -5.5406 -5.4555 -5.4555 -4.9037 -4.9037 -4.6909 -4.6909 -4.5724 -4.5724 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6614 -3.6614 -3.5687 -3.5687 -1.5640 -1.5640 -1.5621 -1.5621 1.8552 1.8552 2.5028 2.5028 k =-0.2917 0.0599 0.0000 ( 7804 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0387 -7.0387 -7.0191 -7.0191 -6.2309 -6.2309 -6.2220 -6.2220 -6.0840 -6.0840 -6.0754 -6.0754 -5.5415 -5.5415 -5.4562 -5.4562 -4.9035 -4.9035 -4.6906 -4.6906 -4.5723 -4.5723 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6617 -3.6617 -3.5688 -3.5688 -1.5640 -1.5640 -1.5621 -1.5621 1.8969 1.8969 2.5351 2.5351 k =-0.3125 0.0641 0.0000 ( 7810 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0387 -7.0387 -7.0192 -7.0192 -6.2308 -6.2308 -6.2219 -6.2219 -6.0840 -6.0840 -6.0754 -6.0754 -5.5423 -5.5423 -5.4569 -5.4569 -4.9033 -4.9033 -4.6904 -4.6904 -4.5723 -4.5723 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6620 -3.6620 -3.5689 -3.5689 -1.5640 -1.5640 -1.5621 -1.5621 1.9413 1.9413 2.5694 2.5694 k =-0.3333 0.0684 0.0000 ( 7810 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0388 -7.0388 -7.0192 -7.0192 -6.2308 -6.2308 -6.2218 -6.2218 -6.0840 -6.0840 -6.0754 -6.0754 -5.5431 -5.5431 -5.4575 -5.4575 -4.9031 -4.9031 -4.6902 -4.6902 -4.5722 -4.5722 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6623 -3.6623 -3.5690 -3.5690 -1.5640 -1.5640 -1.5621 -1.5621 1.9882 1.9882 2.6056 2.6056 k =-0.3542 0.0727 0.0000 ( 7810 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0388 -7.0388 -7.0193 -7.0193 -6.2307 -6.2307 -6.2217 -6.2217 -6.0839 -6.0839 -6.0754 -6.0754 -5.5439 -5.5439 -5.4581 -5.4581 -4.9029 -4.9029 -4.6899 -4.6899 -4.5722 -4.5722 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6626 -3.6626 -3.5692 -3.5692 -1.5640 -1.5640 -1.5621 -1.5621 2.0376 2.0376 2.6438 2.6438 k =-0.3750 0.0770 0.0000 ( 7804 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0389 -7.0389 -7.0193 -7.0193 -6.2306 -6.2306 -6.2217 -6.2217 -6.0839 -6.0839 -6.0754 -6.0754 -5.5445 -5.5445 -5.4587 -5.4587 -4.9028 -4.9028 -4.6897 -4.6897 -4.5721 -4.5721 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6628 -3.6628 -3.5693 -3.5693 -1.5640 -1.5640 -1.5621 -1.5621 2.0891 2.0891 2.6836 2.6836 k =-0.3958 0.0813 0.0000 ( 7800 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5816 -8.5816 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0389 -7.0389 -7.0192 -7.0192 -6.2306 -6.2306 -6.2216 -6.2216 -6.0839 -6.0839 -6.0753 -6.0753 -5.5451 -5.5451 -5.4592 -5.4592 -4.9026 -4.9026 -4.6895 -4.6895 -4.5721 -4.5721 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6630 -3.6630 -3.5693 -3.5693 -1.5640 -1.5640 -1.5621 -1.5621 2.1425 2.1425 2.7250 2.7250 k =-0.4167 0.0855 0.0000 ( 7804 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2377 -8.2377 -7.0389 -7.0389 -7.0193 -7.0193 -6.2305 -6.2305 -6.2216 -6.2216 -6.0840 -6.0840 -6.0753 -6.0753 -5.5456 -5.5456 -5.4596 -5.4596 -4.9025 -4.9025 -4.6894 -4.6894 -4.5721 -4.5721 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6632 -3.6632 -3.5694 -3.5694 -1.5640 -1.5640 -1.5621 -1.5621 2.1974 2.1974 2.7638 2.7638 k =-0.4375 0.0898 0.0000 ( 7800 PWs) bands (ev): -20.8525 -20.8525 -20.8130 -20.8130 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2377 -8.2377 -7.0389 -7.0389 -7.0193 -7.0193 -6.2305 -6.2305 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5460 -5.5460 -5.4599 -5.4599 -4.9024 -4.9024 -4.6893 -4.6893 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6633 -3.6633 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.2529 2.2529 2.6954 2.6954 k =-0.4583 0.0941 0.0000 ( 7798 PWs) bands (ev): -20.8525 -20.8525 -20.8130 -20.8130 -19.8883 -19.8883 -19.8341 -19.8341 -8.5817 -8.5817 -8.4239 -8.4239 -8.2504 -8.2504 -8.2377 -8.2377 -7.0390 -7.0390 -7.0193 -7.0193 -6.2305 -6.2305 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5463 -5.5463 -5.4601 -5.4601 -4.9023 -4.9023 -4.6892 -4.6892 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6634 -3.6634 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.3068 2.3068 2.6321 2.6321 k =-0.4792 0.0984 0.0000 ( 7796 PWs) bands (ev): -20.8525 -20.8525 -20.8130 -20.8130 -19.8883 -19.8883 -19.8341 -19.8341 -8.5816 -8.5816 -8.4239 -8.4239 -8.2504 -8.2504 -8.2377 -8.2377 -7.0390 -7.0390 -7.0193 -7.0193 -6.2304 -6.2304 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5465 -5.5465 -5.4602 -5.4602 -4.9023 -4.9023 -4.6892 -4.6892 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6635 -3.6635 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.3530 2.3530 2.5803 2.5803 k =-0.5000 0.1026 0.0000 ( 7802 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5816 -8.5816 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0390 -7.0390 -7.0193 -7.0193 -6.2304 -6.2304 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5466 -5.5466 -5.4603 -5.4603 -4.9023 -4.9023 -4.6892 -4.6892 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6635 -3.6635 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.3741 2.3741 2.5573 2.5573 k =-0.5000 0.1026 0.0000 ( 7802 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5816 -8.5816 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0390 -7.0390 -7.0193 -7.0193 -6.2304 -6.2304 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5466 -5.5466 -5.4603 -5.4603 -4.9023 -4.9023 -4.6892 -4.6892 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6635 -3.6635 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.3741 2.3741 2.5573 2.5573 k =-0.4956 0.1238-0.0000 ( 7794 PWs) bands (ev): -20.8519 -20.8519 -20.8125 -20.8125 -19.8882 -19.8882 -19.8340 -19.8340 -8.5807 -8.5807 -8.4230 -8.4230 -8.2502 -8.2502 -8.2377 -8.2377 -7.0386 -7.0386 -7.0189 -7.0189 -6.2316 -6.2316 -6.2227 -6.2227 -6.0872 -6.0872 -6.0782 -6.0782 -5.5424 -5.5424 -5.4565 -5.4565 -4.9035 -4.9035 -4.6919 -4.6919 -4.5712 -4.5712 -4.2827 -4.2827 -4.2774 -4.2774 -3.9787 -3.9787 -3.6638 -3.6638 -3.5698 -3.5698 -1.5666 -1.5666 -1.5640 -1.5640 2.3765 2.3765 2.5584 2.5584 k =-0.4913 0.1451-0.0000 ( 7794 PWs) bands (ev): -20.8502 -20.8502 -20.8108 -20.8108 -19.8879 -19.8879 -19.8337 -19.8337 -8.5777 -8.5777 -8.4204 -8.4204 -8.2499 -8.2499 -8.2374 -8.2374 -7.0372 -7.0372 -7.0175 -7.0175 -6.2353 -6.2353 -6.2266 -6.2266 -6.0968 -6.0968 -6.0866 -6.0866 -5.5302 -5.5302 -5.4453 -5.4453 -4.9072 -4.9072 -4.7002 -4.7002 -4.5687 -4.5687 -4.2857 -4.2857 -4.2747 -4.2747 -3.9780 -3.9780 -3.6645 -3.6645 -3.5706 -3.5706 -1.5744 -1.5744 -1.5700 -1.5700 2.3837 2.3837 2.5616 2.5616 k =-0.4869 0.1663-0.0000 ( 7800 PWs) bands (ev): -20.8474 -20.8474 -20.8080 -20.8080 -19.8874 -19.8874 -19.8334 -19.8334 -8.5728 -8.5728 -8.4162 -8.4162 -8.2493 -8.2493 -8.2371 -8.2371 -7.0350 -7.0350 -7.0154 -7.0154 -6.2415 -6.2415 -6.2331 -6.2331 -6.1118 -6.1118 -6.0997 -6.0997 -5.5108 -5.5108 -5.4274 -5.4274 -4.9133 -4.9133 -4.7135 -4.7135 -4.5646 -4.5646 -4.2902 -4.2902 -4.2710 -4.2710 -3.9769 -3.9769 -3.6656 -3.6656 -3.5719 -3.5719 -1.5871 -1.5871 -1.5801 -1.5801 2.3956 2.3956 2.5669 2.5669 k =-0.4826 0.1875-0.0000 ( 7806 PWs) bands (ev): -20.8434 -20.8434 -20.8041 -20.8041 -19.8868 -19.8868 -19.8328 -19.8328 -8.5659 -8.5659 -8.4103 -8.4103 -8.2484 -8.2484 -8.2364 -8.2364 -7.0319 -7.0319 -7.0124 -7.0124 -6.2506 -6.2506 -6.2425 -6.2425 -6.1307 -6.1307 -6.1167 -6.1167 -5.4853 -5.4853 -5.4037 -5.4037 -4.9218 -4.9218 -4.7314 -4.7314 -4.5591 -4.5591 -4.2962 -4.2962 -4.2666 -4.2666 -3.9755 -3.9755 -3.6672 -3.6672 -3.5738 -3.5738 -1.6045 -1.6045 -1.5943 -1.5943 2.4123 2.4123 2.5744 2.5744 k =-0.4782 0.2087-0.0000 ( 7802 PWs) bands (ev): -20.8384 -20.8384 -20.7991 -20.7991 -19.8859 -19.8859 -19.8321 -19.8321 -8.5571 -8.5571 -8.4028 -8.4028 -8.2473 -8.2473 -8.2354 -8.2354 -7.0279 -7.0279 -7.0086 -7.0086 -6.2629 -6.2629 -6.2550 -6.2550 -6.1523 -6.1523 -6.1363 -6.1363 -5.4549 -5.4549 -5.3750 -5.3750 -4.9326 -4.9326 -4.7533 -4.7533 -4.5521 -4.5521 -4.3036 -4.3036 -4.2618 -4.2618 -3.9739 -3.9739 -3.6693 -3.6693 -3.5762 -3.5762 -1.6266 -1.6266 -1.6122 -1.6122 2.4335 2.4335 2.5840 2.5840 k =-0.4739 0.2299-0.0000 ( 7802 PWs) bands (ev): -20.8322 -20.8322 -20.7930 -20.7930 -19.8849 -19.8849 -19.8313 -19.8313 -8.5463 -8.5463 -8.3939 -8.3939 -8.2458 -8.2458 -8.2340 -8.2340 -7.0231 -7.0231 -7.0039 -7.0039 -6.2786 -6.2786 -6.2709 -6.2709 -6.1753 -6.1753 -6.1577 -6.1577 -5.4207 -5.4207 -5.3422 -5.3422 -4.9456 -4.9456 -4.7785 -4.7785 -4.5439 -4.5439 -4.3122 -4.3122 -4.2570 -4.2570 -3.9721 -3.9721 -3.6718 -3.6718 -3.5791 -3.5791 -1.6531 -1.6531 -1.6338 -1.6338 2.4592 2.4592 2.5957 2.5957 k =-0.4695 0.2511-0.0000 ( 7798 PWs) bands (ev): -20.8249 -20.8249 -20.7858 -20.7858 -19.8837 -19.8837 -19.8303 -19.8303 -8.5337 -8.5337 -8.3836 -8.3836 -8.2439 -8.2439 -8.2319 -8.2319 -7.0174 -7.0174 -6.9984 -6.9984 -6.2980 -6.2980 -6.2902 -6.2902 -6.1987 -6.1987 -6.1800 -6.1800 -5.3833 -5.3833 -5.3062 -5.3062 -4.9606 -4.9606 -4.8064 -4.8064 -4.5345 -4.5345 -4.3220 -4.3220 -4.2524 -4.2524 -3.9703 -3.9703 -3.6748 -3.6748 -3.5825 -3.5825 -1.6839 -1.6839 -1.6586 -1.6586 2.4892 2.4892 2.6095 2.6095 k =-0.4652 0.2723-0.0000 ( 7798 PWs) bands (ev): -20.8166 -20.8166 -20.7775 -20.7775 -19.8823 -19.8823 -19.8291 -19.8291 -8.5191 -8.5191 -8.3723 -8.3723 -8.2416 -8.2416 -8.2290 -8.2290 -7.0110 -7.0110 -6.9921 -6.9921 -6.3211 -6.3211 -6.3129 -6.3129 -6.2223 -6.2223 -6.2029 -6.2029 -5.3436 -5.3436 -5.2676 -5.2676 -4.9776 -4.9776 -4.8365 -4.8365 -4.5241 -4.5241 -4.3328 -4.3328 -4.2485 -4.2485 -3.9687 -3.9687 -3.6783 -3.6783 -3.5865 -3.5865 -1.7186 -1.7186 -1.6865 -1.6865 2.5234 2.5234 2.6254 2.6254 k =-0.4608 0.2935-0.0000 ( 7802 PWs) bands (ev): -20.8072 -20.8072 -20.7682 -20.7682 -19.8808 -19.8808 -19.8279 -19.8279 -8.5028 -8.5028 -8.3600 -8.3600 -8.2389 -8.2389 -8.2249 -8.2249 -7.0037 -7.0037 -6.9851 -6.9851 -6.3473 -6.3473 -6.3385 -6.3385 -6.2460 -6.2460 -6.2265 -6.2265 -5.3021 -5.3021 -5.2269 -5.2269 -4.9961 -4.9961 -4.8681 -4.8681 -4.5129 -4.5129 -4.3444 -4.3444 -4.2453 -4.2453 -3.9675 -3.9675 -3.6823 -3.6823 -3.5910 -3.5910 -1.7569 -1.7569 -1.7171 -1.7171 2.5617 2.5617 2.6435 2.6435 k =-0.4565 0.3147-0.0000 ( 7798 PWs) bands (ev): -20.7968 -20.7968 -20.7579 -20.7579 -19.8791 -19.8791 -19.8265 -19.8265 -8.4847 -8.4847 -8.3473 -8.3473 -8.2356 -8.2356 -8.2192 -8.2192 -6.9956 -6.9956 -6.9773 -6.9773 -6.3760 -6.3760 -6.3665 -6.3665 -6.2704 -6.2704 -6.2510 -6.2510 -5.2593 -5.2593 -5.1846 -5.1846 -5.0158 -5.0158 -4.9005 -4.9005 -4.5011 -4.5011 -4.3566 -4.3566 -4.2430 -4.2430 -3.9669 -3.9669 -3.6866 -3.6866 -3.5960 -3.5960 -1.7984 -1.7984 -1.7500 -1.7500 2.6038 2.6038 2.6636 2.6636 k =-0.4521 0.3360-0.0000 ( 7794 PWs) bands (ev): -20.7853 -20.7853 -20.7465 -20.7465 -19.8772 -19.8772 -19.8249 -19.8249 -8.4648 -8.4648 -8.3346 -8.3346 -8.2316 -8.2316 -8.2115 -8.2115 -6.9869 -6.9869 -6.9688 -6.9688 -6.4065 -6.4065 -6.3963 -6.3963 -6.2959 -6.2959 -6.2769 -6.2769 -5.2161 -5.2161 -5.1414 -5.1414 -5.0359 -5.0359 -4.9331 -4.9331 -4.4890 -4.4890 -4.3694 -4.3694 -4.2419 -4.2419 -3.9673 -3.9673 -3.6915 -3.6915 -3.6015 -3.6015 -1.8429 -1.8429 -1.7847 -1.7847 2.6496 2.6496 2.6858 2.6858 k =-0.4478 