Program PWSCF v.5.1.1 starts on 28May2015 at 23:11:45 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: ./FeGe.save/ file Fe.rel-pbe-n-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 32 25 7 971 652 104 Max 33 26 8 978 668 108 Sum 1569 1221 359 46789 31771 5051 bravais-lattice index = 14 lattice parameter (alat) = 11.7877 a.u. unit-cell volume = 754.3819 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.787672 celldm(2)= 1.000000 celldm(3)= 0.790924 celldm(4)= 0.221741 celldm(5)= 0.221741 celldm(6)= 0.800811 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.800811 0.598917 0.000000 ) a(3) = ( 0.175380 0.058328 0.769025 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.337100 -0.126640 ) b(2) = ( 0.000000 1.669682 -0.126640 ) b(3) = ( 0.000000 0.000000 1.300347 ) PseudoPot. # 1 for Ge read from file: /home/autes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 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 Fe read from file: /home/autes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 Ge 4.00 72.64000 Ge( 1.00) Fe 8.00 55.84500 Fe( 1.00) 2 Sym. Ops., with inversion, found 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= 352 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0178571 0.0059390 -0.0045229), wk = 0.0028409 k( 3) = ( 0.0357143 0.0118779 -0.0090457), wk = 0.0028409 k( 4) = ( 0.0535714 0.0178169 -0.0135686), wk = 0.0028409 k( 5) = ( 0.0714286 0.0237558 -0.0180915), wk = 0.0028409 k( 6) = ( 0.0892857 0.0296948 -0.0226143), wk = 0.0028409 k( 7) = ( 0.1071429 0.0356337 -0.0271372), wk = 0.0028409 k( 8) = ( 0.1250000 0.0415727 -0.0316601), wk = 0.0028409 k( 9) = ( 0.1428571 0.0475116 -0.0361829), wk = 0.0028409 k( 10) = ( 0.1607143 0.0534506 -0.0407058), wk = 0.0028409 k( 11) = ( 0.1785714 0.0593896 -0.0452287), wk = 0.0028409 k( 12) = ( 0.1964286 0.0653285 -0.0497515), wk = 0.0028409 k( 13) = ( 0.2142857 0.0712675 -0.0542744), wk = 0.0028409 k( 14) = ( 0.2321429 0.0772064 -0.0587973), wk = 0.0028409 k( 15) = ( 0.2500000 0.0831454 -0.0633201), wk = 0.0028409 k( 16) = ( 0.2678571 0.0890843 -0.0678430), wk = 0.0028409 k( 17) = ( 0.2857143 0.0950233 -0.0723659), wk = 0.0028409 k( 18) = ( 0.3035714 0.1009622 -0.0768887), wk = 0.0028409 k( 19) = ( 0.3214286 0.1069012 -0.0814116), wk = 0.0028409 k( 20) = ( 0.3392857 0.1128402 -0.0859345), wk = 0.0028409 k( 21) = ( 0.3571429 0.1187791 -0.0904573), wk = 0.0028409 k( 22) = ( 0.3750000 0.1247181 -0.0949802), wk = 0.0028409 k( 23) = ( 0.3928571 0.1306570 -0.0995031), wk = 0.0028409 k( 24) = ( 0.4107143 0.1365960 -0.1040260), wk = 0.0028409 k( 25) = ( 0.4285714 0.1425349 -0.1085488), wk = 0.0028409 k( 26) = ( 0.4464286 0.1484739 -0.1130717), wk = 0.0028409 k( 27) = ( 0.4642857 0.1544128 -0.1175946), wk = 0.0028409 k( 28) = ( 0.4821429 0.1603518 -0.1221174), wk = 0.0028409 k( 29) = ( 0.5000000 0.1662908 -0.1266403), wk = 0.0028409 k( 30) = ( 0.5000000 0.1662908 -0.1266403), wk = 0.0028409 k( 31) = ( 0.5042641 0.1677089 -0.1079427), wk = 0.0028409 k( 32) = ( 0.5085282 0.1691271 -0.0892451), wk = 0.0028409 k( 33) = ( 0.5127923 0.1705452 -0.0705474), wk = 0.0028409 k( 34) = ( 0.5170564 0.1719634 -0.0518498), wk = 0.0028409 k( 35) = ( 0.5213205 0.1733815 -0.0331522), wk = 0.0028409 k( 36) = ( 0.5255845 0.1747997 -0.0144546), wk = 0.0028409 k( 37) = ( 0.5298486 0.1762179 0.0042430), wk = 0.0028409 k( 38) = ( 0.5341127 0.1776360 0.0229406), wk = 0.0028409 k( 39) = ( 0.5383768 0.1790542 0.0416382), wk = 0.0028409 k( 40) = ( 0.5426409 0.1804723 0.0603359), wk = 0.0028409 k( 41) = ( 0.5469050 0.1818905 0.0790335), wk = 0.0028409 k( 42) = ( 0.5511691 0.1833086 0.0977311), wk = 0.0028409 k( 43) = ( 0.5554332 0.1847268 0.1164287), wk = 0.0028409 k( 44) = ( 0.5596973 0.1861450 0.1351263), wk = 0.0028409 k( 45) = ( 0.5639614 0.1875631 0.1538239), wk = 0.0028409 k( 46) = ( 0.5682254 0.1889813 0.1725216), wk = 0.0028409 k( 47) = ( 0.5724895 0.1903994 0.1912192), wk = 0.0028409 k( 48) = ( 0.5767536 0.1918176 0.2099168), wk = 0.0028409 k( 49) = ( 0.5810177 0.1932357 0.2286144), wk = 0.0028409 k( 50) = ( 0.5852818 0.1946539 0.2473120), wk = 0.0028409 k( 51) = ( 0.5895459 0.1960721 0.2660096), wk = 0.0028409 k( 52) = ( 0.5938100 0.1974902 0.2847072), wk = 0.0028409 k( 53) = ( 0.5980741 0.1989084 0.3034049), wk = 0.0028409 k( 54) = ( 0.6023382 0.2003265 0.3221025), wk = 0.0028409 k( 55) = ( 0.6066022 0.2017447 0.3408001), wk = 0.0028409 k( 56) = ( 0.6108663 0.2031629 0.3594977), wk = 0.0028409 k( 57) = ( 0.6151304 0.2045810 0.3781953), wk = 0.0028409 k( 58) = ( 0.6193945 0.2059992 0.3968929), wk = 0.0028409 k( 59) = ( 0.6193945 0.2059992 0.3968929), wk = 0.0028409 k( 60) = ( 0.6061285 0.2015871 0.4109641), wk = 0.0028409 k( 61) = ( 0.5928624 0.1971751 0.4250352), wk = 0.0028409 k( 62) = ( 0.5795963 0.1927630 0.4391064), wk = 0.0028409 k( 63) = ( 0.5663303 0.1883510 0.4531775), wk = 0.0028409 k( 64) = ( 0.5530642 0.1839389 0.4672486), wk = 0.0028409 k( 65) = ( 0.5397982 0.1795269 0.4813198), wk = 0.0028409 k( 66) = ( 0.5265321 0.1751148 0.4953909), wk = 0.0028409 k( 67) = ( 0.5132661 0.1707028 0.5094621), wk = 0.0028409 k( 68) = ( 0.5000000 0.1662908 0.5235332), wk = 0.0028409 k( 69) = ( 0.5000000 0.1662908 0.5235332), wk = 0.0028409 k( 70) = ( 0.5062408 0.1475260 0.5235332), wk = 0.0028409 k( 71) = ( 0.5124816 0.1287612 0.5235332), wk = 0.0028409 k( 72) = ( 0.5187224 0.1099965 0.5235332), wk = 0.0028409 k( 73) = ( 0.5249633 0.0912317 0.5235332), wk = 0.0028409 k( 74) = ( 0.5312041 0.0724669 0.5235332), wk = 0.0028409 k( 75) = ( 0.5374449 0.0537022 0.5235332), wk = 0.0028409 k( 76) = ( 0.5436857 0.0349374 0.5235332), wk = 0.0028409 k( 77) = ( 0.5499265 0.0161726 0.5235332), wk = 0.0028409 k( 78) = ( 0.5561673 -0.0025921 0.5235332), wk = 0.0028409 k( 79) = ( 0.5624081 -0.0213569 0.5235332), wk = 0.0028409 k( 80) = ( 0.5686490 -0.0401217 0.5235332), wk = 0.0028409 k( 81) = ( 0.5748898 -0.0588864 0.5235332), wk = 0.0028409 k( 82) = ( 0.5811306 -0.0776512 0.5235332), wk = 0.0028409 k( 83) = ( 0.5873714 -0.0964160 0.5235332), wk = 0.0028409 k( 84) = ( 0.5936122 -0.1151807 0.5235332), wk = 0.0028409 k( 85) = ( 0.5998530 -0.1339455 0.5235332), wk = 0.0028409 k( 86) = ( 0.6060938 -0.1527103 0.5235332), wk = 0.0028409 k( 87) = ( 0.6123346 -0.1714750 0.5235332), wk = 0.0028409 k( 88) = ( 0.6185755 -0.1902398 0.5235332), wk = 0.0028409 k( 89) = ( 0.6248163 -0.2090045 0.5235332), wk = 0.0028409 k( 90) = ( 0.6310571 -0.2277693 0.5235332), wk = 0.0028409 k( 91) = ( 0.6372979 -0.2465341 0.5235332), wk = 0.0028409 k( 92) = ( 0.6435387 -0.2652988 0.5235332), wk = 0.0028409 k( 93) = ( 0.6497795 -0.2840636 0.5235332), wk = 0.0028409 k( 94) = ( 0.6560204 -0.3028284 0.5235332), wk = 0.0028409 k( 95) = ( 0.6622612 -0.3215931 0.5235332), wk = 0.0028409 k( 96) = ( 0.6685020 -0.3403579 0.5235332), wk = 0.0028409 k( 97) = ( 0.6747428 -0.3591227 0.5235332), wk = 0.0028409 k( 98) = ( 0.6809836 -0.3778874 0.5235332), wk = 0.0028409 k( 99) = ( 0.6872244 -0.3966522 0.5235332), wk = 0.0028409 k( 100) = ( 0.6934652 -0.4154170 0.5235332), wk = 0.0028409 k( 101) = ( 0.6997060 -0.4341817 0.5235332), wk = 0.0028409 k( 102) = ( 0.7059469 -0.4529465 0.5235332), wk = 0.0028409 k( 103) = ( 0.7121877 -0.4717113 0.5235332), wk = 0.0028409 k( 104) = ( 0.7184285 -0.4904760 0.5235332), wk = 0.0028409 k( 105) = ( 0.7246693 -0.5092408 0.5235332), wk = 0.0028409 k( 106) = ( 0.7309101 -0.5280056 0.5235332), wk = 0.0028409 k( 107) = ( 0.7371509 -0.5467703 0.5235332), wk = 0.0028409 k( 108) = ( 0.2628491 -0.7903297 0.6501735), wk = 0.0028409 k( 109) = ( 0.2565907 -0.7715124 0.6501735), wk = 0.0028409 k( 110) = ( 0.2503324 -0.7526950 0.6501735), wk = 0.0028409 k( 111) = ( 0.2440741 -0.7338776 0.6501735), wk = 0.0028409 k( 112) = ( 0.2378158 -0.7150602 0.6501735), wk = 0.0028409 k( 113) = ( 0.2315575 -0.6962429 0.6501735), wk = 0.0028409 k( 114) = ( 0.2252992 -0.6774255 0.6501735), wk = 0.0028409 k( 115) = ( 0.2190409 -0.6586081 0.6501735), wk = 0.0028409 k( 116) = ( 0.2127826 -0.6397908 0.6501735), wk = 0.0028409 k( 117) = ( 0.2065243 -0.6209734 0.6501735), wk = 0.0028409 k( 118) = ( 0.2002659 -0.6021560 0.6501735), wk = 0.0028409 k( 119) = ( 0.1940076 -0.5833386 0.6501735), wk = 0.0028409 k( 120) = ( 0.1877493 -0.5645212 0.6501735), wk = 0.0028409 k( 121) = ( 0.1814910 -0.5457039 0.6501735), wk = 0.0028409 k( 122) = ( 0.1752327 -0.5268865 0.6501735), wk = 0.0028409 k( 123) = ( 0.1689744 -0.5080691 0.6501735), wk = 0.0028409 k( 124) = ( 0.1627161 -0.4892518 0.6501735), wk = 0.0028409 k( 125) = ( 0.1564578 -0.4704344 0.6501735), wk = 0.0028409 k( 126) = ( 0.1501995 -0.4516170 0.6501735), wk = 0.0028409 k( 127) = ( 0.1439411 -0.4327996 0.6501735), wk = 0.0028409 k( 128) = ( 0.1376828 -0.4139822 0.6501735), wk = 