0.3572-0.0000 ( 7786 PWs) bands (ev): -20.7729 -20.7729 -20.7342 -20.7342 -19.8752 -19.8752 -19.8233 -19.8233 -8.4434 -8.4434 -8.3224 -8.3224 -8.2269 -8.2269 -8.2011 -8.2011 -6.9774 -6.9774 -6.9597 -6.9597 -6.4381 -6.4381 -6.4275 -6.4275 -6.3230 -6.3230 -6.3045 -6.3045 -5.1743 -5.1743 -5.0985 -5.0985 -5.0546 -5.0546 -4.9643 -4.9643 -4.4767 -4.4767 -4.3826 -4.3826 -4.2419 -4.2419 -3.9689 -3.9689 -3.6968 -3.6968 -3.6076 -3.6076 -1.8898 -1.8898 -1.8208 -1.8208 2.6986 2.6986 2.7105 2.7105 k =-0.4434 0.3784-0.0000 ( 7784 PWs) bands (ev): -20.7595 -20.7595 -20.7209 -20.7209 -19.8730 -19.8730 -19.8215 -19.8215 -8.4205 -8.4205 -8.3112 -8.3112 -8.2213 -8.2213 -8.1875 -8.1875 -6.9674 -6.9674 -6.9501 -6.9501 -6.4705 -6.4705 -6.4594 -6.4594 -6.3523 -6.3523 -6.3341 -6.3341 -5.1408 -5.1408 -5.0658 -5.0658 -5.0598 -5.0598 -4.9889 -4.9889 -4.4647 -4.4647 -4.3961 -4.3961 -4.2432 -4.2432 -3.9720 -3.9720 -3.7026 -3.7026 -3.6141 -3.6141 -1.9386 -1.9386 -1.8578 -1.8578 2.7357 2.7357 2.7524 2.7524 k =-0.4390 0.3996-0.0000 ( 7778 PWs) bands (ev): -20.7452 -20.7452 -20.7067 -20.7067 -19.8707 -19.8707 -19.8196 -19.8196 -8.3962 -8.3962 -8.3012 -8.3012 -8.2147 -8.2147 -8.1706 -8.1706 -6.9568 -6.9568 -6.9400 -6.9400 -6.5032 -6.5032 -6.4919 -6.4919 -6.3841 -6.3841 -6.3662 -6.3662 -5.1341 -5.1341 -5.0557 -5.0557 -5.0461 -5.0461 -4.9811 -4.9811 -4.4533 -4.4533 -4.4100 -4.4100 -4.2457 -4.2457 -3.9770 -3.9770 -3.7088 -3.7088 -3.6211 -3.6211 -1.9889 -1.9889 -1.8953 -1.8953 2.7642 2.7642 2.8080 2.8080 k =-0.4347 0.4208-0.0000 ( 7786 PWs) bands (ev): -20.7299 -20.7299 -20.6917 -20.6917 -19.8682 -19.8682 -19.8176 -19.8176 -8.3709 -8.3709 -8.2923 -8.2923 -8.2067 -8.2067 -8.1502 -8.1502 -6.9458 -6.9458 -6.9295 -6.9295 -6.5359 -6.5359 -6.5245 -6.5245 -6.4184 -6.4184 -6.4007 -6.4007 -5.1490 -5.1490 -5.0776 -5.0776 -5.0082 -5.0082 -4.9417 -4.9417 -4.4429 -4.4429 -4.4240 -4.4240 -4.2496 -4.2496 -3.9843 -3.9843 -3.7154 -3.7154 -3.6287 -3.6287 -2.0402 -2.0402 -1.9326 -1.9326 2.7945 2.7945 2.8668 2.8668 k =-0.4303 0.4420-0.0000 ( 7790 PWs) bands (ev): -20.7138 -20.7138 -20.6757 -20.6757 -19.8657 -19.8657 -19.8155 -19.8155 -8.3448 -8.3448 -8.2843 -8.2843 -8.1970 -8.1970 -8.1267 -8.1267 -6.9346 -6.9346 -6.9189 -6.9189 -6.5684 -6.5684 -6.5571 -6.5571 -6.4555 -6.4555 -6.4379 -6.4379 -5.1695 -5.1695 -5.1056 -5.1056 -4.9626 -4.9626 -4.8955 -4.8955 -4.4395 -4.4395 -4.4327 -4.4327 -4.2548 -4.2548 -3.9942 -3.9942 -3.7225 -3.7225 -3.6367 -3.6367 -2.0919 -2.0919 -1.9692 -1.9692 2.8268 2.8268 2.9284 2.9284 k =-0.4260 0.4632-0.0000 ( 7784 PWs) bands (ev): -20.6969 -20.6969 -20.6590 -20.6590 -19.8630 -19.8630 -19.8133 -19.8133 -8.3185 -8.3185 -8.2768 -8.2768 -8.1851 -8.1851 -8.1004 -8.1004 -6.9233 -6.9233 -6.9085 -6.9085 -6.6003 -6.6003 -6.5892 -6.5892 -6.4953 -6.4953 -6.4776 -6.4776 -5.1912 -5.1912 -5.1335 -5.1335 -4.9148 -4.9148 -4.8475 -4.8475 -4.4536 -4.4536 -4.4260 -4.4260 -4.2613 -4.2613 -4.0072 -4.0072 -3.7300 -3.7300 -3.6452 -3.6452 -2.1433 -2.1433 -2.0046 -2.0046 2.8610 2.8610 2.9927 2.9927 k =-0.4216 0.4844-0.0000 ( 7784 PWs) bands (ev): -20.6792 -20.6792 -20.6414 -20.6414 -19.8602 -19.8602 -19.8110 -19.8110 -8.2927 -8.2927 -8.2696 -8.2696 -8.1702 -8.1702 -8.0714 -8.0714 -6.9126 -6.9126 -6.8988 -6.8988 -6.6312 -6.6312 -6.6207 -6.6207 -6.5375 -6.5375 -6.5196 -6.5196 -5.2128 -5.2128 -5.1603 -5.1603 -4.8659 -4.8659 -4.7986 -4.7986 -4.4686 -4.4686 -4.4210 -4.4210 -4.2690 -4.2690 -4.0235 -4.0235 -3.7380 -3.7380 -3.6541 -3.6541 -2.1938 -2.1938 -2.0382 -2.0382 2.8971 2.8971 3.0594 3.0594 k =-0.4173 0.5056-0.0000 ( 7788 PWs) bands (ev): -20.6607 -20.6607 -20.6232 -20.6232 -19.8573 -19.8573 -19.8086 -19.8086 -8.2680 -8.2680 -8.2622 -8.2622 -8.1518 -8.1518 -8.0403 -8.0403 -6.9029 -6.9029 -6.8906 -6.8906 -6.6606 -6.6606 -6.6510 -6.6510 -6.5817 -6.5817 -6.5636 -6.5636 -5.2336 -5.2336 -5.1854 -5.1854 -4.8165 -4.8165 -4.7492 -4.7492 -4.4838 -4.4838 -4.4189 -4.4189 -4.2781 -4.2781 -4.0436 -4.0436 -3.7464 -3.7464 -3.6635 -3.6635 -2.2430 -2.2430 -2.0695 -2.0695 2.9352 2.9352 3.1285 3.1285 k =-0.4129 0.5268-0.0000 ( 7788 PWs) bands (ev): -20.6415 -20.6415 -20.6042 -20.6042 -19.8543 -19.8543 -19.8062 -19.8062 -8.2546 -8.2546 -8.2452 -8.2452 -8.1290 -8.1290 -8.0071 -8.0071 -6.8957 -6.8957 -6.8853 -6.8853 -6.6877 -6.6877 -6.6793 -6.6793 -6.6272 -6.6272 -6.6090 -6.6090 -5.2535 -5.2535 -5.2087 -5.2087 -4.7669 -4.7669 -4.6996 -4.6996 -4.4993 -4.4993 -4.4201 -4.4201 -4.2885 -4.2885 -4.0677 -4.0677 -3.7552 -3.7552 -3.6734 -3.6734 -2.2900 -2.2900 -2.0982 -2.0982 2.9751 2.9751 3.1998 3.1998 k =-0.4086 0.5481-0.0000 ( 7792 PWs) bands (ev): -20.6217 -20.6217 -20.5846 -20.5846 -19.8512 -19.8512 -19.8036 -19.8036 -8.2465 -8.2465 -8.2246 -8.2246 -8.1017 -8.1017 -7.9722 -7.9722 -6.8931 -6.8931 -6.8853 -6.8853 -6.7116 -6.7116 -6.7044 -6.7044 -6.6721 -6.6721 -6.6546 -6.6546 -5.2721 -5.2721 -5.2301 -5.2301 -4.7173 -4.7173 -4.6498 -4.6498 -4.5151 -4.5151 -4.4253 -4.4253 -4.3002 -4.3002 -4.0960 -4.0960 -3.7643 -3.7643 -3.6837 -3.6837 -2.3342 -2.3342 -2.1238 -2.1238 3.0168 3.0168 3.2732 3.2732 k =-0.4042 0.5693-0.0000 ( 7786 PWs) bands (ev): -20.6013 -20.6013 -20.5644 -20.5644 -19.8481 -19.8481 -19.8011 -19.8011 -8.2377 -8.2377 -8.2056 -8.2056 -8.0702 -8.0702 -7.9357 -7.9357 -6.8995 -6.8995 -6.8932 -6.8932 -6.7356 -6.7356 -6.7251 -6.7251 -6.7104 -6.7104 -6.6967 -6.6967 -5.2894 -5.2894 -5.2497 -5.2497 -4.6681 -4.6681 -4.6001 -4.6001 -4.5307 -4.5307 -4.4348 -4.4348 -4.3131 -4.3131 -4.1288 -4.1288 -3.7739 -3.7739 -3.6943 -3.6943 -2.3752 -2.3752 -2.1459 -2.1459 3.0604 3.0604 3.3484 3.3484 k =-0.3999 0.5905-0.0000 ( 7790 PWs) bands (ev): -20.5803 -20.5803 -20.5436 -20.5436 -19.8448 -19.8448 -19.7985 -19.7985 -8.2280 -8.2280 -8.1878 -8.1878 -8.0354 -8.0354 -7.8979 -7.8979 -6.9198 -6.9198 -6.9107 -6.9107 -6.7707 -6.7707 -6.7532 -6.7532 -6.7287 -6.7287 -6.7189 -6.7189 -5.3055 -5.3055 -5.2675 -5.2675 -4.6210 -4.6210 -4.5511 -4.5511 -4.5446 -4.5446 -4.4491 -4.4491 -4.3272 -4.3272 -4.1660 -4.1660 -3.7839 -3.7839 -3.7054 -3.7054 -2.4121 -2.4121 -2.1645 -2.1645 3.1057 3.1057 3.4249 3.4249 k =-0.3955 0.6117-0.0000 ( 7786 PWs) bands (ev): -20.5588 -20.5588 -20.5224 -20.5224 -19.8416 -19.8416 -19.7958 -19.7958 -8.2174 -8.2174 -8.1704 -8.1704 -7.9978 -7.9978 -7.8589 -7.8589 -6.9538 -6.9538 -6.9397 -6.9397 -6.8086 -6.8086 -6.7913 -6.7913 -6.7308 -6.7308 -6.7203 -6.7203 -5.3201 -5.3201 -5.2835 -5.2835 -4.5885 -4.5885 -4.5452 -4.5452 -4.5029 -4.5029 -4.4677 -4.4677 -4.3423 -4.3423 -4.2076 -4.2076 -3.7942 -3.7942 -3.7169 -3.7169 -2.4446 -2.4446 -2.1794 -2.1794 3.1528 3.1528 3.4693 3.4693 k =-0.3912 0.6329-0.0000 ( 7786 PWs) bands (ev): -20.5368 -20.5368 -20.5007 -20.5007 -19.8383 -19.8383 -19.7931 -19.7931 -8.2057 -8.2057 -8.1530 -8.1530 -7.9583 -7.9583 -7.8191 -7.8191 -6.9982 -6.9982 -6.9791 -6.9791 -6.8440 -6.8440 -6.8277 -6.8277 -6.7248 -6.7248 -6.7134 -6.7134 -5.3335 -5.3335 -5.2979 -5.2979 -4.5940 -4.5940 -4.5083 -4.5083 -4.4965 -4.4965 -4.4518 -4.4518 -4.3576 -4.3576 -4.2536 -4.2536 -3.8048 -3.8048 -3.7287 -3.7287 -2.4723 -2.4723 -2.1906 -2.1906 3.2016 3.2016 3.5152 3.5152 k =-0.3868 0.6541-0.0000 ( 7786 PWs) bands (ev): -20.5145 -20.5145 -20.4787 -20.4787 -19.8349 -19.8349 -19.7904 -19.7904 -8.1930 -8.1930 -8.1352 -8.1352 -7.9173 -7.9173 -7.7789 -7.7789 -7.0495 -7.0495 -7.0260 -7.0260 -6.8766 -6.8766 -6.8610 -6.8610 -6.7138 -6.7138 -6.7021 -6.7021 -5.3457 -5.3457 -5.3107 -5.3107 -4.6108 -4.6108 -4.5268 -4.5268 -4.4612 -4.4612 -4.4120 -4.4120 -4.3676 -4.3676 -4.3036 -4.3036 -3.8157 -3.8157 -3.7409 -3.7409 -2.4950 -2.4950 -2.1981 -2.1981 3.2520 3.2520 3.5626 3.5626 k =-0.3824 0.6753-0.0000 ( 7786 PWs) bands (ev): -20.4919 -20.4919 -20.4563 -20.4563 -19.8315 -19.8315 -19.7877 -19.7877 -8.1790 -8.1790 -8.1167 -8.1167 -7.8755 -7.8755 -7.7389 -7.7389 -7.1046 -7.1046 -7.0771 -7.0771 -6.9068 -6.9068 -6.8919 -6.8919 -6.6998 -6.6998 -6.6880 -6.6880 -5.3568 -5.3568 -5.3222 -5.3222 -4.6301 -4.6301 -4.5634 -4.5634 -4.4140 -4.4140 -4.4076 -4.4076 -4.3568 -4.3568 -4.3427 -4.3427 -3.8270 -3.8270 -3.7533 -3.7533 -2.5125 -2.5125 -2.2021 -2.2021 3.3040 3.3040 3.6116 3.6116 k =-0.3781 0.6965-0.0000 ( 7782 PWs) bands (ev): -20.4689 -20.4689 -20.4337 -20.4337 -19.8281 -19.8281 -19.7850 -19.7850 -8.1638 -8.1638 -8.0974 -8.0974 -7.8335 -7.8335 -7.7000 -7.7000 -7.1613 -7.1613 -7.1297 -7.1297 -6.9353 -6.9353 -6.9208 -6.9208 -6.6838 -6.6838 -6.6722 -6.6722 -5.3669 -5.3669 -5.3325 -5.3325 -4.6512 -4.6512 -4.6055 -4.6055 -4.4294 -4.4294 -4.4129 -4.4129 -4.3628 -4.3628 -4.2981 -4.2981 -3.8385 -3.8385 -3.7660 -3.7660 -2.5247 -2.5247 -2.2028 -2.2028 3.3576 3.3576 3.6619 3.6619 k =-0.3737 0.7177-0.0000 ( 7784 PWs) bands (ev): -20.4458 -20.4458 -20.4108 -20.4108 -19.8248 -19.8248 -19.7823 -19.7823 -8.1473 -8.1473 -8.0770 -8.0770 -7.7925 -7.7925 -7.6639 -7.6639 -7.2172 -7.2172 -7.1811 -7.1811 -6.9625 -6.9625 -6.9481 -6.9481 -6.6665 -6.6665 -6.6552 -6.6552 -5.3761 -5.3761 -5.3416 -5.3416 -4.6758 -4.6758 -4.6509 -4.6509 -4.4795 -4.4795 -4.4446 -4.4446 -4.3151 -4.3151 -4.2513 -4.2513 -3.8503 -3.8503 -3.7790 -3.7790 -2.5319 -2.5319 -2.2005 -2.2005 3.4127 3.4127 3.7137 3.7137 k =-0.3694 0.7389-0.0000 ( 7794 PWs) bands (ev): -20.4225 -20.4225 -20.3879 -20.3879 -19.8214 -19.8214 -19.7795 -19.7795 -8.1294 -8.1294 -8.0557 -8.0557 -7.7543 -7.7543 -7.6335 -7.6335 -7.2697 -7.2697 -7.2277 -7.2277 -6.9884 -6.9884 -6.9740 -6.9740 -6.6483 -6.6483 -6.6374 -6.6374 -5.3847 -5.3847 -5.3498 -5.3498 -4.7156 -4.7156 -4.6879 -4.6879 -4.5421 -4.5421 -4.4687 -4.4687 -4.2674 -4.2674 -4.2044 -4.2044 -3.8622 -3.8622 -3.7922 -3.7922 -2.5343 -2.5343 -2.1953 -2.1953 3.4692 3.4692 3.7667 3.7667 k =-0.3650 0.7602-0.0000 ( 7794 PWs) bands (ev): -20.3992 -20.3992 -20.3649 -20.3649 -19.8180 -19.8180 -19.7768 -19.7768 -8.1101 -8.1101 -8.0331 -8.0331 -7.7215 -7.7215 -7.6139 -7.6139 -7.3152 -7.3152 -7.2645 -7.2645 -7.0131 -7.0131 -6.9985 -6.9985 -6.6294 -6.6294 -6.6190 -6.6190 -5.3926 -5.3926 -5.3571 -5.3571 -4.7716 -4.7716 -4.7153 -4.7153 -4.6071 -4.6071 -4.4937 -4.4937 -4.2202 -4.2202 -4.1581 -4.1581 -3.8743 -3.8743 -3.8056 -3.8056 -2.5322 -2.5322 -2.1877 -2.1877 3.5271 3.5271 3.8210 3.8210 k =-0.3607 0.7814-0.0000 ( 7790 PWs) bands (ev): -20.3759 -20.3759 -20.3419 -20.3419 -19.8147 -19.8147 -19.7742 -19.7742 -8.0894 -8.0894 -8.0095 -8.0095 -7.6990 -7.6990 -7.6114 -7.6114 -7.3484 -7.3484 -7.2846 -7.2846 -7.0367 -7.0367 -7.0214 -7.0214 -6.6101 -6.6101 -6.6002 -6.6002 -5.4001 -5.4001 -5.3638 -5.3638 -4.8340 -4.8340 -4.7448 -4.7448 -4.6715 -4.6715 -4.5199 -4.5199 -4.1736 -4.1736 -4.1124 -4.1124 -3.8866 -3.8866 -3.8192 -3.8192 -2.5261 -2.5261 -2.1779 -2.1779 3.5863 3.5863 3.8765 3.8765 k =-0.3563 0.8026-0.0000 ( 7790 PWs) bands (ev): -20.3526 -20.3526 -20.3190 -20.3190 -19.8113 -19.8113 -19.7715 -19.7715 -8.0673 -8.0673 -7.9849 -7.9849 -7.6930 -7.6930 -7.6297 -7.6297 -7.3636 -7.3636 -7.2840 -7.2840 -7.0589 -7.0589 -7.0425 -7.0425 -6.5905 -6.5905 -6.5811 -6.5811 -5.4072 -5.4072 -5.3698 -5.3698 -4.9007 -4.9007 -4.7855 -4.7855 -4.7274 -4.7274 -4.5472 -4.5472 -4.1278 -4.1278 -4.0676 -4.0676 -3.8989 -3.8989 -3.8328 -3.8328 -2.5163 -2.5163 -2.1662 -2.1662 3.6467 3.6467 3.9330 3.9330 k =-0.3520 0.8238-0.0000 ( 7788 PWs) bands (ev): -20.3295 -20.3295 -20.2962 -20.2962 -19.8081 -19.8081 -19.7690 -19.7690 -8.0439 -8.0439 -7.9594 -7.9594 -7.7069 -7.7069 -7.6648 -7.6648 -7.3582 -7.3582 -7.2658 -7.2658 -7.0796 -7.0796 -7.0609 -7.0609 -6.5707 -6.5707 -6.5618 -6.5618 -5.4142 -5.4142 -5.3754 -5.3754 -4.9709 -4.9709 -4.8456 -4.8456 -4.7663 -4.7663 -4.5757 -4.5757 -4.0829 -4.0829 -4.0239 -4.0239 -3.9110 -3.9110 -3.8465 -3.8465 -2.5033 -2.5033 -2.1530 -2.1530 3.7083 3.7083 3.9906 3.9906 k =-0.3476 0.8450-0.0000 ( 7772 PWs) bands (ev): -20.3066 -20.3066 -20.2737 -20.2737 -19.8049 -19.8049 -19.7664 -19.7664 -8.0193 -8.0193 -7.9339 -7.9339 -7.7372 -7.7372 -7.7096 -7.7096 -7.3354 -7.3354 -7.2384 -7.2384 -7.0983 -7.0983 -7.0746 -7.0746 -6.5508 -6.5508 -6.5424 -6.5424 -5.4213 -5.4213 -5.3807 -5.3807 -5.0439 -5.0439 -4.9168 -4.9168 -4.7962 -4.7962 -4.6052 -4.6052 -4.0391 -4.0391 -3.9821 -3.9821 -3.9223 -3.9223 -3.8602 -3.8602 -2.4876 -2.4876 -2.1385 -2.1385 3.7709 3.7709 4.0490 4.0490 k =-0.3433 0.8662-0.0000 ( 7766 PWs) bands (ev): -20.2840 -20.2840 -20.2514 -20.2514 -19.8017 -19.8017 -19.7639 -19.7639 -7.9938 -7.9938 -7.9107 -7.9107 -7.7759 -7.7759 -7.7581 -7.7581 -7.3024 -7.3024 -7.2113 -7.2113 -7.1140 -7.1140 -7.0791 -7.0791 -6.5310 -6.5310 -6.5231 -6.5231 -5.4286 -5.4286 -5.3859 -5.3859 -5.1193 -5.1193 -4.9924 -4.9924 -4.8237 -4.8237 -4.6357 -4.6357 -3.9964 -3.9964 -3.9500 -3.9500 -3.9250 -3.9250 -3.8736 -3.8736 -2.4696 -2.4696 -2.1230 -2.1230 3.8344 3.8344 4.1083 4.1083 k =-0.3389 0.8874-0.0000 ( 7770 PWs) bands (ev): -20.2618 -20.2618 -20.2295 -20.2295 -19.7986 -19.7986 -19.7615 -19.7615 -7.9688 -7.9688 -7.8993 -7.8993 -7.8136 -7.8136 -7.8007 -7.8007 -7.2665 -7.2665 -7.1955 -7.1955 -7.1237 -7.1237 -7.0667 -7.0667 -6.5113 -6.5113 -6.5039 -6.5039 -5.4363 -5.4363 -5.3910 -5.3910 -5.1964 -5.1964 -5.0702 -5.0702 -4.8505 -4.8505 -4.6671 -4.6671 -3.9555 -3.9555 -3.9531 -3.9531 -3.8936 -3.8936 -3.8865 -3.8865 -2.4498 -2.4498 -2.1068 -2.1068 3.8988 3.8988 4.1682 4.1682 k =-0.3346 0.9086-0.0000 ( 7784 PWs) bands (ev): -20.2400 -20.2400 -20.2081 -20.2081 -19.7957 -19.7957 -19.7592 -19.7592 -7.9498 -7.9498 -7.9191 -7.9191 -7.8538 -7.8538 -7.8039 -7.8039 -7.2379 -7.2379 -7.1949 -7.1949 -7.1205 -7.1205 -7.0351 -7.0351 -6.4919 -6.4919 -6.4850 -6.4850 -5.4446 -5.4446 -5.3963 -5.3963 -5.2750 -5.2750 -5.1494 -5.1494 -4.8771 -4.8771 -4.6992 -4.6992 -3.9644 -3.9644 -3.9200 -3.9200 -3.8950 -3.8950 -3.8553 -3.8553 -2.4285 -2.4285 -2.0901 -2.0901 3.9639 3.9639 4.2286 4.2286 k =-0.3302 0.9298-0.0000 ( 7780 PWs) bands (ev): -20.2187 -20.2187 -20.1872 -20.1872 -19.7928 -19.7928 -19.7569 -19.7569 -7.9669 -7.9669 -7.9520 -7.9520 -7.8688 -7.8688 -7.7807 -7.7807 -7.2267 -7.2267 -7.2033 -7.2033 -7.0957 -7.0957 -6.9913 -6.9913 -6.4727 -6.4727 -6.4663 -6.4663 -5.4539 -5.4539 -5.4019 -5.4019 -5.3544 -5.3544 -5.2295 -5.2295 -4.9034 -4.9034 -4.7320 -4.7320 -3.9763 -3.9763 -3.9185 -3.9185 -3.8708 -3.8708 -3.8174 -3.8174 -2.4062 -2.4062 -2.0731 -2.0731 4.0296 4.0296 4.2895 4.2895 k =-0.3258 0.9510-0.0000 ( 7772 PWs) bands (ev): -20.1980 -20.1980 -20.1669 -20.1669 -19.7900 -19.7900 -19.7547 -19.7547 -8.0150 -8.0150 -7.9922 -7.9922 -7.8493 -7.8493 -7.7492 -7.7492 -7.2301 -7.2301 -7.2153 -7.2153 -7.0532 -7.0532 -6.9413 -6.9413 -6.4539 -6.4539 -6.4480 -6.4480 -5.4646 -5.4646 -5.4345 -5.4345 -5.4077 -5.4077 -5.3101 -5.3101 -4.9293 -4.9293 -4.7653 -4.7653 -3.9883 -3.9883 -3.9303 -3.9303 -3.8344 -3.8344 -3.7808 -3.7808 -2.3830 -2.3830 -2.0561 -2.0561 4.0957 4.0957 4.3506 4.3506 k =-0.3215 0.9723-0.0000 ( 7780 PWs) bands (ev): -20.1780 -20.1780 -20.1472 -20.1472 -19.7873 -19.7873 -19.7526 -19.7526 -8.0653 -8.0653 -8.0397 -8.0397 -7.8186 -7.8186 -7.7141 -7.7141 -7.2396 -7.2396 -7.2285 -7.2285 -7.0021 -7.0021 -6.8880 -6.8880 -6.4356 -6.4356 -6.4301 -6.4301 -5.5157 -5.5157 -5.4759 -5.4759 -5.4145 -5.4145 -5.3907 -5.3907 -4.9548 -4.9548 -4.7988 -4.7988 -4.0002 -4.0002 -3.9429 -3.9429 -3.7984 -3.7984 -3.7456 -3.7456 -2.3595 -2.3595 -2.0391 -2.0391 4.1621 4.1621 4.4118 4.4118 k =-0.3171 0.9935-0.0000 ( 7770 PWs) bands (ev): -20.1587 -20.1587 -20.1283 -20.1283 -19.7847 -19.7847 -19.7506 -19.7506 -8.1150 -8.1150 -8.0879 -8.0879 -7.7839 -7.7839 -7.6768 -7.6768 -7.2510 -7.2510 -7.2419 -7.2419 -6.9468 -6.9468 -6.8329 -6.8329 -6.4178 -6.4178 -6.4128 -6.4128 -5.5958 -5.5958 -5.4925 -5.4925 -5.4687 -5.4687 -5.4221 -5.4221 -4.9795 -4.9795 -4.8324 -4.8324 -4.0118 -4.0118 -3.9554 -3.9554 -3.7638 -3.7638 -3.7119 -3.7119 -2.3359 -2.3359 -2.0225 -2.0225 4.2285 4.2285 4.4728 4.4728 k =-0.3128 1.0147-0.0000 ( 7764 PWs) bands (ev): -20.1402 -20.1402 -20.1102 -20.1102 -19.7822 -19.7822 -19.7487 -19.7487 -8.1630 -8.1630 -8.1349 -8.1349 -7.7467 -7.7467 -7.6377 -7.6377 -7.2628 -7.2628 -7.2549 -7.2549 -6.8894 -6.8894 -6.7765 -6.7765 -6.4006 -6.4006 -6.3961 -6.3961 -5.6758 -5.6758 -5.5550 -5.5550 -5.5024 -5.5024 -5.4309 -5.4309 -5.0033 -5.0033 -4.8657 -4.8657 -4.0231 -4.0231 -3.9676 -3.9676 -3.7308 -3.7308 -3.6799 -3.6799 -2.3125 -2.3125 -2.0063 -2.0063 4.2948 4.2948 4.5335 4.5335 k =-0.3084 1.0359-0.0000 ( 7778 PWs) bands (ev): -20.1226 -20.1226 -20.0929 -20.0929 -19.7799 -19.7799 -19.7469 -19.7469 -8.2090 -8.2090 -8.1801 -8.1801 -7.7078 -7.7078 -7.5973 -7.5973 -7.2743 -7.2743 -7.2674 -7.2674 -6.8306 -6.8306 -6.7194 -6.7194 -6.3842 -6.3842 -6.3801 -6.3801 -5.7551 -5.7551 -5.6343 -5.6343 -5.5210 -5.5210 -5.4412 -5.4412 -5.0258 -5.0258 -4.8985 -4.8985 -4.0340 -4.0340 -3.9794 -3.9794 -3.6996 -3.6996 -3.6496 -3.6496 -2.2895 -2.2895 -1.9907 -1.9907 4.3607 4.3607 4.5936 4.5936 k =-0.3041 1.0571-0.0000 ( 7764 PWs) bands (ev): -20.1060 -20.1060 -20.0766 -20.0766 -19.7777 -19.7777 -19.7452 -19.7452 -8.2526 -8.2526 -8.2230 -8.2230 -7.6673 -7.6673 -7.5557 -7.5557 -7.2851 -7.2851 -7.2790 -7.2790 -6.7709 -6.7709 -6.6619 -6.6619 -6.3685 -6.3685 -6.3648 -6.3648 -5.8334 -5.8334 -5.7134 -5.7134 -5.5415 -5.5415 -5.4532 -5.4532 -5.0467 -5.0467 -4.9304 -4.9304 -4.0445 -4.0445 -3.9906 -3.9906 -3.6701 -3.6701 -3.6212 -3.6212 -2.2671 -2.2671 -1.9758 -1.9758 4.4260 4.4260 4.6529 4.6529 k =-0.2997 1.0783-0.0000 ( 7772 PWs) bands (ev): -20.0903 -20.0903 -20.0613 -20.0613 -19.7757 -19.7757 -19.7437 -19.7437 -8.2935 -8.2935 -8.2634 -8.2634 -7.6257 -7.6257 -7.5135 -7.5135 -7.2948 -7.2948 -7.2898 -7.2898 -6.7109 -6.7109 -6.6043 -6.6043 -6.3538 -6.3538 -6.3504 -6.3504 -5.9104 -5.9104 -5.7915 -5.7915 -5.5647 -5.5647 -5.4674 -5.4674 -5.0659 -5.0659 -4.9609 -4.9609 -4.0544 -4.0544 -4.0014 -4.0014 -3.6425 -3.6425 -3.5946 -3.5946 -2.2456 -2.2456 -1.9618 -1.9618 4.4904 4.4904 4.7111 4.7111 k =-0.2954 1.0995-0.0000 ( 7752 PWs) bands (ev): -20.0757 -20.0757 -20.0470 -20.0470 -19.7738 -19.7738 -19.7422 -19.7422 -8.3316 -8.3316 -8.3009 -8.3009 -7.5831 -7.5831 -7.4711 -7.4711 -7.3030 -7.3030 -7.2993 -7.2993 -6.6505 -6.6505 -6.5470 -6.5470 -6.3400 -6.3400 -6.3370 -6.3370 -5.9857 -5.9857 -5.8683 -5.8683 -5.5908 -5.5908 -5.4839 -5.4839 -5.0831 -5.0831 -4.9897 -4.9897 -4.0637 -4.0637 -4.0115 -4.0115 -3.6169 -3.6169 -3.5700 -3.5700 -2.2252 -2.2252 -1.9486 -1.9486 4.5536 4.5536 4.7680 4.7680 k =-0.2910 1.1207-0.0000 ( 7756 PWs) bands (ev): -20.0623 -20.0623 -20.0339 -20.0339 -19.7720 -19.7720 -19.7409 -19.7409 -8.3666 -8.3666 -8.3355 -8.3355 -7.5399 -7.5399 -7.4298 -7.4298 -7.3093 -7.3093 -7.3070 -7.3070 -6.5903 -6.5903 -6.4902 -6.4902 -6.3272 -6.3272 -6.3246 -6.3246 -6.0587 -6.0587 -5.9434 -5.9434 -5.6200 -5.6200 -5.5031 -5.5031 -5.0983 -5.0983 -5.0164 -5.0164 -4.0724 -4.0724 -4.0209 -4.0209 -3.5934 -3.5934 -3.5475 -3.5475 -2.2060 -2.2060 -1.9365 -1.9365 4.6153 4.6153 4.8231 4.8231 k =-0.2867 1.1419-0.0000 ( 7756 PWs) bands (ev): -20.0501 -20.0501 -20.0219 -20.0219 -19.7705 -19.7705 -19.7397 -19.7397 -8.3985 -8.3985 -8.3670 -8.3670 -7.4968 -7.4968 -7.3930 -7.3930 -7.3153 -7.3153 -7.3079 -7.3079 -6.5303 -6.5303 -6.4343 -6.4343 -6.3157 -6.3157 -6.3133 -6.3133 -6.1287 -6.1287 -6.0162 -6.0162 -5.6522 -5.6522 -5.5250 -5.5250 -5.1114 -5.1114 -5.0407 -5.0407 -4.0805 -4.0805 -4.0296 -4.0296 -3.5721 -3.5721 -3.5270 -3.5270 -2.1883 -2.1883 -1.9255 -1.9255 4.6752 4.6752 4.8762 4.8762 k =-0.2823 1.1632-0.0000 ( 7748 PWs) bands (ev): -20.0391 -20.0391 -20.0111 -20.0111 -19.7690 -19.7690 -19.7386 -19.7386 -8.4271 -8.4271 -8.3952 -8.3952 -7.4548 -7.4548 -7.3683 -7.3683 -7.3199 -7.3199 -7.2952 -7.2952 -6.4708 -6.4708 -6.3802 -6.3802 -6.3057 -6.3057 -6.3036 -6.3036 -6.1943 -6.1943 -6.0863 -6.0863 -5.6872 -5.6872 -5.5496 -5.5496 -5.1225 -5.1225 -5.0623 -5.0623 -4.0877 -4.0877 -4.0374 -4.0374 -3.5529 -3.5529 -3.5087 -3.5087 -2.1722 -2.1722 -1.9155 -1.9155 4.7328 4.7328 4.9269 4.9269 k =-0.2780 1.1844-0.0000 ( 7760 PWs) bands (ev): -20.0293 -20.0293 -20.0016 -20.0016 -19.7678 -19.7678 -19.7377 -19.7377 -8.4523 -8.4523 -8.4201 -8.4201 -7.4162 -7.4162 -7.3599 -7.3599 -7.3207 -7.3207 -7.2662 -7.2662 -6.4122 -6.4122 -6.3300 -6.3300 -6.3016 -6.3016 -6.2954 -6.2954 -6.2489 -6.2489 -6.1524 -6.1524 -5.7250 -5.7250 -5.5766 -5.5766 -5.1316 -5.1316 -5.0811 -5.0811 -4.0942 -4.0942 -4.0444 -4.0444 -3.5361 -3.5361 -3.4925 -3.4925 -2.1577 -2.1577 -1.9068 -1.9068 4.7878 4.7878 4.9749 4.9749 k =-0.2736 1.2056-0.0000 ( 7756 PWs) bands (ev): -20.0210 -20.0210 -19.9934 -19.9934 -19.7667 -19.7667 -19.7369 -19.7369 -8.4740 -8.4740 -8.4416 -8.4416 -7.3863 -7.3863 -7.3595 -7.3595 -7.3130 -7.3130 -7.2300 -7.2300 -6.3557 -6.3557 -6.3316 -6.3316 -6.2931 -6.2931 -6.2884 -6.2884 -6.2572 -6.2572 -6.2110 -6.2110 -5.7652 -5.7652 -5.6056 -5.6056 -5.1389 -5.1389 -5.0971 -5.0971 -4.0998 -4.0998 -4.0505 -4.0505 -3.5215 -3.5215 -3.4786 -3.4786 -2.1451 -2.1451 -1.8993 -1.8993 4.8398 4.8398 5.0198 5.0198 k =-0.2692 1.2268-0.0000 ( 7756 PWs) bands (ev): -20.0139 -20.0139 -19.9866 -19.9866 -19.7658 -19.7658 -19.7362 -19.7362 -8.4921 -8.4921 -8.4596 -8.4596 -7.3711 -7.3711 -7.3614 -7.3614 -7.2919 -7.2919 -7.1937 -7.1937 -6.3793 -6.3793 -6.3054 -6.3054 -6.2964 -6.2964 -6.2789 -6.2789 -6.2540 -6.2540 -6.2147 -6.2147 -5.8075 -5.8075 -5.6354 -5.6354 -5.1445 -5.1445 -5.1102 -5.1102 -4.1045 -4.1045 -4.0556 -4.0556 -3.5093 -3.5093 -3.4670 -3.4670 -2.1345 -2.1345 -1.8930 -1.8930 4.8883 4.8883 5.0614 5.0614 k =-0.2649 1.2480-0.0000 ( 7760 PWs) bands (ev): -20.0083 -20.0083 -19.9811 -19.9811 -19.7651 -19.7651 -19.7356 -19.7356 -8.5067 -8.5067 -8.4739 -8.4739 -7.3665 -7.3665 -7.3636 -7.3636 -7.2631 -7.2631 -7.1608 -7.1608 -6.4220 -6.4220 -6.3380 -6.3380 -6.2773 -6.2773 -6.2731 -6.2731 -6.2298 -6.2298 -6.1747 -6.1747 -5.8512 -5.8512 -5.6647 -5.6647 -5.1485 -5.1485 -5.1208 -5.1208 -4.1083 -4.1083 -4.0597 -4.0597 -3.4995 -3.4995 -3.4577 -3.4577 -2.1259 -2.1259 -1.8880 -1.8880 4.9331 4.9331 5.0992 5.0992 k =-0.2605 1.2692-0.0000 ( 7754 PWs) bands (ev): -20.0041 -20.0041 -19.9769 -19.9769 -19.7646 -19.7646 -19.7352 -19.7352 -8.5175 -8.5175 -8.4847 -8.4847 -7.3662 -7.3662 -7.3649 -7.3649 -7.2354 -7.2354 -7.1337 -7.1337 -6.4556 -6.4556 -6.3787 -6.3787 -6.2705 -6.2705 -6.2691 -6.2691 -6.1818 -6.1818 -6.1385 -6.1385 -5.8951 -5.8951 -5.6913 -5.6913 -5.1511 -5.1511 -5.1288 -5.1288 -4.1111 -4.1111 -4.0628 -4.0628 -3.4922 -3.4922 -3.4507 -3.4507 -2.1194 -2.1194 -1.8842 -1.8842 4.9736 4.9736 5.1330 5.1330 k =-0.2605 1.2692-0.0000 ( 7754 PWs) bands (ev): -20.0041 -20.0041 -19.9769 -19.9769 -19.7646 -19.7646 -19.7352 -19.7352 -8.5175 -8.5175 -8.4847 -8.4847 -7.3662 -7.3662 -7.3649 -7.3649 -7.2354 -7.2354 -7.1337 -7.1337 -6.4556 -6.4556 -6.3787 -6.3787 -6.2705 -6.2705 -6.2691 -6.2691 -6.1818 -6.1818 -6.1385 -6.1385 -5.8951 -5.8951 -5.6913 -5.6913 -5.1511 -5.1511 -5.1288 -5.1288 -4.1111 -4.1111 -4.0628 -4.0628 -3.4922 -3.4922 -3.4507 -3.4507 -2.1194 -2.1194 -1.8842 -1.8842 4.9736 4.9736 5.1330 5.1330 k =-0.2605 1.2692 0.0213 ( 7760 PWs) bands (ev): -20.0040 -20.0040 -19.9770 -19.9770 -19.7645 -19.7645 -19.7353 -19.7353 -8.5174 -8.5174 -8.4848 -8.4848 -7.3662 -7.3662 -7.3649 -7.3649 -7.2351 -7.2351 -7.1341 -7.1341 -6.4555 -6.4555 -6.3790 -6.3790 -6.2706 -6.2706 -6.2691 -6.2691 -6.1815 -6.1815 -6.1386 -6.1386 -5.8945 -5.8945 -5.6919 -5.6919 -5.1511 -5.1511 -5.1289 -5.1289 -4.1110 -4.1110 -4.0630 -4.0630 -3.4920 -3.4920 -3.4509 -3.4509 -2.1187 -2.1187 -1.8849 -1.8849 4.9741 4.9741 5.1325 5.1325 k =-0.2605 1.2692 0.0426 ( 7762 PWs) bands (ev): -20.0038 -20.0038 -19.9773 -19.9773 -19.7642 -19.7642 -19.7356 -19.7356 -8.5172 -8.5172 -8.4851 -8.4851 -7.3662 -7.3662 -7.3649 -7.3649 -7.2342 -7.2342 -7.1351 -7.1351 -6.4552 -6.4552 -6.3801 -6.3801 -6.2705 -6.2705 -6.2692 -6.2692 -6.1806 -6.1806 -6.1388 -6.1388 -5.8926 -5.8926 -5.6937 -5.6937 -5.1510 -5.1510 -5.1291 -5.1291 -4.1106 -4.1106 -4.0635 -4.0635 -3.4916 -3.4916 -3.4512 -3.4512 -2.1164 -2.1164 -1.8871 -1.8871 4.9755 4.9755 5.1308 5.1308 k =-0.2605 1.2692 0.0639 ( 7762 PWs) bands (ev): -20.0034 -20.0034 -19.9778 -19.9778 -19.7637 -19.7637 -19.7360 -19.7360 -8.5167 -8.5167 -8.4857 -8.4857 -7.3661 -7.3661 -7.3649 -7.3649 -7.2328 -7.2328 -7.1368 -7.1368 -6.4546 -6.4546 -6.3818 -6.3818 -6.2705 -6.2705 -6.2692 -6.2692 -6.1791 -6.1791 -6.1390 -6.1390 -5.8894 -5.8894 -5.6967 -5.6967 -5.1507 -5.1507 -5.1296 -5.1296 -4.1099 -4.1099 -4.0643 -4.0643 -3.4909 -3.4909 -3.4518 -3.4518 -2.1127 -2.1127 -1.8907 -1.8907 4.9777 4.9777 5.1281 5.1281 k =-0.2605 1.2692 0.0852 ( 7762 PWs) bands (ev): -20.0029 -20.0029 -19.9785 -19.9785 -19.7630 -19.7630 -19.7365 -19.7365 -8.5160 -8.5160 -8.4864 -8.4864 -7.3660 -7.3660 -7.3648 -7.3648 -7.2309 -7.2309 -7.1392 -7.1392 -6.4538 -6.4538 -6.3842 -6.3842 -6.2705 -6.2705 -6.2693 -6.2693 -6.1772 -6.1772 -6.1394 -6.1394 -5.8850 -5.8850 -5.7008 -5.7008 -5.1504 -5.1504 -5.1302 -5.1302 -4.1089 -4.1089 -4.0654 -4.0654 -3.4900 -3.4900 -3.4526 -3.4526 -2.1076 -2.1076 -1.8956 -1.8956 4.9809 4.9809 5.1244 5.1244 k =-0.2605 1.2692 0.1064 ( 7766 PWs) bands (ev): -20.0022 -20.0022 -19.9793 -19.9793 -19.7621 -19.7621 -19.7373 -19.7373 -8.5151 -8.5151 -8.4873 -8.4873 -7.3659 -7.3659 -7.3648 -7.3648 -7.2283 -7.2283 -7.1421 -7.1421 -6.4527 -6.4527 -6.3871 -6.3871 -6.2704 -6.2704 -6.2693 -6.2693 -6.1749 -6.1749 -6.1399 -6.1399 -5.8794 -5.8794 -5.7061 -5.7061 -5.1500 -5.1500 -5.1309 -5.1309 -4.1077 -4.1077 -4.0668 -4.0668 -3.4888 -3.4888 -3.4537 -3.4537 -2.1010 -2.1010 -1.9019 -1.9019 4.9848 4.9848 5.1197 5.1197 k =-0.2605 1.2692 0.1277 ( 7769 PWs) bands (ev): -20.0014 -20.0014 -19.9803 -19.9803 -19.7610 -19.7610 -19.7381 -19.7381 -8.5141 -8.5141 -8.4884 -8.4884 -7.3659 -7.3659 -7.3648 -7.3648 -7.2253 -7.2253 -7.1457 -7.1457 -6.4512 -6.4512 -6.3905 -6.3905 -6.2703 -6.2703 -6.2693 -6.2693 -6.1723 -6.1723 -6.1406 -6.1406 -5.8727 -5.8727 -5.7125 -5.7125 -5.1494 -5.1494 -5.1318 -5.1318 -4.1062 -4.1062 -4.0684 -4.0684 -3.4873 -3.4873 -3.4550 -3.4550 -2.0933 -2.0933 -1.9094 -1.9094 4.9896 4.9896 5.1141 5.1141 k =-0.2605 1.2692 0.1490 ( 7769 PWs) bands (ev): -20.0005 -20.0005 -19.9814 -19.9814 -19.7598 -19.7598 -19.7392 -19.7392 -8.5129 -8.5129 -8.4897 -8.4897 -7.3657 -7.3657 -7.3647 -7.3647 -7.2218 -7.2218 -7.1497 -7.1497 -6.4494 -6.4494 -6.3943 -6.3943 -6.2703 -6.2703 -6.2694 -6.2694 -6.1696 -6.1696 -6.1413 -6.1413 -5.8649 -5.8649 -5.7198 -5.7198 -5.1488 -5.1488 -5.1329 -5.1329 -4.1044 -4.1044 -4.0703 -4.0703 -3.4857 -3.4857 -3.4564 -3.4564 -2.0843 -2.0843 -1.9181 -1.9181 4.9952 4.9952 5.1077 5.1077 k =-0.2605 1.2692 0.1703 ( 7771 PWs) bands (ev): -19.9994 -19.9994 -19.9826 -19.9826 -19.7585 -19.7585 -19.7403 -19.7403 -8.5116 -8.5116 -8.4911 -8.4911 -7.3656 -7.3656 -7.3647 -7.3647 -7.2178 -7.2178 -7.1542 -7.1542 -6.4473 -6.4473 -6.3985 -6.3985 -6.2702 -6.2702 -6.2694 -6.2694 -6.1668 -6.1668 -6.1422 -6.1422 -5.8562 -5.8562 -5.7281 -5.7281 -5.1480 -5.1480 -5.1340 -5.1340 -4.1025 -4.1025 -4.0724 -4.0724 -3.4839 -3.4839 -3.4581 -3.4581 -2.0744 -2.0744 -1.9278 -1.9278 5.0014 5.0014 5.1006 5.1006 k =-0.2605 1.2692 0.1916 ( 7759 PWs) bands (ev): -19.9983 -19.9983 -19.9839 -19.9839 -19.7571 -19.7571 -19.7415 -19.7415 -8.5101 -8.5101 -8.4926 -8.4926 -7.3654 -7.3654 -7.3647 -7.3647 -7.2134 -7.2134 -7.1591 -7.1591 -6.4447 -6.4447 -6.4029 -6.4029 -6.2701 -6.2701 -6.2695 -6.2695 -6.1639 -6.1639 -6.1433 -6.1433 -5.8467 -5.8467 -5.7372 -5.7372 -5.1472 -5.1472 -5.1352 -5.1352 -4.1004 -4.1004 -4.0747 -4.0747 -3.4819 -3.4819 -3.4599 -3.4599 -2.0635 -2.0635 -1.9384 -1.9384 5.0083 5.0083 5.0929 5.0929 k =-0.2605 1.2692 0.2129 ( 7757 PWs) bands (ev): -19.9970 -19.9970 -19.9853 -19.9853 -19.7556 -19.7556 -19.7429 -19.7429 -8.5085 -8.5085 -8.4943 -8.4943 -7.3653 -7.3653 -7.3647 -7.3647 -7.2086 -7.2086 -7.1643 -7.1643 -6.4417 -6.4417 -6.4076 -6.4076 -6.2701 -6.2701 -6.2695 -6.2695 -6.1611 -6.1611 -6.1445 -6.1445 -5.8364 -5.8364 -5.7471 -5.7471 -5.1462 -5.1462 -5.1364 -5.1364 -4.0981 -4.0981 -4.0772 -4.0772 -3.4798 -3.4798 -3.4618 -3.4618 -2.0518 -2.0518 -1.9498 -1.9498 5.0158 5.0158 5.0847 5.0847 k =-0.2605 1.2692 0.2342 ( 7757 PWs) bands (ev): -19.9957 -19.9957 -19.9868 -19.9868 -19.7540 -19.7540 -19.7444 -19.7444 -8.5068 -8.5068 -8.4960 -8.4960 -7.3652 -7.3652 -7.3647 -7.3647 -7.2036 -7.2036 -7.1698 -7.1698 -6.4383 -6.4383 -6.4123 -6.4123 -6.2700 -6.2700 -6.2696 -6.2696 -6.1584 -6.1584 -6.1459 -6.1459 -5.8256 -5.8256 -5.7575 -5.7575 -5.1452 -5.1452 -5.1377 -5.1377 -4.0957 -4.0957 -4.0797 -4.0797 -3.4776 -3.4776 -3.4639 -3.4639 -2.0395 -2.0395 -1.9619 -1.9619 5.0237 5.0237 5.0762 5.0762 k =-0.2605 1.2692 0.2555 ( 7751 PWs) bands (ev): -19.9943 -19.9943 -19.9883 -19.9883 -19.7524 -19.7524 -19.7459 -19.7459 -8.5051 -8.5051 -8.4978 -8.4978 -7.3650 -7.3650 -7.3647 -7.3647 -7.1982 -7.1982 -7.1754 -7.1754 -6.4346 -6.4346 -6.4170 -6.4170 -6.2699 -6.2699 -6.2696 -6.2696 -6.1558 -6.1558 -6.1475 -6.1475 -5.8144 -5.8144 -5.7685 -5.7685 -5.1440 -5.1440 -5.1390 -5.1390 -4.0931 -4.0931 -4.0824 -4.0824 -3.4753 -3.4753 -3.4661 -3.4661 -2.0268 -2.0268 -1.9745 -1.9745 5.0320 5.0320 5.0674 5.0674 k =-0.2605 1.2692 0.2768 ( 7764 PWs) bands (ev): -19.9928 -19.9928 -19.9898 -19.9898 -19.7507 -19.7507 -19.7475 -19.7475 -8.5033 -8.5033 -8.4996 -8.4996 -7.3650 -7.3650 -7.3648 -7.3648 -7.1926 -7.1926 -7.1812 -7.1812 -6.4305 -6.4305 -6.4217 -6.4217 -6.2699 -6.2699 -6.2698 -6.2698 -6.1535 -6.1535 -6.1493 -6.1493 -5.8029 -5.8029 -5.7798 -5.7798 -5.1429 -5.1429 -5.1403 -5.1403 -4.0905 -4.0905 -4.0851 -4.0851 -3.4730 -3.4730 -3.4684 -3.4684 -2.0138 -2.0138 -1.9875 -1.9875 5.0407 5.0407 5.0585 5.0585 k =-0.2605 1.2692 0.2980 ( 7770 PWs) bands (ev): -19.9914 -19.9914 -19.9913 -19.9913 -19.7491 -19.7491 -19.7491 -19.7491 -8.5015 -8.5015 -8.5015 -8.5015 -7.3649 -7.3649 -7.3649 -7.3649 -7.1870 -7.1870 -7.1869 -7.1869 -6.4262 -6.4262 -6.4262 -6.4262 -6.2698 -6.2698 -6.2698 -6.2698 -6.1513 -6.1513 -6.1513 -6.1513 -5.7913 -5.7913 -5.7913 -5.7913 -5.1416 -5.1416 -5.1416 -5.1416 -4.0878 -4.0878 -4.0878 -4.0878 -3.4707 -3.4707 -3.4706 -3.4706 -2.0006 -2.0006 -2.0006 -2.0006 5.0495 5.0495 5.0495 5.0495 k =-0.2605 1.2692 0.2980 ( 7770 PWs) bands (ev): -19.9914 -19.9914 -19.9913 -19.9913 -19.7491 -19.7491 -19.7491 -19.7491 -8.5015 -8.5015 -8.5015 -8.5015 -7.3649 -7.3649 -7.3649 -7.3649 -7.1870 -7.1870 -7.1869 -7.1869 -6.4262 -6.4262 -6.4262 -6.4262 -6.2698 -6.2698 -6.2698 -6.2698 -6.1513 -6.1513 -6.1513 -6.1513 -5.7913 -5.7913 -5.7913 -5.7913 -5.1416 -5.1416 -5.1416 -5.1416 -4.0878 -4.0878 -4.0878 -4.0878 -3.4707 -3.4707 -3.4706 -3.4706 -2.0006 -2.0006 -2.0006 -2.0006 5.0495 5.0495 5.0495 5.0495 k =-0.2649 1.2480 0.2980 ( 7766 PWs) bands (ev): -19.9955 -19.9955 -19.9955 -19.9955 -19.7496 -19.7496 -19.7495 -19.7495 -8.4907 -8.4907 -8.4907 -8.4907 -7.3637 -7.3637 -7.3637 -7.3637 -7.2154 -7.2154 -7.2154 -7.2154 -6.3899 -6.3899 -6.3899 -6.3899 -6.2744 -6.2744 -6.2744 -6.2744 -6.1919 -6.1919 -6.1919 -6.1919 -5.7567 -5.7567 -5.7567 -5.7567 -5.1367 -5.1367 -5.1366 -5.1366 -4.0849 -4.0849 -4.0848 -4.0848 -3.4778 -3.4778 -3.4778 -3.4778 -2.0057 -2.0057 -2.0056 -2.0056 5.0119 5.0119 5.0119 5.0119 k =-0.2692 1.2268 0.2980 ( 7754 PWs) bands (ev): -20.0011 -20.0011 -20.0010 -20.0010 -19.7502 -19.7502 -19.7502 -19.7502 -8.4762 -8.4762 -8.4762 -8.4762 -7.3632 -7.3632 -7.3632 -7.3632 -7.2483 -7.2483 -7.2483 -7.2483 -6.3502 -6.3502 -6.3501 -6.3501 -6.2823 -6.2823 -6.2823 -6.2823 -6.2303 -6.2303 -6.2302 -6.2302 -5.7200 -5.7200 -5.7199 -5.7199 -5.1298 -5.1298 -5.1298 -5.1298 -4.0809 -4.0809 -4.0809 -4.0809 -3.4873 -3.4873 -3.4873 -3.4873 -2.0123 -2.0123 -2.0123 -2.0123 4.9701 4.9701 4.9701 4.9701 k =-0.2736 1.2056 0.2980 ( 7752 PWs) bands (ev): -20.0080 -20.0080 -20.0080 -20.0080 -19.7510 -19.7510 -19.7510 -19.7510 -8.4581 -8.4581 -8.4581 -8.4581 -7.3659 -7.3659 -7.3658 -7.3658 -7.2813 -7.2813 -7.2813 -7.2813 -6.3349 -6.3349 -6.3348 -6.3348 -6.2925 -6.2925 -6.2925 -6.2925 -6.2394 -6.2394 -6.2394 -6.2394 -5.6833 -5.6833 -5.6833 -5.6833 -5.1209 -5.1209 -5.1209 -5.1209 -4.0761 -4.0761 -4.0760 -4.0760 -3.4992 -3.4992 -3.4991 -3.4991 -2.0207 -2.0207 -2.0206 -2.0206 4.9245 4.9245 4.9245 4.9245 k =-0.2780 1.1844 0.2980 ( 7748 PWs) bands (ev): -20.0163 -20.0163 -20.0163 -20.0163 -19.7520 -19.7520 -19.7519 -19.7519 -8.4366 -8.4366 -8.4365 -8.4365 -7.3783 -7.3783 -7.3783 -7.3783 -7.3061 -7.3061 -7.3061 -7.3061 -6.3723 -6.3723 -6.3723 -6.3723 -6.2966 -6.2966 -6.2965 -6.2965 -6.1998 -6.1998 -6.1998 -6.1998 -5.6480 -5.6480 -5.6480 -5.6480 -5.1099 -5.1099 -5.1099 -5.1099 -4.0703 -4.0703 -4.0702 -4.0702 -3.5133 -3.5133 -3.5133 -3.5133 -2.0306 -2.0306 -2.0306 -2.0306 4.8755 4.8755 4.8755 4.8755 k =-0.2823 1.1632 0.2980 ( 7768 PWs) bands (ev): -20.0259 -20.0259 -20.0259 -20.0259 -19.7531 -19.7531 -19.7530 -19.7530 -8.4115 -8.4115 -8.4115 -8.4115 -7.4067 -7.4067 -7.4067 -7.4067 -7.3155 -7.3155 -7.3155 -7.3155 -6.4245 -6.4245 -6.4244 -6.4244 -6.3045 -6.3045 -6.3045 -6.3045 -6.1402 -6.1402 -6.1402 -6.1402 -5.6148 -5.6148 -5.6148 -5.6148 -5.0966 -5.0966 -5.0966 -5.0966 -4.0636 -4.0636 -4.0636 -4.0636 -3.5298 -3.5298 -3.5297 -3.5297 -2.0421 -2.0421 -2.0421 -2.0421 4.8234 4.8234 4.8234 4.8234 k =-0.2867 1.1419 0.2980 ( 7772 PWs) bands (ev): -20.0368 -20.0368 -20.0367 -20.0367 -19.7543 -19.7543 -19.7543 -19.7543 -8.3831 -8.3831 -8.3831 -8.3831 -7.4450 -7.4450 -7.4450 -7.4450 -7.3147 -7.3147 -7.3147 -7.3147 -6.4802 -6.4802 -6.4802 -6.4802 -6.3145 -6.3145 -6.3145 -6.3145 -6.0736 -6.0736 -6.0736 -6.0736 -5.5841 -5.5841 -5.5840 -5.5840 -5.0809 -5.0809 -5.0808 -5.0808 -4.0562 -4.0562 -4.0561 -4.0561 -3.5484 -3.5484 -3.5484 -3.5484 -2.0550 -2.0550 -2.0549 -2.0549 4.7686 4.7686 4.7686 4.7686 k =-0.2910 1.1207 0.2980 ( 7764 PWs) bands (ev): -20.0489 -20.0489 -20.0488 -20.0488 -19.7557 -19.7557 -19.7557 -19.7557 -8.3515 -8.3515 -8.3515 -8.3515 -7.4869 -7.4869 -7.4869 -7.4869 -7.3094 -7.3094 -7.3094 -7.3094 -6.5376 -6.5376 -6.5376 -6.5376 -6.3259 -6.3259 -6.3259 -6.3259 -6.0031 -6.0031 -6.0031 -6.0031 -5.5562 -5.5562 -5.5561 -5.5561 -5.0627 -5.0627 -5.0627 -5.0627 -4.0479 -4.0479 -4.0479 -4.0479 -3.5692 -3.5692 -3.5692 -3.5692 -2.0692 -2.0692 -2.0691 -2.0691 4.7114 4.7114 4.7115 4.7115 k =-0.2954 1.0995 0.2980 ( 7768 PWs) bands (ev): -20.0621 -20.0621 -20.0621 -20.0621 -19.7573 -19.7573 -19.7572 -19.7572 -8.3167 -8.3167 -8.3167 -8.3167 -7.5297 -7.5297 -7.5297 -7.5297 -7.3017 -7.3017 -7.3017 -7.3017 -6.5958 -6.5958 -6.5958 -6.5958 -6.3384 -6.3384 -6.3384 -6.3384 -5.9300 -5.9300 -5.9299 -5.9299 -5.5312 -5.5312 -5.5311 -5.5311 -5.0423 -5.0423 -5.0423 -5.0423 -4.0390 -4.0390 -4.0390 -4.0390 -3.5921 -3.5921 -3.5921 -3.5921 -2.0846 -2.0846 -2.0845 -2.0845 4.6524 4.6524 4.6524 4.6524 k =-0.2997 1.0783 0.2980 ( 7772 PWs) bands (ev): -20.0765 -20.0765 -20.0765 -20.0765 -19.7590 -19.7590 -19.7589 -19.7589 -8.2789 -8.2789 -8.2789 -8.2789 -7.5725 -7.5725 -7.5725 -7.5725 -7.2925 -7.2925 -7.2925 -7.2925 -6.6545 -6.6545 -6.6545 -6.6545 -6.3521 -6.3521 -6.3521 -6.3521 -5.8549 -5.8549 -5.8549 -5.8549 -5.5089 -5.5089 -5.5089 -5.5089 -5.0196 -5.0196 -5.0196 -5.0196 -4.0295 -4.0295 -4.0294 -4.0294 -3.6170 -3.6170 -3.6170 -3.6170 -2.1011 -2.1011 -2.1011 -2.1011 4.5917 4.5917 4.5917 4.5917 k =-0.3041 1.0571 0.2980 ( 7780 PWs) bands (ev): -20.0920 -20.0920 -20.0920 -20.0920 -19.7608 -19.7608 -19.7607 -19.7607 -8.2383 -8.2383 -8.2383 -8.2383 -7.6145 -7.6145 -7.6145 -7.6145 -7.2822 -7.2822 -7.2822 -7.2822 -6.7133 -6.7133 -6.7133 -6.7133 -6.3666 -6.3666 -6.3666 -6.3666 -5.7785 -5.7785 -5.7785 -5.7785 -5.4892 -5.4892 -5.4892 -5.4892 -4.9950 -4.9950 -4.9950 -4.9950 -4.0194 -4.0194 -4.0193 -4.0193 -3.6439 -3.6439 -3.6438 -3.6438 -2.1186 -2.1186 -2.1186 -2.1186 4.5297 4.5297 4.5297 4.5297 k =-0.3084 1.0359 0.2980 ( 7772 PWs) bands (ev): -20.1085 -20.1085 -20.1084 -20.1084 -19.7627 -19.7627 -19.7627 -19.7627 -8.1951 -8.1951 -8.1951 -8.1951 -7.6555 -7.6555 -7.6555 -7.6555 -7.2709 -7.2709 -7.2709 -7.2709 -6.7718 -6.7718 -6.7718 -6.7718 -6.3821 -6.3821 -6.3821 -6.3821 -5.7015 -5.7015 -5.7015 -5.7015 -5.4714 -5.4714 -5.4714 -5.4714 -4.9688 -4.9688 -4.9688 -4.9688 -4.0088 -4.0088 -4.0087 -4.0087 -3.6726 -3.6726 -3.6725 -3.6725 -2.1370 -2.1370 -2.1370 -2.1370 4.4667 4.4667 4.4667 4.4667 k =-0.3128 1.0147 0.2980 ( 7770 PWs) bands (ev): -20.1259 -20.1259 -20.1259 -20.1259 -19.7648 -19.7648 -19.7648 -19.7648 -8.1496 -8.1496 -8.1496 -8.1496 -7.6951 -7.6951 -7.6951 -7.6951 -7.2588 -7.2588 -7.2588 -7.2588 -6.8298 -6.8298 -6.8298 -6.8298 -6.3983 -6.3983 -6.3983 -6.3983 -5.6250 -5.6250 -5.6249 -5.6249 -5.4546 -5.4546 -5.4545 -5.4545 -4.9412 -4.9412 -4.9412 -4.9412 -3.9978 -3.9978 -3.9977 -3.9977 -3.7030 -3.7030 -3.7029 -3.7029 -2.1560 -2.1560 -2.1560 -2.1560 4.4030 4.4030 4.4030 4.4030 k =-0.3171 0.9935 0.2980 ( 7778 PWs) bands (ev): -20.1442 -20.1442 -20.1441 -20.1441 -19.7670 -19.7670 -19.7669 -19.7669 -8.1022 -8.1022 -8.1022 -8.1022 -7.7331 -7.7331 -7.7331 -7.7331 -7.2463 -7.2463 -7.2463 -7.2463 -6.8868 -6.8868 -6.8868 -6.8868 -6.4152 -6.4152 -6.4152 -6.4152 -5.5514 -5.5514 -5.5513 -5.5513 -5.4362 -5.4362 -5.4360 -5.4360 -4.9126 -4.9126 -4.9126 -4.9126 -3.9866 -3.9866 -3.9865 -3.9865 -3.7350 -3.7350 -3.7349 -3.7349 -2.1756 -2.1756 -2.1755 -2.1755 4.3388 4.3388 4.3388 4.3388 k =-0.3215 0.9723 0.2980 ( 7758 PWs) bands (ev): -20.1633 -20.1633 -20.1632 -20.1632 -19.7693 -19.7693 -19.7692 -19.7692 -8.0535 -8.0535 -8.0535 -8.0535 -7.7689 -7.7689 -7.7688 -7.7688 -7.2336 -7.2336 -7.2336 -7.2336 -6.9422 -6.9422 -6.9422 -6.9422 -6.4327 -6.4327 -6.4327 -6.4327 -5.4896 -5.4896 -5.4894 -5.4894 -5.4074 -5.4074 -5.4071 -5.4071 -4.8832 -4.8832 -4.8832 -4.8832 -3.9753 -3.9753 -3.9752 -3.9752 -3.7683 -3.7683 -3.7682 -3.7682 -2.1954 -2.1954 -2.1954 -2.1954 4.2744 4.2744 4.2744 4.2744 k =-0.3258 0.9510 0.2980 ( 7750 PWs) bands (ev): -20.1831 -20.1831 -20.1831 -20.1831 -19.7717 -19.7717 -19.7716 -19.7716 -8.0048 -8.0048 -8.0048 -8.0048 -7.8014 -7.8014 -7.8014 -7.8014 -7.2216 -7.2216 -7.2216 -7.2216 -6.9951 -6.9951 -6.9951 -6.9951 -6.4508 -6.4508 -6.4508 -6.4508 -5.4543 -5.4543 -5.4541 -5.4541 -5.3533 -5.3533 -5.3531 -5.3531 -4.8535 -4.8535 -4.8534 -4.8534 -3.9644 -3.9644 -3.9642 -3.9642 -3.8027 -3.8027 -3.8025 -3.8025 -2.2154 -2.2154 -2.2153 -2.2153 4.2100 4.2100 4.2100 4.2100 k =-0.3302 0.9298 0.2980 ( 7750 PWs) bands (ev): -20.2036 -20.2036 -20.2036 -20.2036 -19.7742 -19.7742 -19.7741 -19.7741 -7.9599 -7.9599 -7.9598 -7.9598 -7.8275 -7.8275 -7.8274 -7.8274 -7.2124 -7.2124 -7.2124 -7.2124 -7.0430 -7.0430 -7.0430 -7.0430 -6.4694 -6.4694 -6.4694 -6.4694 -5.4372 -5.4372 -5.4371 -5.4371 -5.2823 -5.2823 -5.2822 -5.2822 -4.8234 -4.8234 -4.8234 -4.8234 -3.9545 -3.9545 -3.9543 -3.9543 -3.8372 -3.8372 -3.8370 -3.8370 -2.2352 -2.2352 -2.2352 -2.2352 4.1457 4.1457 4.1457 4.1457 k =-0.3346 0.9086 0.2980 ( 7752 PWs) bands (ev): -20.2247 -20.2247 -20.2247 -20.2247 -19.7768 -19.7768 -19.7767 -19.7767 -7.9317 -7.9317 -7.9315 -7.9315 -7.8347 -7.8347 -7.8345 -7.8345 -7.2105 -7.2105 -7.2105 -7.2105 -7.0808 -7.0808 -7.0808 -7.0808 -6.4883 -6.4883 -6.4883 -6.4883 -5.4263 -5.4263 -5.4262 -5.4262 -5.2069 -5.2069 -5.2068 -5.2068 -4.7932 -4.7932 -4.7932 -4.7932 -3.9484 -3.9484 -3.9481 -3.9481 -3.8693 -3.8693 -3.8690 -3.8690 -2.2547 -2.2547 -2.2546 -2.2546 4.0818 4.0818 4.0818 4.0818 k =-0.3389 0.8874 0.2980 ( 7754 PWs) bands (ev): -20.2463 -20.2463 -20.2463 -20.2463 -19.7795 -19.7795 -19.7794 -19.7794 -7.9360 -7.9360 -7.9359 -7.9359 -7.8079 -7.8079 -7.8077 -7.8077 -7.2238 -7.2238 -7.2238 -7.2238 -7.1000 -7.1000 -7.1000 -7.1000 -6.5075 -6.5075 -6.5075 -6.5075 -5.4177 -5.4177 -5.4177 -5.4177 -5.1309 -5.1309 -5.1308 -5.1308 -4.7630 -4.7630 -4.7629 -4.7629 -3.9545 -3.9545 -3.9541 -3.9541 -3.8903 -3.8903 -3.8899 -3.8899 -2.2735 -2.2735 -2.2734 -2.2734 4.0183 4.0183 4.0184 4.0184 k =-0.3433 0.8662 0.2980 ( 7762 PWs) bands (ev): -20.2683 -20.2683 -20.2683 -20.2683 -19.7822 -19.7822 -19.7822 -19.7822 -7.9572 -7.9572 -7.9571 -7.9571 -7.7643 -7.7643 -7.7641 -7.7641 -7.2520 -7.2520 -7.2520 -7.2520 -7.0996 -7.0996 -7.0996 -7.0996 -6.5270 -6.5270 -6.5270 -6.5270 -5.4103 -5.4103 -5.4102 -5.4102 -5.0558 -5.0558 -5.0558 -5.0558 -4.7326 -4.7326 -4.7326 -4.7326 -3.9807 -3.9807 -3.9804 -3.9804 -3.8922 -3.8922 -3.8919 -3.8919 -2.2914 -2.2914 -2.2914 -2.2914 3.9556 3.9556 3.9556 3.9556 k =-0.3476 0.8450 0.2980 ( 7758 PWs) bands (ev): -20.2908 -20.2908 -20.2907 -20.2907 -19.7850 -19.7850 -19.7850 -19.7850 -7.9820 -7.9820 -7.9819 -7.9819 -7.7192 -7.7192 -7.7191 -7.7191 -7.2845 -7.2845 -7.2845 -7.2845 -7.0880 -7.0880 -7.0880 -7.0880 -6.5466 -6.5466 -6.5465 -6.5465 -5.4034 -5.4034 -5.4034 -5.4034 -4.9828 -4.9828 -4.9827 -4.9827 -4.7018 -4.7018 -4.7018 -4.7018 -4.0177 -4.0177 -4.0175 -4.0175 -3.8844 -3.8844 -3.8842 -3.8842 -2.3081 -2.3081 -2.3080 -2.3080 3.8935 3.8935 3.8935 3.8935 k =-0.3520 0.8238 0.2980 ( 7754 PWs) bands (ev): -20.3135 -20.3135 -20.3134 -20.3134 -19.7879 -19.7879 -19.7879 -19.7879 -8.0072 -8.0072 -8.0071 -8.0071 -7.6801 -7.6801 -7.6801 -7.6801 -7.3116 -7.3116 -7.3116 -7.3116 -7.0710 -7.0710 -7.0710 -7.0710 -6.5661 -6.5661 -6.5661 -6.5661 -5.3968 -5.3968 -5.3968 -5.3968 -4.9127 -4.9127 -4.9127 -4.9127 -4.6704 -4.6704 -4.6704 -4.6704 -4.0588 -4.0588 -4.0586 -4.0586 -3.8736 -3.8736 -3.8734 -3.8734 -2.3232 -2.3232 -2.3232 -2.3232 3.8324 3.8324 3.8324 3.8324 k =-0.3563 0.8026 0.2980 ( 7756 PWs) bands (ev): -20.3364 -20.3364 -20.3364 -20.3364 -19.7908 -19.7908 -19.7908 -19.7908 -8.0317 -8.0317 -8.0316 -8.0316 -7.6542 -7.6542 -7.6541 -7.6541 -7.3251 -7.3251 -7.3251 -7.3251 -7.0512 -7.0512 -7.0512 -7.0512 -6.5857 -6.5857 -6.5857 -6.5857 -5.3902 -5.3902 -5.3902 -5.3902 -4.8469 -4.8469 -4.8469 -4.8469 -4.6376 -4.6376 -4.6375 -4.6375 -4.1019 -4.1019 -4.1018 -4.1018 -3.8617 -3.8617 -3.8616 -3.8616 -2.3365 -2.3365 -2.3364 -2.3364 3.7722 3.7722 3.7722 3.7722 k =-0.3607 0.7814 0.2980 ( 7764 PWs) bands (ev): -20.3595 -20.3595 -20.3595 -20.3595 -19.7938 -19.7938 -19.7938 -19.7938 -8.0551 -8.0551 -8.0550 -8.0550 -7.6475 -7.6475 -7.6475 -7.6475 -7.3185 -7.3185 -7.3185 -7.3185 -7.0294 -7.0294 -7.0294 -7.0294 -6.6050 -6.6050 -6.6050 -6.6050 -5.3834 -5.3834 -5.3834 -5.3834 -4.7868 -4.7868 -4.7868 -4.7868 -4.6024 -4.6024 -4.6023 -4.6023 -4.1465 -4.1465 -4.1464 -4.1464 -3.8495 -3.8495 -3.8494 -3.8494 -2.3475 -2.3475 -2.3474 -2.3474 3.7131 3.7131 3.7132 3.7132 k =-0.3650 0.7602 0.2980 ( 7776 PWs) bands (ev): -20.3827 -20.3827 -20.3826 -20.3826 -19.7968 -19.7968 -19.7968 -19.7968 -8.0773 -8.0773 -8.0773 -8.0773 -7.6604 -7.6604 -7.6603 -7.6603 -7.2915 -7.2915 -7.2915 -7.2915 -7.0061 -7.0061 -7.0061 -7.0061 -6.6241 -6.6241 -6.6241 -6.6241 -5.3762 -5.3762 -5.3762 -5.3762 -4.7339 -4.7339 -4.7338 -4.7338 -4.5638 -4.5638 -4.5638 -4.5638 -4.1921 -4.1921 -4.1921 -4.1921 -3.8371 -3.8371 -3.8370 -3.8370 -2.3558 -2.3558 -2.3558 -2.3558 3.6552 3.6552 3.6552 3.6552 k =-0.3694 0.7389 0.2980 ( 7788 PWs) bands (ev): -20.4058 -20.4058 -20.4058 -20.4058 -19.7999 -19.7999 -19.7999 -19.7999 -8.0983 -8.0983 -8.0982 -8.0982 -7.6871 -7.6871 -7.6871 -7.6871 -7.2499 -7.2499 -7.2498 -7.2498 -6.9815 -6.9815 -6.9815 -6.9815 -6.6428 -6.6428 -6.6427 -6.6427 -5.3685 -5.3685 -5.3685 -5.3685 -4.6889 -4.6889 -4.6889 -4.6889 -4.5216 -4.5216 -4.5216 -4.5216 -4.2386 -4.2386 -4.2385 -4.2385 -3.8246 -3.8246 -3.8246 -3.8246 -2.3612 -2.3612 -2.3612 -2.3612 3.5985 3.5985 3.5986 3.5986 k =-0.3737 0.7177 0.2980 ( 7800 PWs) bands (ev): -20.4289 -20.4289 -20.4289 -20.4289 -19.8029 -19.8029 -19.8029 -19.8029 -8.1180 -8.1180 -8.1180 -8.1180 -7.7219 -7.7219 -7.7218 -7.7218 -7.1999 -7.1999 -7.1999 -7.1999 -6.9557 -6.9557 -6.9556 -6.9556 -6.6608 -6.6608 -6.6608 -6.6608 -5.3601 -5.3601 -5.3601 -5.3601 -4.6517 -4.6517 -4.6517 -4.6517 -4.4766 -4.4766 -4.4766 -4.4766 -4.2856 -4.2856 -4.2855 -4.2855 -3.8123 -3.8123 -3.8123 -3.8123 -2.3632 -2.3632 -2.3632 -2.3632 3.5432 3.5432 3.5432 3.5432 k =-0.3781 0.6965 0.2980 ( 7792 PWs) bands (ev): -20.4519 -20.4519 -20.4519 -20.4519 -19.8060 -19.8060 -19.8060 -19.8060 -8.1365 -8.1365 -8.1365 -8.1365 -7.7606 -7.7606 -7.7605 -7.7605 -7.1460 -7.1460 -7.1460 -7.1460 -6.9284 -6.9284 -6.9284 -6.9284 -6.6779 -6.6779 -6.6779 -6.6779 -5.3509 -5.3509 -5.3509 -5.3509 -4.6209 -4.6209 -4.6208 -4.6208 -4.4310 -4.4310 -4.4309 -4.4309 -4.3325 -4.3325 -4.3325 -4.3325 -3.8002 -3.8002 -3.8001 -3.8001 -2.3616 -2.3616 -2.3615 -2.3615 3.4893 3.4893 3.4893 3.4893 k =-0.3824 0.6753 0.2980 ( 7804 PWs) bands (ev): -20.4747 -20.4747 -20.4746 -20.4746 -19.8091 -19.8091 -19.8090 -19.8090 -8.1539 -8.1539 -8.1538 -8.1538 -7.8011 -7.8011 -7.8011 -7.8011 -7.0912 -7.0912 -7.0912 -7.0912 -6.8998 -6.8998 -6.8998 -6.8998 -6.6938 -6.6938 -6.6938 -6.6938 -5.3407 -5.3407 -5.3407 -5.3407 -4.5949 -4.5949 -4.5949 -4.5949 -4.3964 -4.3964 -4.3964 -4.3964 -4.3694 -4.3694 -4.3694 -4.3694 -3.7882 -3.7882 -3.7882 -3.7882 -2.3560 -2.3560 -2.3559 -2.3559 3.4368 3.4368 3.4368 3.4368 k =-0.3868 0.6541 0.2980 ( 7788 PWs) bands (ev): -20.4972 -20.4972 -20.4971 -20.4971 -19.8121 -19.8121 -19.8121 -19.8121 -8.1701 -8.1701 -8.1701 -8.1701 -7.8422 -7.8422 -7.8422 -7.8422 -7.0379 -7.0379 -7.0379 -7.0379 -6.8693 -6.8693 -6.8692 -6.8692 -6.7078 -6.7078 -6.7078 -6.7078 -5.3294 -5.3294 -5.3294 -5.3294 -4.5730 -4.5730 -4.5729 -4.5729 -4.4328 -4.4328 -4.4328 -4.4328 -4.3375 -4.3375 -4.3374 -4.3374 -3.7765 -3.7765 -3.7765 -3.7765 -2.3461 -2.3461 -2.3461 -2.3461 3.3858 3.3858 3.3858 3.3858 k =-0.3912 0.6329 0.2980 ( 7788 PWs) bands (ev): -20.5194 -20.5194 -20.5193 -20.5193 -19.8152 -19.8152 -19.8151 -19.8151 -8.1853 -8.1853 -8.1853 -8.1853 -7.8830 -7.8830 -7.8830 -7.8830 -6.9888 -6.9888 -6.9887 -6.9887 -6.8364 -6.8364 -6.8364 -6.8364 -6.7190 -6.7190 -6.7189 -6.7189 -5.3169 -5.3169 -5.3169 -5.3169 -4.5553 -4.5553 -4.5552 -4.5552 -4.4790 -4.4790 -4.4789 -4.4789 -4.2979 -4.2979 -4.2978 -4.2978 -3.7651 -3.7651 -3.7651 -3.7651 -2.3319 -2.3319 -2.3319 -2.3319 3.3363 3.3363 3.3364 3.3364 k =-0.3955 0.6117 0.2980 ( 7786 PWs) bands (ev): -20.5412 -20.5412 -20.5411 -20.5411 -19.8182 -19.8182 -19.8181 -19.8181 -8.1997 -8.1997 -8.1996 -8.1996 -7.9230 -7.9230 -7.9229 -7.9229 -6.9468 -6.9468 -6.9467 -6.9467 -6.8006 -6.8006 -6.8005 -6.8005 -6.7254 -6.7254 -6.7254 -6.7254 -5.3031 -5.3031 -5.3031 -5.3031 -4.5517 -4.5517 -4.5517 -4.5517 -4.5141 -4.5141 -4.5140 -4.5140 -4.2615 -4.2615 -4.2614 -4.2614 -3.7540 -3.7540 -3.7539 -3.7539 -2.3133 -2.3133 -2.3133 -2.3133 3.2885 3.2885 3.2885 3.2885 k =-0.3999 0.5905 0.2980 ( 7782 PWs) bands (ev): -20.5625 -20.5625 -20.5625 -20.5625 -19.8211 -19.8211 -19.8211 -19.8211 -8.2132 -8.2132 -8.2132 -8.2132 -7.9618 -7.9618 -7.9617 -7.9617 -6.9153 -6.9153 -6.9152 -6.9152 -6.7625 -6.7625 -6.7624 -6.7624 -6.7237 -6.7237 -6.7237 -6.7237 -5.2879 -5.2879 -5.2879 -5.2879 -4.5881 -4.5881 -4.5881 -4.5881 -4.5113 -4.5113 -4.5113 -4.5113 -4.2292 -4.2292 -4.2291 -4.2291 -3.7432 -3.7432 -3.7431 -3.7431 -2.2904 -2.2904 -2.2904 -2.2904 3.2424 3.2424 3.2424 3.2424 k =-0.4042 0.5693 0.2980 ( 7772 PWs) bands (ev): -20.5834 -20.5834 -20.5834 -20.5834 -19.8240 -19.8240 -19.8240 -19.8240 -8.2262 -8.2262 -8.2261 -8.2261 -7.9990 -7.9990 -7.9989 -7.9989 -6.8964 -6.8964 -6.8964 -6.8964 -6.7301 -6.7301 -6.7300 -6.7300 -6.7043 -6.7043 -6.7043 -6.7043 -5.2711 -5.2711 -5.2711 -5.2711 -4.6358 -4.6358 -4.6358 -4.6358 -4.4991 -4.4991 -4.4990 -4.4990 -4.2011 -4.2011 -4.2010 -4.2010 -3.7327 -3.7327 -3.7327 -3.7327 -2.2632 -2.2632 -2.2632 -2.2632 3.1979 3.1979 3.1979 3.1979 k =-0.4086 0.5481 0.2980 ( 7772 PWs) bands (ev): -20.6037 -20.6037 -20.6037 -20.6037 -19.8269 -19.8269 -19.8269 -19.8269 -8.2388 -8.2388 -8.2387 -8.2387 -8.0344 -8.0344 -8.0343 -8.0343 -6.8893 -6.8893 -6.8893 -6.8893 -6.7078 -6.7078 -6.7077 -6.7077 -6.6639 -6.6639 -6.6639 -6.6639 -5.2529 -5.2529 -5.2529 -5.2529 -4.6851 -4.6851 -4.6850 -4.6850 -4.4867 -4.4867 -4.4867 -4.4867 -4.1774 -4.1774 -4.1773 -4.1773 -3.7227 -3.7227 -3.7226 -3.7226 -2.2322 -2.2322 -2.2322 -2.2322 3.1551 3.1551 3.1552 3.1552 k =-0.4129 0.5268 0.2980 ( 7778 PWs) bands (ev): -20.6234 -20.6234 -20.6234 -20.6234 -19.8297 -19.8297 -19.8297 -19.8297 -8.2513 -8.2513 -8.2512 -8.2512 -8.0675 -8.0675 -8.0674 -8.0674 -6.8907 -6.8907 -6.8906 -6.8906 -6.6833 -6.6833 -6.6833 -6.6833 -6.6186 -6.6186 -6.6185 -6.6185 -5.2332 -5.2332 -5.2332 -5.2332 -4.7346 -4.7346 -4.7346 -4.7346 -4.4752 -4.4752 -4.4752 -4.4752 -4.1578 -4.1578 -4.1577 -4.1577 -3.7130 -3.7130 -3.7130 -3.7130 -2.1977 -2.1977 -2.1976 -2.1976 3.1142 3.1142 3.1142 3.1142 k =-0.4173 0.5056 0.2980 ( 7790 PWs) bands (ev): -20.6425 -20.6425 -20.6425 -20.6425 -19.8324 -19.8324 -19.8324 -19.8324 -8.2641 -8.2641 -8.2640 -8.2640 -8.0980 -8.0980 -8.0979 -8.0979 -6.8970 -6.8970 -6.8969 -6.8969 -6.6557 -6.6557 -6.6556 -6.6556 -6.5731 -6.5731 -6.5731 -6.5731 -5.2120 -5.2120 -5.2120 -5.2120 -4.7842 -4.7842 -4.7842 -4.7842 -4.4646 -4.4646 -4.4645 -4.4645 -4.1422 -4.1422 -4.1420 -4.1420 -3.7037 -3.7037 -3.7037 -3.7037 -2.1600 -2.1600 -2.1600 -2.1600 3.0750 3.0750 3.0751 3.0751 k =-0.4216 0.4844 0.2980 ( 7788 PWs) bands (ev): -20.6609 -20.6609 -20.6608 -20.6608 -19.8350 -19.8350 -19.8350 -19.8350 -8.2775 -8.2775 -8.2774 -8.2774 -8.1255 -8.1255 -8.1254 -8.1254 -6.9059 -6.9059 -6.9059 -6.9059 -6.6258 -6.6258 -6.6257 -6.6257 -6.5290 -6.5290 -6.5290 -6.5290 -5.1896 -5.1896 -5.1895 -5.1895 -4.8335 -4.8335 -4.8335 -4.8335 -4.4548 -4.4548 -4.4547 -4.4547 -4.1302 -4.1302 -4.1301 -4.1301 -3.6949 -3.6949 -3.6949 -3.6949 -2.1199 -2.1199 -2.1199 -2.1199 3.0377 3.0377 3.0377 3.0377 k =-0.4260 0.4632 0.2980 ( 7800 PWs) bands (ev): -20.6785 -20.6785 -20.6785 -20.6785 -19.8376 -19.8376 -19.8376 -19.8376 -8.2919 -8.2919 -8.2918 -8.2918 -8.1496 -8.1496 -8.1495 -8.1495 -6.9162 -6.9162 -6.9162 -6.9162 -6.5946 -6.5946 -6.5945 -6.5945 -6.4869 -6.4869 -6.4869 -6.4869 -5.1661 -5.1661 -5.1661 -5.1661 -4.8824 -4.8824 -4.8823 -4.8823 -4.4457 -4.4457 -4.4456 -4.4456 -4.1215 -4.1215 -4.1214 -4.1214 -3.6865 -3.6865 -3.6865 -3.6865 -2.0777 -2.0777 -2.0777 -2.0777 3.0022 3.0022 3.0023 3.0023 k =-0.4303 0.4420 0.2980 ( 7796 PWs) bands (ev): -20.6953 -20.6953 -20.6953 -20.6953 -19.8400 -19.8400 -19.8400 -19.8400 -8.3076 -8.3076 -8.3075 -8.3075 -8.1700 -8.1700 -8.1700 -8.1700 -6.9270 -6.9270 -6.9270 -6.9270 -6.5625 -6.5625 -6.5625 -6.5625 -6.4472 -6.4472 -6.4472 -6.4472 -5.1422 -5.1422 -5.1421 -5.1421 -4.9303 -4.9303 -4.9303 -4.9303 -4.4372 -4.4372 -4.4371 -4.4371 -4.1158 -4.1158 -4.1156 -4.1156 -3.6785 -3.6785 -3.6785 -3.6785 -2.0342 -2.0342 -2.0342 -2.0342 2.9687 2.9687 2.9687 2.9687 k =-0.4347 0.4208 0.2980 ( 7804 PWs) bands (ev): -20.7114 -20.7114 -20.7113 -20.7113 -19.8424 -19.8424 -19.8424 -19.8424 -8.3245 -8.3245 -8.3244 -8.3244 -8.1868 -8.1868 -8.1868 -8.1868 -6.9379 -6.9379 -6.9379 -6.9379 -6.5301 -6.5301 -6.5300 -6.5300 -6.4102 -6.4102 -6.4102 -6.4102 -5.1189 -5.1189 -5.1189 -5.1189 -4.9763 -4.9763 -4.9763 -4.9763 -4.4291 -4.4291 -4.4290 -4.4290 -4.1127 -4.1127 -4.1125 -4.1125 -3.6710 -3.6710 -3.6710 -3.6710 -1.9899 -1.9899 -1.9898 -1.9898 2.9370 2.9370 2.9370 2.9370 k =-0.4390 0.3996 0.2980 ( 7804 PWs) bands (ev): -20.7265 -20.7265 -20.7265 -20.7265 -19.8446 -19.8446 -19.8446 -19.8446 -8.3424 -8.3424 -8.3424 -8.3424 -8.2003 -8.2003 -8.2002 -8.2002 -6.9486 -6.9486 -6.9486 -6.9486 -6.4974 -6.4974 -6.4974 -6.4974 -6.3757 -6.3757 -6.3757 -6.3757 -5.1005 -5.1005 -5.1004 -5.1004 -5.0165 -5.0165 -5.0165 -5.0165 -4.4213 -4.4213 -4.4212 -4.4212 -4.1119 -4.1119 -4.1117 -4.1117 -3.6640 -3.6640 -3.6639 -3.6639 -1.9453 -1.9453 -1.9453 -1.9453 2.9073 2.9073 2.9073 2.9073 k =-0.4434 0.3784 0.2980 ( 7792 PWs) bands (ev): -20.7408 -20.7408 -20.7407 -20.7407 -19.8467 -19.8467 -19.8467 -19.8467 -8.3609 -8.3609 -8.3608 -8.3608 -8.2109 -8.2109 -8.2108 -8.2108 -6.9589 -6.9589 -6.9589 -6.9589 -6.4648 -6.4648 -6.4648 -6.4648 -6.3439 -6.3439 -6.3438 -6.3438 -5.1044 -5.1044 -5.1044 -5.1044 -5.0335 -5.0335 -5.0335 -5.0335 -4.4135 -4.4135 -4.4134 -4.4134 -4.1130 -4.1130 -4.1129 -4.1129 -3.6574 -3.6574 -3.6573 -3.6573 -1.9011 -1.9011 -1.9011 -1.9011 2.8795 2.8795 2.8796 2.8796 k =-0.4478 0.3572 0.2980 ( 7784 PWs) bands (ev): -20.7541 -20.7541 -20.7541 -20.7541 -19.8487 -19.8487 -19.8487 -19.8487 -8.3793 -8.3793 -8.3792 -8.3792 -8.2191 -8.2191 -8.2191 -8.2191 -6.9688 -6.9688 -6.9688 -6.9688 -6.4326 -6.4326 -6.4326 -6.4326 -6.3144 -6.3144 -6.3144 -6.3144 -5.1381 -5.1381 -5.1381 -5.1381 -5.0202 -5.0202 -5.0201 -5.0201 -4.4056 -4.4056 -4.4055 -4.4055 -4.1159 -4.1159 -4.1158 -4.1158 -3.6512 -3.6512 -3.6512 -3.6512 -1.8578 -1.8578 -1.8578 -1.8578 2.8538 2.8538 2.8538 2.8538 k =-0.4521 0.3360 0.2980 ( 7792 PWs) bands (ev): -20.7665 -20.7665 -20.7664 -20.7664 -19.8506 -19.8506 -19.8505 -19.8505 -8.3973 -8.3973 -8.3972 -8.3972 -8.2256 -8.2256 -8.2256 -8.2256 -6.9781 -6.9781 -6.9780 -6.9780 -6.4013 -6.4013 -6.4012 -6.4012 -6.2870 -6.2870 -6.2870 -6.2870 -5.1801 -5.1801 -5.1801 -5.1801 -4.9984 -4.9984 -4.9983 -4.9983 -4.3974 -4.3974 -4.3973 -4.3973 -4.1203 -4.1203 -4.1202 -4.1202 -3.6456 -3.6456 -3.6455 -3.6455 -1.8160 -1.8160 -1.8160 -1.8160 2.8300 2.8300 2.8300 2.8300 k =-0.4565 0.3147 0.2980 ( 7796 PWs) bands (ev): -20.7779 -20.7779 -20.7778 -20.7778 -19.8523 -19.8523 -19.8522 -19.8522 -8.4144 -8.4144 -8.4144 -8.4144 -8.2307 -8.2307 -8.2306 -8.2306 -6.9867 -6.9867 -6.9867 -6.9867 -6.3711 -6.3711 -6.3711 -6.3711 -6.2613 -6.2613 -6.2613 -6.2613 -5.2231 -5.2231 -5.2231 -5.2231 -4.9754 -4.9754 -4.9754 -4.9754 -4.3887 -4.3887 -4.3887 -4.3887 -4.1261 -4.1261 -4.1259 -4.1259 -3.6404 -3.6404 -3.6404 -3.6404 -1.7761 -1.7761 -1.7761 -1.7761 2.8082 2.8082 2.8082 2.8082 k =-0.4608 0.2935 0.2980 ( 7798 PWs) bands (ev): -20.7882 -20.7882 -20.7882 -20.7882 -19.8538 -19.8538 -19.8538 -19.8538 -8.4304 -8.4304 -8.4304 -8.4304 -8.2347 -8.2347 -8.2346 -8.2346 -6.9946 -6.9946 -6.9946 -6.9946 -6.3428 -6.3428 -6.3428 -6.3428 -6.2369 -6.2369 -6.2369 -6.2369 -5.2656 -5.2656 -5.2656 -5.2656 -4.9532 -4.9532 -4.9531 -4.9531 -4.3795 -4.3795 -4.3795 -4.3795 -4.1329 -4.1329 -4.1327 -4.1327 -3.6357 -3.6357 -3.6357 -3.6357 -1.7386 -1.7386 -1.7386 -1.7386 2.7885 2.7885 2.7885 2.7885 k =-0.4652 0.2723 0.2980 ( 7806 PWs) bands (ev): -20.7976 -20.7976 -20.7976 -20.7976 -19.8552 -19.8552 -19.8552 -19.8552 -8.4451 -8.4451 -8.4451 -8.4451 -8.2378 -8.2378 -8.2377 -8.2377 -7.0018 -7.0018 -7.0018 -7.0018 -6.3170 -6.3170 -6.3170 -6.3170 -6.2132 -6.2132 -6.2132 -6.2132 -5.3066 -5.3066 -5.3066 -5.3066 -4.9325 -4.9325 -4.9324 -4.9324 -4.3696 -4.3696 -4.3696 -4.3696 -4.1407 -4.1407 -4.1406 -4.1406 -3.6315 -3.6315 -3.6315 -3.6315 -1.7039 -1.7039 -1.7038 -1.7038 2.7707 2.7707 2.7708 2.7708 k =-0.4695 0.2511 0.2980 ( 7802 PWs) bands (ev): -20.8059 -20.8059 -20.8059 -20.8059 -19.8565 -19.8565 -19.8565 -19.8565 -8.4583 -8.4583 -8.4583 -8.4583 -8.2402 -8.2402 -8.2401 -8.2401 -7.0082 -7.0082 -7.0081 -7.0081 -6.2942 -6.2942 -6.2942 -6.2942 -6.1899 -6.1899 -6.1899 -6.1899 -5.3458 -5.3458 -5.3458 -5.3458 -4.9137 -4.9137 -4.9136 -4.9136 -4.3591 -4.3591 -4.3591 -4.3591 -4.1494 -4.1494 -4.1492 -4.1492 -3.6278 -3.6278 -3.6278 -3.6278 -1.6723 -1.6723 -1.6723 -1.6723 2.7550 2.7550 2.7550 2.7550 k =-0.4739 0.2299 0.2980 ( 7806 PWs) bands (ev): -20.8131 -20.8131 -20.8131 -20.8131 -19.8576 -19.8576 -19.8576 -19.8576 -8.4699 -8.4699 -8.4699 -8.4699 -8.2420 -8.2420 -8.2420 -8.2420 -7.0137 -7.0137 -7.0137 -7.0137 -6.2749 -6.2749 -6.2749 -6.2749 -6.1670 -6.1670 -6.1670 -6.1670 -5.3824 -5.3824 -5.3824 -5.3824 -4.8971 -4.8971 -4.8970 -4.8970 -4.3480 -4.3480 -4.3480 -4.3480 -4.1587 -4.1587 -4.1585 -4.1585 -3.6246 -3.6246 -3.6246 -3.6246 -1.6442 -1.6442 -1.6442 -1.6442 2.7405 2.7405 2.7405 2.7405 k =-0.4782 0.2087 0.2980 ( 7814 PWs) bands (ev): -20.8193 -20.8193 -20.8192 -20.8192 -19.8585 -19.8585 -19.8585 -19.8585 -8.4798 -8.4798 -8.4798 -8.4798 -8.2435 -8.2435 -8.2435 -8.2435 -7.0185 -7.0185 -7.0185 -7.0185 -6.2592 -6.2592 -6.2592 -6.2592 -6.1448 -6.1448 -6.1448 -6.1448 -5.4159 -5.4159 -5.4159 -5.4159 -4.8830 -4.8830 -4.8829 -4.8829 -4.3365 -4.3365 -4.3365 -4.3365 -4.1684 -4.1684 -4.1683 -4.1683 -3.6219 -3.6219 -3.6219 -3.6219 -1.6199 -1.6199 -1.6199 -1.6199 2.7198 2.7198 2.7198 2.7198 k =-0.4826 0.1875 0.2980 ( 7824 PWs) bands (ev): -20.8243 -20.8243 -20.8243 -20.8243 -19.8593 -19.8593 -19.8593 -19.8593 -8.4881 -8.4881 -8.4880 -8.4880 -8.2445 -8.2445 -8.2445 -8.2445 -7.0224 -7.0224 -7.0224 -7.0224 -6.2468 -6.2468 -6.2468 -6.2468 -6.1242 -6.1242 -6.1242 -6.1242 -5.4454 -5.4454 -5.4453 -5.4453 -4.8715 -4.8715 -4.8713 -4.8713 -4.3251 -4.3251 -4.3251 -4.3251 -4.1783 -4.1783 -4.1781 -4.1781 -3.6197 -3.6197 -3.6197 -3.6197 -1.5998 -1.5998 -1.5998 -1.5998 2.7005 2.7005 2.7005 2.7005 k =-0.4869 0.1663 0.2980 ( 7824 PWs) bands (ev): -20.8282 -20.8282 -20.8282 -20.8282 -19.8599 -19.8599 -19.8599 -19.8599 -8.4945 -8.4945 -8.4945 -8.4945 -8.2453 -8.2453 -8.2453 -8.2453 -7.0255 -7.0255 -7.0254 -7.0254 -6.2376 -6.2376 -6.2376 -6.2376 -6.1063 -6.1063 -6.1063 -6.1063 -5.4699 -5.4699 -5.4699 -5.4699 -4.8625 -4.8625 -4.8624 -4.8624 -4.3142 -4.3142 -4.3142 -4.3142 -4.1878 -4.1878 -4.1876 -4.1876 -3.6179 -3.6179 -3.6179 -3.6179 -1.5838 -1.5838 -1.5838 -1.5838 2.6853 2.6853 2.6853 2.6853 k =-0.4913 0.1451 0.2980 ( 7824 PWs) bands (ev): -20.8310 -20.8310 -20.8310 -20.8310 -19.8603 -19.8603 -19.8603 -19.8603 -8.4991 -8.4991 -8.4991 -8.4991 -8.2458 -8.2458 -8.2458 -8.2458 -7.0276 -7.0276 -7.0276 -7.0276 -6.2313 -6.2313 -6.2313 -6.2313 -6.0923 -6.0923 -6.0923 -6.0923 -5.4885 -5.4885 -5.4885 -5.4885 -4.8561 -4.8561 -4.8560 -4.8560 -4.3048 -4.3048 -4.3048 -4.3048 -4.1961 -4.1961 -4.1959 -4.1959 -3.6167 -3.6167 -3.6167 -3.6167 -1.5723 -1.5723 -1.5723 -1.5723 2.6743 2.6743 2.6743 2.6743 k =-0.4956 0.1238 0.2980 ( 7824 PWs) bands (ev): -20.8327 -20.8327 -20.8327 -20.8327 -19.8606 -19.8606 -19.8606 -19.8606 -8.5019 -8.5019 -8.5018 -8.5018 -8.2462 -8.2462 -8.2462 -8.2462 -7.0290 -7.0290 -7.0290 -7.0290 -6.2275 -6.2275 -6.2275 -6.2275 -6.0833 -6.0833 -6.0833 -6.0833 -5.5002 -5.5002 -5.5002 -5.5002 -4.8523 -4.8523 -4.8521 -4.8521 -4.2982 -4.2982 -4.2982 -4.2982 -4.2020 -4.2020 -4.2018 -4.2018 -3.6160 -3.6160 -3.6159 -3.6159 -1.5654 -1.5654 -1.5654 -1.5654 2.6677 2.6677 2.6677 2.6677 k =-0.5000 0.1026 0.2980 ( 7824 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2463 -8.2463 -8.2463 -8.2463 -7.0294 -7.0294 -7.0294 -7.0294 -6.2263 -6.2263 -6.2263 -6.2263 -6.0802 -6.0802 -6.0802 -6.0802 -5.5041 -5.5041 -5.5041 -5.5041 -4.8510 -4.8510 -4.8509 -4.8509 -4.2958 -4.2958 -4.2957 -4.2957 -4.2042 -4.2042 -4.2040 -4.2040 -3.6157 -3.6157 -3.6157 -3.6157 -1.5631 -1.5631 -1.5631 -1.5631 2.6655 2.6655 2.6655 2.6655 k =-0.5000 0.1026 0.2980 ( 7824 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2463 -8.2463 -8.2463 -8.2463 -7.0294 -7.0294 -7.0294 -7.0294 -6.2263 -6.2263 -6.2263 -6.2263 -6.0802 -6.0802 -6.0802 -6.0802 -5.5041 -5.5041 -5.5041 -5.5041 -4.8510 -4.8510 -4.8509 -4.8509 -4.2958 -4.2958 -4.2957 -4.2957 -4.2042 -4.2042 -4.2040 -4.2040 -3.6157 -3.6157 -3.6157 -3.6157 -1.5631 -1.5631 -1.5631 -1.5631 2.6655 2.6655 2.6655 2.6655 k =-0.5000 0.1026 0.2768 ( 7822 PWs) bands (ev): -20.8355 -20.8355 -20.8311 -20.8311 -19.8637 -19.8637 -19.8576 -19.8576 -8.5116 -8.5116 -8.4939 -8.4939 -8.2469 -8.2469 -8.2456 -8.2456 -7.0305 -7.0305 -7.0283 -7.0283 -6.2268 -6.2268 -6.2258 -6.2258 -6.0807 -6.0807 -6.0797 -6.0797 -5.5089 -5.5089 -5.4993 -5.4993 -4.8586 -4.8586 -4.8426 -4.8426 -4.3024 -4.3024 -4.2918 -4.2918 -4.2268 -4.2268 -4.1795 -4.1795 -3.6210 -3.6210 -3.6105 -3.6105 -1.5632 -1.5632 -1.5630 -1.5630 2.6303 2.6303 2.6856 2.6856 k =-0.5000 0.1026 0.2555 ( 7822 PWs) bands (ev): -20.8376 -20.8376 -20.8289 -20.8289 -19.8667 -19.8667 -19.8547 -19.8547 -8.5204 -8.5204 -8.4851 -8.4851 -8.2474 -8.2474 -8.2449 -8.2449 -7.0316 -7.0316 -7.0272 -7.0272 -6.2273 -6.2273 -6.2253 -6.2253 -6.0811 -6.0811 -6.0792 -6.0792 -5.5137 -5.5137 -5.4945 -5.4945 -4.8655 -4.8655 -4.8334 -4.8334 -4.3138 -4.3138 -4.2893 -4.2893 -4.2453 -4.2453 -4.1544 -4.1544 -3.6262 -3.6262 -3.6053 -3.6053 -1.5633 -1.5633 -1.5629 -1.5629 2.5962 2.5962 2.6680 2.6680 k =-0.5000 0.1026 0.2342 ( 7822 PWs) bands (ev): -20.8397 -20.8397 -20.8267 -20.8267 -19.8697 -19.8697 -19.8518 -19.8518 -8.5290 -8.5290 -8.4765 -8.4765 -8.2479 -8.2479 -8.2441 -8.2441 -7.0326 -7.0326 -7.0261 -7.0261 -6.2277 -6.2277 -6.2248 -6.2248 -6.0815 -6.0815 -6.0787 -6.0787 -5.5183 -5.5183 -5.4898 -5.4898 -4.8717 -4.8717 -4.8234 -4.8234 -4.3315 -4.3315 -4.2876 -4.2876 -4.2578 -4.2578 -4.1297 -4.1297 -3.6313 -3.6313 -3.6003 -3.6003 -1.5634 -1.5634 -1.5628 -1.5628 2.5637 2.5637 2.6513 2.6513 k =-0.5000 0.1026 0.2129 ( 7830 PWs) bands (ev): -20.8417 -20.8417 -20.8246 -20.8246 -19.8725 -19.8725 -19.8490 -19.8490 -8.5372 -8.5372 -8.4683 -8.4683 -8.2484 -8.2484 -8.2434 -8.2434 -7.0337 -7.0337 -7.0251 -7.0251 -6.2282 -6.2282 -6.2243 -6.2243 -6.0820 -6.0820 -6.0783 -6.0783 -5.5227 -5.5227 -5.4853 -5.4853 -4.8773 -4.8773 -4.8126 -4.8126 -4.3544 -4.3544 -4.2863 -4.2863 -4.2652 -4.2652 -4.1060 -4.1060 -3.6362 -3.6362 -3.5955 -3.5955 -1.5635 -1.5635 -1.5627 -1.5627 2.5331 2.5331 2.6357 2.6357 k =-0.5000 0.1026 0.1916 ( 7822 PWs) bands (ev): -20.8436 -20.8436 -20.8227 -20.8227 -19.8752 -19.8752 -19.8464 -19.8464 -8.5449 -8.5449 -8.4605 -8.4605 -8.2488 -8.2488 -8.2426 -8.2426 -7.0346 -7.0346 -7.0241 -7.0241 -6.2286 -6.2286 -6.2238 -6.2238 -6.0823 -6.0823 -6.0778 -6.0778 -5.5269 -5.5269 -5.4810 -5.4810 -4.8822 -4.8822 -4.8009 -4.8009 -4.3802 -4.3802 -4.2853 -4.2853 -4.2695 -4.2695 -4.0836 -4.0836 -3.6409 -3.6409 -3.5910 -3.5910 -1.5635 -1.5635 -1.5626 -1.5626 2.5045 2.5045 2.6213 2.6213 k =-0.5000 0.1026 0.1703 ( 7804 PWs) bands (ev): -20.8454 -20.8454 -20.8208 -20.8208 -19.8777 -19.8777 -19.8440 -19.8440 -8.5521 -8.5521 -8.4533 -8.4533 -8.2491 -8.2491 -8.2418 -8.2418 -7.0354 -7.0354 -7.0232 -7.0232 -6.2289 -6.2289 -6.2233 -6.2233 -6.0826 -6.0826 -6.0773 -6.0773 -5.5307 -5.5307 -5.4770 -5.4770 -4.8866 -4.8866 -4.7884 -4.7884 -4.4073 -4.4073 -4.2845 -4.2845 -4.2722 -4.2722 -4.0629 -4.0629 -3.6453 -3.6453 -3.5867 -3.5867 -1.5636 -1.5636 -1.5624 -1.5624 2.4784 2.4784 2.6083 2.6083 k =-0.5000 0.1026 0.1490 ( 7804 PWs) bands (ev): -20.8470 -20.8470 -20.8191 -20.8191 -19.8801 -19.8801 -19.8417 -19.8417 -8.5587 -8.5587 -8.4467 -8.4467 -8.2494 -8.2494 -8.2410 -8.2410 -7.0362 -7.0362 -7.0223 -7.0223 -6.2293 -6.2293 -6.2229 -6.2229 -6.0829 -6.0829 -6.0769 -6.0769 -5.5343 -5.5343 -5.4733 -5.4733 -4.8903 -4.8903 -4.7750 -4.7750 -4.4346 -4.4346 -4.2838 -4.2838 -4.2741 -4.2741 -4.0441 -4.0441 -3.6493 -3.6493 -3.5829 -3.5829 -1.5637 -1.5637 -1.5623 -1.5623 2.4547 2.4547 2.5966 2.5966 k =-0.5000 0.1026 0.1277 ( 7804 PWs) bands (ev): -20.8484 -20.8484 -20.8176 -20.8176 -19.8821 -19.8821 -19.8398 -19.8398 -8.5646 -8.5646 -8.4409 -8.4409 -8.2497 -8.2497 -8.2402 -8.2402 -7.0369 -7.0369 -7.0216 -7.0216 -6.2296 -6.2296 -6.2225 -6.2225 -6.0832 -6.0832 -6.0765 -6.0765 -5.5374 -5.5374 -5.4700 -5.4700 -4.8936 -4.8936 -4.7609 -4.7609 -4.4615 -4.4615 -4.2833 -4.2833 -4.2754 -4.2754 -4.0273 -4.0273 -3.6529 -3.6529 -3.5795 -3.5795 -1.5638 -1.5638 -1.5623 -1.5623 2.4339 2.4339 2.5863 2.5863 k =-0.5000 0.1026 0.1064 ( 7800 PWs) bands (ev): -20.8496 -20.8496 -20.8162 -20.8162 -19.8840 -19.8840 -19.8381 -19.8381 -8.5697 -8.5697 -8.4358 -8.4358 -8.2499 -8.2499 -8.2395 -8.2395 -7.0376 -7.0376 -7.0209 -7.0209 -6.2298 -6.2298 -6.2222 -6.2222 -6.0834 -6.0834 -6.0761 -6.0761 -5.5401 -5.5401 -5.4671 -5.4671 -4.8963 -4.8963 -4.7463 -4.7463 -4.4876 -4.4876 -4.2828 -4.2828 -4.2764 -4.2764 -4.0129 -4.0129 -3.6561 -3.6561 -3.5765 -3.5765 -1.5638 -1.5638 -1.5622 -1.5622 2.4159 2.4159 2.5775 2.5775 k =-0.5000 0.1026 0.0852 ( 7800 PWs) bands (ev): -20.8506 -20.8506 -20.8151 -20.8151 -19.8855 -19.8855 -19.8366 -19.8366 -8.5739 -8.5739 -8.4315 -8.4315 -8.2501 -8.2501 -8.2389 -8.2389 -7.0381 -7.0381 -7.0204 -7.0204 -6.2300 -6.2300 -6.2219 -6.2219 -6.0836 -6.0836 -6.0758 -6.0758 -5.5424 -5.5424 -5.4647 -5.4647 -4.8985 -4.8985 -4.7313 -4.7313 -4.5122 -4.5122 -4.2823 -4.2823 -4.2772 -4.2772 -4.0008 -4.0008 -3.6587 -3.6587 -3.5740 -3.5740 -1.5639 -1.5639 -1.5622 -1.5622 2.4010 2.4010 2.5703 2.5703 k =-0.5000 0.1026 0.0639 ( 7802 PWs) bands (ev): -20.8514 -20.8514 -20.8142 -20.8142 -19.8867 -19.8867 -19.8355 -19.8355 -8.5773 -8.5773 -8.4282 -8.4282 -8.2502 -8.2502 -8.2384 -8.2384 -7.0385 -7.0385 -7.0199 -7.0199 -6.2302 -6.2302 -6.2217 -6.2217 -6.0838 -6.0838 -6.0756 -6.0756 -5.5442 -5.5442 -5.4628 -5.4628 -4.9001 -4.9001 -4.7165 -4.7165 -4.5346 -4.5346 -4.2819 -4.2819 -4.2778 -4.2778 -3.9913 -3.9913 -3.6608 -3.6608 -3.5721 -3.5721 -1.5639 -1.5639 -1.5621 -1.5621 2.3893 2.3893 2.5646 2.5646 k =-0.5000 0.1026 0.0426 ( 7792 PWs) bands (ev): -20.8520 -20.8520 -20.8136 -20.8136 -19.8876 -19.8876 -19.8347 -19.8347 -8.5797 -8.5797 -8.4258 -8.4258 -8.2503 -8.2503 -8.2380 -8.2380 -7.0387 -7.0387 -7.0196 -7.0196 -6.2303 -6.2303 -6.2215 -6.2215 -6.0839 -6.0839 -6.0754 -6.0754 -5.5455 -5.5455 -5.4614 -5.4614 -4.9013 -4.9013 -4.7031 -4.7031 -4.5535 -4.5535 -4.2816 -4.2816 -4.2782 -4.2782 -3.9844 -3.9844 -3.6623 -3.6623 -3.5707 -3.5707 -1.5639 -1.5639 -1.5621 -1.5621 2.3809 2.3809 2.5606 2.5606 k =-0.5000 0.1026 0.0213 ( 7802 PWs) bands (ev): -20.8524 -20.8524 -20.8132 -20.8132 -19.8881 -19.8881 -19.8342 -19.8342 -8.5812 -8.5812 -8.4244 -8.4244 -8.2503 -8.2503 -8.2378 -8.2378 -7.0390 -7.0390 -7.0193 -7.0193 -6.2304 -6.2304 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5463 -5.5463 -5.4606 -5.4606 -4.9021 -4.9021 -4.6930 -4.6930 -4.5670 -4.5670 -4.2814 -4.2814 -4.2785 -4.2785 -3.9803 -3.9803 -3.6632 -3.6632 -3.5698 -3.5698 -1.5639 -1.5639 -1.5621 -1.5621 2.3758 2.3758 2.5581 2.5581 k =-0.5000 0.1026 0.0000 ( 7802 PWs) bands (ev): -20.8525 -20.8525 -20.8131 -20.8131 -19.8883 -19.8883 -19.8341 -19.8341 -8.5816 -8.5816 -8.4239 -8.4239 -8.2504 -8.2504 -8.2378 -8.2378 -7.0390 -7.0390 -7.0193 -7.0193 -6.2304 -6.2304 -6.2215 -6.2215 -6.0839 -6.0839 -6.0753 -6.0753 -5.5466 -5.5466 -5.4603 -5.4603 -4.9023 -4.9023 -4.6892 -4.6892 -4.5720 -4.5720 -4.2813 -4.2813 -4.2786 -4.2786 -3.9789 -3.9789 -3.6635 -3.6635 -3.5695 -3.5695 -1.5640 -1.5640 -1.5621 -1.5621 2.3741 2.3741 2.5573 2.5573 k = 0.0000 0.0000 0.2980 ( 7768 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5027 -8.5027 -8.2462 -8.2462 -8.2462 -8.2462 -7.0285 -7.0285 -7.0285 -7.0285 -6.2277 -6.2277 -6.2277 -6.2277 -6.0804 -6.0804 -6.0804 -6.0804 -5.4917 -5.4917 -5.4917 -5.4917 -4.8542 -4.8542 -4.8540 -4.8540 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6123 -3.6123 -3.6123 -3.6123 -1.5630 -1.5630 -1.5630 -1.5630 1.8745 1.8745 1.8745 1.8745 k =-0.0208 0.0043 0.2980 ( 7772 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0285 -7.0285 -7.0285 -7.0285 -6.2277 -6.2277 -6.2277 -6.2277 -6.0804 -6.0804 -6.0804 -6.0804 -5.4917 -5.4917 -5.4917 -5.4917 -4.8542 -4.8542 -4.8540 -4.8540 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6123 -3.6123 -3.6123 -3.6123 -1.5630 -1.5630 -1.5630 -1.5630 1.8760 1.8760 1.8760 1.8760 k =-0.0417 0.0086 0.2980 ( 7768 