0.0028409 k( 129) = ( 0.1314245 -0.3951649 0.6501735), wk = 0.0028409 k( 130) = ( 0.1251662 -0.3763475 0.6501735), wk = 0.0028409 k( 131) = ( 0.1189079 -0.3575301 0.6501735), wk = 0.0028409 k( 132) = ( 0.1126496 -0.3387127 0.6501735), wk = 0.0028409 k( 133) = ( 0.1063913 -0.3198954 0.6501735), wk = 0.0028409 k( 134) = ( 0.1001330 -0.3010780 0.6501735), wk = 0.0028409 k( 135) = ( 0.0938747 -0.2822606 0.6501735), wk = 0.0028409 k( 136) = ( 0.0876163 -0.2634432 0.6501735), wk = 0.0028409 k( 137) = ( 0.0813580 -0.2446259 0.6501735), wk = 0.0028409 k( 138) = ( 0.0750997 -0.2258085 0.6501735), wk = 0.0028409 k( 139) = ( 0.0688414 -0.2069911 0.6501735), wk = 0.0028409 k( 140) = ( 0.0625831 -0.1881737 0.6501735), wk = 0.0028409 k( 141) = ( 0.0563248 -0.1693564 0.6501735), wk = 0.0028409 k( 142) = ( 0.0500665 -0.1505390 0.6501735), wk = 0.0028409 k( 143) = ( 0.0438082 -0.1317216 0.6501735), wk = 0.0028409 k( 144) = ( 0.0375499 -0.1129043 0.6501735), wk = 0.0028409 k( 145) = ( 0.0312916 -0.0940869 0.6501735), wk = 0.0028409 k( 146) = ( 0.0250332 -0.0752695 0.6501735), wk = 0.0028409 k( 147) = ( 0.0187749 -0.0564521 0.6501735), wk = 0.0028409 k( 148) = ( 0.0125166 -0.0376347 0.6501735), wk = 0.0028409 k( 149) = ( 0.0062583 -0.0188174 0.6501735), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.6501735), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.6501735), wk = 0.0028409 k( 152) = ( 0.0181241 0.0060277 0.6501735), wk = 0.0028409 k( 153) = ( 0.0362481 0.0120555 0.6501735), wk = 0.0028409 k( 154) = ( 0.0543722 0.0180832 0.6501735), wk = 0.0028409 k( 155) = ( 0.0724963 0.0241109 0.6501735), wk = 0.0028409 k( 156) = ( 0.0906204 0.0301387 0.6501735), wk = 0.0028409 k( 157) = ( 0.1087444 0.0361664 0.6501735), wk = 0.0028409 k( 158) = ( 0.1268685 0.0421941 0.6501735), wk = 0.0028409 k( 159) = ( 0.1449926 0.0482218 0.6501735), wk = 0.0028409 k( 160) = ( 0.1631166 0.0542496 0.6501735), wk = 0.0028409 k( 161) = ( 0.1812407 0.0602773 0.6501735), wk = 0.0028409 k( 162) = ( 0.1993648 0.0663050 0.6501735), wk = 0.0028409 k( 163) = ( 0.2174889 0.0723328 0.6501735), wk = 0.0028409 k( 164) = ( 0.2356129 0.0783605 0.6501735), wk = 0.0028409 k( 165) = ( 0.2537370 0.0843882 0.6501735), wk = 0.0028409 k( 166) = ( 0.2718611 0.0904160 0.6501735), wk = 0.0028409 k( 167) = ( 0.2899851 0.0964437 0.6501735), wk = 0.0028409 k( 168) = ( 0.3081092 0.1024714 0.6501735), wk = 0.0028409 k( 169) = ( 0.3262333 0.1084992 0.6501735), wk = 0.0028409 k( 170) = ( 0.3443574 0.1145269 0.6501735), wk = 0.0028409 k( 171) = ( 0.3624814 0.1205546 0.6501735), wk = 0.0028409 k( 172) = ( 0.3806055 0.1265824 0.6501735), wk = 0.0028409 k( 173) = ( 0.5000000 0.1662908 -0.1266403), wk = 0.0028409 k( 174) = ( 0.5061319 0.1478533 -0.1266403), wk = 0.0028409 k( 175) = ( 0.5122639 0.1294159 -0.1266403), wk = 0.0028409 k( 176) = ( 0.5183958 0.1109785 -0.1266403), wk = 0.0028409 k( 177) = ( 0.5245278 0.0925410 -0.1266403), wk = 0.0028409 k( 178) = ( 0.5306597 0.0741036 -0.1266403), wk = 0.0028409 k( 179) = ( 0.5367917 0.0556662 -0.1266403), wk = 0.0028409 k( 180) = ( 0.5429236 0.0372288 -0.1266403), wk = 0.0028409 k( 181) = ( 0.5490556 0.0187913 -0.1266403), wk = 0.0028409 k( 182) = ( 0.5551875 0.0003539 -0.1266403), wk = 0.0028409 k( 183) = ( 0.5613195 -0.0180835 -0.1266403), wk = 0.0028409 k( 184) = ( 0.5674514 -0.0365209 -0.1266403), wk = 0.0028409 k( 185) = ( 0.5735834 -0.0549584 -0.1266403), wk = 0.0028409 k( 186) = ( 0.5797153 -0.0733958 -0.1266403), wk = 0.0028409 k( 187) = ( 0.5858473 -0.0918332 -0.1266403), wk = 0.0028409 k( 188) = ( 0.5919792 -0.1102706 -0.1266403), wk = 0.0028409 k( 189) = ( 0.5981112 -0.1287081 -0.1266403), wk = 0.0028409 k( 190) = ( 0.6042431 -0.1471455 -0.1266403), wk = 0.0028409 k( 191) = ( 0.6103751 -0.1655829 -0.1266403), wk = 0.0028409 k( 192) = ( 0.6165070 -0.1840204 -0.1266403), wk = 0.0028409 k( 193) = ( 0.6226390 -0.2024578 -0.1266403), wk = 0.0028409 k( 194) = ( 0.6287709 -0.2208952 -0.1266403), wk = 0.0028409 k( 195) = ( 0.6349029 -0.2393327 -0.1266403), wk = 0.0028409 k( 196) = ( 0.6410348 -0.2577701 -0.1266403), wk = 0.0028409 k( 197) = ( 0.6471667 -0.2762075 -0.1266403), wk = 0.0028409 k( 198) = ( 0.6532987 -0.2946449 -0.1266403), wk = 0.0028409 k( 199) = ( 0.6594306 -0.3130824 -0.1266403), wk = 0.0028409 k( 200) = ( 0.6655626 -0.3315198 -0.1266403), wk = 0.0028409 k( 201) = ( 0.6716945 -0.3499572 -0.1266403), wk = 0.0028409 k( 202) = ( 0.6778265 -0.3683946 -0.1266403), wk = 0.0028409 k( 203) = ( 0.6839584 -0.3868321 -0.1266403), wk = 0.0028409 k( 204) = ( 0.6900904 -0.4052695 -0.1266403), wk = 0.0028409 k( 205) = ( 0.6962223 -0.4237069 -0.1266403), wk = 0.0028409 k( 206) = ( 0.7023543 -0.4421443 -0.1266403), wk = 0.0028409 k( 207) = ( 0.7084862 -0.4605818 -0.1266403), wk = 0.0028409 k( 208) = ( 0.7146182 -0.4790192 -0.1266403), wk = 0.0028409 k( 209) = ( 0.7207501 -0.4974566 -0.1266403), wk = 0.0028409 k( 210) = ( 0.2792499 -0.8396434 -0.0000000), wk = 0.0028409 k( 211) = ( 0.2730443 -0.8209847 -0.0000000), wk = 0.0028409 k( 212) = ( 0.2668388 -0.8023259 -0.0000000), wk = 0.0028409 k( 213) = ( 0.2606332 -0.7836672 -0.0000000), wk = 0.0028409 k( 214) = ( 0.2544277 -0.7650084 -0.0000000), wk = 0.0028409 k( 215) = ( 0.2482221 -0.7463497 -0.0000000), wk = 0.0028409 k( 216) = ( 0.2420166 -0.7276910 -0.0000000), wk = 0.0028409 k( 217) = ( 0.2358110 -0.7090322 -0.0000000), wk = 0.0028409 k( 218) = ( 0.2296055 -0.6903735 -0.0000000), wk = 0.0028409 k( 219) = ( 0.2233999 -0.6717147 -0.0000000), wk = 0.0028409 k( 220) = ( 0.2171944 -0.6530560 -0.0000000), wk = 0.0028409 k( 221) = ( 0.2109888 -0.6343973 -0.0000000), wk = 0.0028409 k( 222) = ( 0.2047833 -0.6157385 -0.0000000), wk = 0.0028409 k( 223) = ( 0.1985777 -0.5970798 -0.0000000), wk = 0.0028409 k( 224) = ( 0.1923721 -0.5784210 -0.0000000), wk = 0.0028409 k( 