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5027 -8.5027 -8.2462 -8.2462 -8.2462 -8.2462 -7.0285 -7.0285 -7.0285 -7.0285 -6.2276 -6.2276 -6.2276 -6.2276 -6.0804 -6.0804 -6.0804 -6.0804 -5.4919 -5.4919 -5.4919 -5.4919 -4.8541 -4.8541 -4.8540 -4.8540 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6123 -3.6123 -3.6123 -3.6123 -1.5630 -1.5630 -1.5630 -1.5630 1.8806 1.8806 1.8806 1.8806 k =-0.0625 0.0128 0.2980 ( 7780 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0286 -7.0286 -7.0286 -7.0286 -6.2276 -6.2276 -6.2276 -6.2276 -6.0804 -6.0804 -6.0804 -6.0804 -5.4922 -5.4922 -5.4922 -5.4922 -4.8541 -4.8541 -4.8539 -4.8539 -4.2959 -4.2959 -4.2959 -4.2959 -4.2052 -4.2052 -4.2050 -4.2050 -3.6124 -3.6124 -3.6124 -3.6124 -1.5630 -1.5630 -1.5630 -1.5630 1.8882 1.8882 1.8883 1.8883 k =-0.0833 0.0171 0.2980 ( 7784 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0286 -7.0286 -7.0286 -7.0286 -6.2276 -6.2276 -6.2275 -6.2275 -6.0804 -6.0804 -6.0804 -6.0804 -5.4925 -5.4925 -5.4925 -5.4925 -4.8540 -4.8540 -4.8538 -4.8538 -4.2959 -4.2959 -4.2959 -4.2959 -4.2051 -4.2051 -4.2049 -4.2049 -3.6125 -3.6125 -3.6125 -3.6125 -1.5630 -1.5630 -1.5630 -1.5630 1.8989 1.8989 1.8989 1.8989 k =-0.1042 0.0214 0.2980 ( 7794 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0287 -7.0287 -7.0287 -7.0287 -6.2276 -6.2276 -6.2275 -6.2275 -6.0805 -6.0805 -6.0804 -6.0804 -5.4930 -5.4930 -5.4930 -5.4930 -4.8539 -4.8539 -4.8537 -4.8537 -4.2959 -4.2959 -4.2959 -4.2959 -4.2051 -4.2051 -4.2049 -4.2049 -3.6126 -3.6126 -3.6126 -3.6126 -1.5630 -1.5630 -1.5630 -1.5630 1.9126 1.9126 1.9126 1.9126 k =-0.1250 0.0257 0.2980 ( 7776 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8607 -19.8607 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0287 -7.0287 -7.0287 -7.0287 -6.2275 -6.2275 -6.2274 -6.2274 -6.0804 -6.0804 -6.0803 -6.0803 -5.4935 -5.4935 -5.4935 -5.4935 -4.8537 -4.8537 -4.8535 -4.8535 -4.2959 -4.2959 -4.2958 -4.2958 -4.2050 -4.2050 -4.2049 -4.2049 -3.6128 -3.6128 -3.6127 -3.6127 -1.5630 -1.5630 -1.5630 -1.5630 1.9293 1.9293 1.9293 1.9293 k =-0.1458 0.0299 0.2980 ( 7764 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0287 -7.0287 -7.0287 -7.0287 -6.2274 -6.2274 -6.2273 -6.2273 -6.0804 -6.0804 -6.0803 -6.0803 -5.4941 -5.4941 -5.4941 -5.4941 -4.8535 -4.8535 -4.8534 -4.8534 -4.2959 -4.2959 -4.2958 -4.2958 -4.2050 -4.2050 -4.2048 -4.2048 -3.6129 -3.6129 -3.6129 -3.6129 -1.5630 -1.5630 -1.5630 -1.5630 1.9489 1.9489 1.9489 1.9489 k =-0.1667 0.0342 0.2980 ( 7774 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0287 -7.0287 -7.0287 -7.0287 -6.2274 -6.2274 -6.2273 -6.2273 -6.0804 -6.0804 -6.0803 -6.0803 -5.4948 -5.4948 -5.4948 -5.4948 -4.8534 -4.8534 -4.8532 -4.8532 -4.2958 -4.2958 -4.2958 -4.2958 -4.2049 -4.2049 -4.2048 -4.2048 -3.6131 -3.6131 -3.6131 -3.6131 -1.5630 -1.5630 -1.5630 -1.5630 1.9714 1.9714 1.9715 1.9715 k =-0.1875 0.0385 0.2980 ( 7776 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0288 -7.0288 -7.0288 -7.0288 -6.2273 -6.2273 -6.2272 -6.2272 -6.0804 -6.0804 -6.0803 -6.0803 -5.4955 -5.4955 -5.4955 -5.4955 -4.8532 -4.8532 -4.8530 -4.8530 -4.2958 -4.2958 -4.2958 -4.2958 -4.2049 -4.2049 -4.2047 -4.2047 -3.6133 -3.6133 -3.6133 -3.6133 -1.5630 -1.5630 -1.5630 -1.5630 1.9969 1.9969 1.9970 1.9970 k =-0.2083 0.0428 0.2980 ( 7770 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0288 -7.0288 -7.0288 -7.0288 -6.2272 -6.2272 -6.2271 -6.2271 -6.0804 -6.0804 -6.0802 -6.0802 -5.4963 -5.4963 -5.4963 -5.4963 -4.8530 -4.8530 -4.8528 -4.8528 -4.2958 -4.2958 -4.2958 -4.2958 -4.2048 -4.2048 -4.2046 -4.2046 -3.6135 -3.6135 -3.6135 -3.6135 -1.5630 -1.5630 -1.5630 -1.5630 2.0252 2.0252 2.0253 2.0253 k =-0.2292 0.0470 0.2980 ( 7780 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0289 -7.0289 -7.0289 -7.0289 -6.2271 -6.2271 -6.2270 -6.2270 -6.0804 -6.0804 -6.0802 -6.0802 -5.4971 -5.4971 -5.4971 -5.4971 -4.8528 -4.8528 -4.8526 -4.8526 -4.2958 -4.2958 -4.2958 -4.2958 -4.2048 -4.2048 -4.2046 -4.2046 -3.6137 -3.6137 -3.6137 -3.6137 -1.5630 -1.5630 -1.5630 -1.5630 2.0563 2.0563 2.0564 2.0564 k =-0.2500 0.0513 0.2980 ( 7796 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0289 -7.0289 -7.0289 -7.0289 -6.2270 -6.2270 -6.2269 -6.2269 -6.0804 -6.0804 -6.0802 -6.0802 -5.4979 -5.4979 -5.4979 -5.4979 -4.8526 -4.8526 -4.8524 -4.8524 -4.2958 -4.2958 -4.2958 -4.2958 -4.2047 -4.2047 -4.2045 -4.2045 -3.6140 -3.6140 -3.6139 -3.6139 -1.5631 -1.5631 -1.5631 -1.5631 2.0901 2.0901 2.0902 2.0902 k =-0.2708 0.0556 0.2980 ( 7796 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0290 -7.0290 -7.0290 -7.0290 -6.2269 -6.2269 -6.2268 -6.2268 -6.0803 -6.0803 -6.0802 -6.0802 -5.4987 -5.4987 -5.4987 -5.4987 -4.8524 -4.8524 -4.8522 -4.8522 -4.2958 -4.2958 -4.2958 -4.2958 -4.2046 -4.2046 -4.2045 -4.2045 -3.6142 -3.6142 -3.6142 -3.6142 -1.5631 -1.5631 -1.5631 -1.5631 2.1266 2.1266 2.1267 2.1267 k =-0.2917 0.0599 0.2980 ( 7796 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0290 -7.0290 -7.0290 -7.0290 -6.2269 -6.2269 -6.2267 -6.2267 -6.0803 -6.0803 -6.0802 -6.0802 -5.4995 -5.4995 -5.4995 -5.4995 -4.8522 -4.8522 -4.8520 -4.8520 -4.2958 -4.2958 -4.2958 -4.2958 -4.2046 -4.2046 -4.2044 -4.2044 -3.6144 -3.6144 -3.6144 -3.6144 -1.5631 -1.5631 -1.5631 -1.5631 2.1657 2.1657 2.1658 2.1658 k =-0.3125 0.0641 0.2980 ( 7802 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0291 -7.0291 -7.0291 -7.0291 -6.2268 -6.2268 -6.2267 -6.2267 -6.0803 -6.0803 -6.0802 -6.0802 -5.5003 -5.5003 -5.5003 -5.5003 -4.8520 -4.8520 -4.8518 -4.8518 -4.2958 -4.2958 -4.2958 -4.2958 -4.2045 -4.2045 -4.2043 -4.2043 -3.6146 -3.6146 -3.6146 -3.6146 -1.5631 -1.5631 -1.5631 -1.5631 2.2074 2.2074 2.2075 2.2075 k =-0.3333 0.0684 0.2980 ( 7808 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0291 -7.0291 -7.0291 -7.0291 -6.2267 -6.2267 -6.2266 -6.2266 -6.0803 -6.0803 -6.0802 -6.0802 -5.5010 -5.5010 -5.5010 -5.5010 -4.8518 -4.8518 -4.8516 -4.8516 -4.2958 -4.2958 -4.2958 -4.2958 -4.2045 -4.2045 -4.2043 -4.2043 -3.6148 -3.6148 -3.6148 -3.6148 -1.5631 -1.5631 -1.5631 -1.5631 2.2515 2.2515 2.2517 2.2517 k =-0.3542 0.0727 0.2980 ( 7818 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0292 -7.0292 -7.0292 -7.0292 -6.2266 -6.2266 -6.2265 -6.2265 -6.0803 -6.0803 -6.0802 -6.0802 -5.5017 -5.5017 -5.5017 -5.5017 -4.8516 -4.8516 -4.8515 -4.8515 -4.2958 -4.2958 -4.2958 -4.2958 -4.2044 -4.2044 -4.2042 -4.2042 -3.6150 -3.6150 -3.6150 -3.6150 -1.5631 -1.5631 -1.5631 -1.5631 2.2981 2.2981 2.2982 2.2982 k =-0.3750 0.0770 0.2980 ( 7822 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0293 -7.0293 -7.0293 -7.0293 -6.2266 -6.2266 -6.2265 -6.2265 -6.0803 -6.0803 -6.0802 -6.0802 -5.5023 -5.5023 -5.5023 -5.5023 -4.8515 -4.8515 -4.8513 -4.8513 -4.2958 -4.2958 -4.2958 -4.2958 -4.2044 -4.2044 -4.2042 -4.2042 -3.6152 -3.6152 -3.6152 -3.6152 -1.5631 -1.5631 -1.5631 -1.5631 2.3469 2.3469 2.3471 2.3471 k =-0.3958 0.0813 0.2980 ( 7814 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0293 -7.0293 -7.0293 -7.0293 -6.2265 -6.2265 -6.2264 -6.2264 -6.0803 -6.0803 -6.0802 -6.0802 -5.5029 -5.5029 -5.5028 -5.5028 -4.8513 -4.8513 -4.8512 -4.8512 -4.2958 -4.2958 -4.2958 -4.2958 -4.2043 -4.2043 -4.2041 -4.2041 -3.6153 -3.6153 -3.6153 -3.6153 -1.5631 -1.5631 -1.5631 -1.5631 2.3980 2.3980 2.3981 2.3981 k =-0.4167 0.0855 0.2980 ( 7826 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0294 -7.0294 -7.0294 -7.0294 -6.2264 -6.2264 -6.2264 -6.2264 -6.0803 -6.0803 -6.0802 -6.0802 -5.5033 -5.5033 -5.5033 -5.5033 -4.8512 -4.8512 -4.8511 -4.8511 -4.2958 -4.2958 -4.2958 -4.2958 -4.2043 -4.2043 -4.2041 -4.2041 -3.6155 -3.6155 -3.6155 -3.6155 -1.5631 -1.5631 -1.5631 -1.5631 2.4511 2.4511 2.4513 2.4513 k =-0.4375 0.0898 0.2980 ( 7832 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2462 -8.2462 -8.2462 -8.2462 -7.0294 -7.0294 -7.0294 -7.0294 -6.2264 -6.2264 -6.2263 -6.2263 -6.0803 -6.0803 -6.0802 -6.0802 -5.5037 -5.5037 -5.5037 -5.5037 -4.8511 -4.8511 -4.8510 -4.8510 -4.2958 -4.2958 -4.2958 -4.2958 -4.2043 -4.2043 -4.2041 -4.2041 -3.6156 -3.6156 -3.6156 -3.6156 -1.5631 -1.5631 -1.5631 -1.5631 2.5062 2.5062 2.5065 2.5065 k =-0.4583 0.0941 0.2980 ( 7824 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2463 -8.2463 -8.2463 -8.2463 -7.0294 -7.0294 -7.0294 -7.0294 -6.2263 -6.2263 -6.2263 -6.2263 -6.0802 -6.0802 -6.0802 -6.0802 -5.5039 -5.5039 -5.5039 -5.5039 -4.8511 -4.8511 -4.8509 -4.8509 -4.2958 -4.2958 -4.2957 -4.2957 -4.2042 -4.2042 -4.2041 -4.2041 -3.6157 -3.6157 -3.6156 -3.6156 -1.5631 -1.5631 -1.5631 -1.5631 2.5631 2.5631 2.5633 2.5633 k =-0.4792 0.0984 0.2980 ( 7828 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2463 -8.2463 -8.2463 -8.2463 -7.0294 -7.0294 -7.0294 -7.0294 -6.2263 -6.2263 -6.2263 -6.2263 -6.0802 -6.0802 -6.0802 -6.0802 -5.5041 -5.5041 -5.5041 -5.5041 -4.8510 -4.8510 -4.8509 -4.8509 -4.2958 -4.2958 -4.2957 -4.2957 -4.2042 -4.2042 -4.2040 -4.2040 -3.6157 -3.6157 -3.6157 -3.6157 -1.5631 -1.5631 -1.5631 -1.5631 2.6208 2.6208 2.6211 2.6211 k =-0.5000 0.1026 0.2980 ( 7824 PWs) bands (ev): -20.8333 -20.8333 -20.8333 -20.8333 -19.8607 -19.8607 -19.8606 -19.8606 -8.5028 -8.5028 -8.5028 -8.5028 -8.2463 -8.2463 -8.2463 -8.2463 -7.0294 -7.0294 -7.0294 -7.0294 -6.2263 -6.2263 -6.2263 -6.2263 -6.0802 -6.0802 -6.0802 -6.0802 -5.5041 -5.5041 -5.5041 -5.5041 -4.8510 -4.8510 -4.8509 -4.8509 -4.2958 -4.2958 -4.2957 -4.2957 -4.2042 -4.2042 -4.2040 -4.2040 -3.6157 -3.6157 -3.6157 -3.6157 -1.5631 -1.5631 -1.5631 -1.5631 2.6655 2.6655 2.6655 2.6655 Writing output data file CuO2.save init_run : 3.41s CPU 13.46s WALL ( 1 calls) electrons : 1163.82s CPU 1173.97s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.54s CPU 1.70s WALL ( 1 calls) Called by electrons: c_bands : 1163.80s CPU 1173.70s WALL ( 1 calls) v_of_rho : 0.14s CPU 0.87s WALL ( 1 calls) v_h : 0.00s CPU 0.01s WALL ( 1 calls) v_xc : 0.13s CPU 0.60s WALL ( 1 calls) newd : 0.56s CPU 0.79s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.14s WALL ( 370 calls) cegterg : 1038.00s CPU 1043.54s WALL ( 907 calls) Called by sum_band: Called by *egterg: h_psi : 583.94s CPU 593.12s WALL ( 15322 calls) s_psi : 33.03s CPU 33.61s WALL ( 15322 calls) g_psi : 1.25s CPU 1.27s WALL ( 14045 calls) cdiaghg : 285.06s CPU 282.19s WALL ( 14415 calls) cegterg:over : 87.47s CPU 83.22s WALL ( 14045 calls) cegterg:upda : 26.33s CPU 30.83s WALL ( 14045 calls) cegterg:last : 19.21s CPU 19.98s WALL ( 2017 calls) Called by h_psi: h_psi:vloc : 506.90s CPU 514.42s WALL ( 15322 calls) h_psi:vnl : 76.26s CPU 77.21s WALL ( 15322 calls) add_vuspsi : 23.49s CPU 28.54s WALL ( 15322 calls) General routines calbec : 52.72s CPU 48.57s WALL ( 15322 calls) fft : 0.60s CPU 1.46s WALL ( 19 calls) ffts : 0.01s CPU 0.05s WALL ( 4 calls) fftw : 462.24s CPU 464.92s WALL ( 1367092 calls) interpolate : 0.18s CPU 0.22s WALL ( 4 calls) davcio : 0.04s CPU 8.72s WALL ( 740 calls) Parallel routines fft_scatter : 223.34s CPU 222.62s WALL ( 1367115 calls) PWSCF : 21m38.10s CPU 31m34.12s WALL This run was terminated on: 12:50:15 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=