225) = ( 0.1861666 -0.5597623 -0.0000000), wk = 0.0028409 k( 226) = ( 0.1799610 -0.5411036 -0.0000000), wk = 0.0028409 k( 227) = ( 0.1737555 -0.5224448 -0.0000000), wk = 0.0028409 k( 228) = ( 0.1675499 -0.5037861 -0.0000000), wk = 0.0028409 k( 229) = ( 0.1613444 -0.4851273 -0.0000000), wk = 0.0028409 k( 230) = ( 0.1551388 -0.4664686 -0.0000000), wk = 0.0028409 k( 231) = ( 0.1489333 -0.4478098 -0.0000000), wk = 0.0028409 k( 232) = ( 0.1427277 -0.4291511 -0.0000000), wk = 0.0028409 k( 233) = ( 0.1365222 -0.4104924 -0.0000000), wk = 0.0028409 k( 234) = ( 0.1303166 -0.3918336 -0.0000000), wk = 0.0028409 k( 235) = ( 0.1241111 -0.3731749 -0.0000000), wk = 0.0028409 k( 236) = ( 0.1179055 -0.3545161 -0.0000000), wk = 0.0028409 k( 237) = ( 0.1117000 -0.3358574 -0.0000000), wk = 0.0028409 k( 238) = ( 0.1054944 -0.3171986 -0.0000000), wk = 0.0028409 k( 239) = ( 0.0992888 -0.2985399 -0.0000000), wk = 0.0028409 k( 240) = ( 0.0930833 -0.2798812 -0.0000000), wk = 0.0028409 k( 241) = ( 0.0868777 -0.2612224 -0.0000000), wk = 0.0028409 k( 242) = ( 0.0806722 -0.2425637 -0.0000000), wk = 0.0028409 k( 243) = ( 0.0744666 -0.2239049 -0.0000000), wk = 0.0028409 k( 244) = ( 0.0682611 -0.2052462 -0.0000000), wk = 0.0028409 k( 245) = ( 0.0620555 -0.1865874 -0.0000000), wk = 0.0028409 k( 246) = ( 0.0558500 -0.1679287 -0.0000000), wk = 0.0028409 k( 247) = ( 0.0496444 -0.1492699 -0.0000000), wk = 0.0028409 k( 248) = ( 0.0434389 -0.1306112 -0.0000000), wk = 0.0028409 k( 249) = ( 0.0372333 -0.1119525 -0.0000000), wk = 0.0028409 k( 250) = ( 0.0310278 -0.0932937 -0.0000000), wk = 0.0028409 k( 251) = ( 0.0248222 -0.0746350 -0.0000000), wk = 0.0028409 k( 252) = ( 0.0186167 -0.0559762 -0.0000000), wk = 0.0028409 k( 253) = ( 0.0124111 -0.0373175 -0.0000000), wk = 0.0028409 k( 254) = ( 0.0062055 -0.0186587 -0.0000000), wk = 0.0028409 k( 255) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 256) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 257) = ( 0.0116279 -0.0155477 -0.0014726), wk = 0.0028409 k( 258) = ( 0.0232558 -0.0310953 -0.0029451), wk = 0.0028409 k( 259) = ( 0.0348837 -0.0466430 -0.0044177), wk = 0.0028409 k( 260) = ( 0.0465116 -0.0621907 -0.0058902), wk = 0.0028409 k( 261) = ( 0.0581395 -0.0777384 -0.0073628), wk = 0.0028409 k( 262) = ( 0.0697674 -0.0932860 -0.0088354), wk = 0.0028409 k( 263) = ( 0.0813954 -0.1088337 -0.0103079), wk = 0.0028409 k( 264) = ( 0.0930233 -0.1243814 -0.0117805), wk = 0.0028409 k( 265) = ( 0.1046512 -0.1399291 -0.0132531), wk = 0.0028409 k( 266) = ( 0.1162791 -0.1554768 -0.0147256), wk = 0.0028409 k( 267) = ( 0.1279070 -0.1710244 -0.0161982), wk = 0.0028409 k( 268) = ( 0.1395349 -0.1865721 -0.0176707), wk = 0.0028409 k( 269) = ( 0.1511628 -0.2021198 -0.0191433), wk = 0.0028409 k( 270) = ( 0.1627907 -0.2176675 -0.0206159), wk = 0.0028409 k( 271) = ( 0.1744186 -0.2332151 -0.0220884), wk = 0.0028409 k( 272) = ( 0.1860465 -0.2487628 -0.0235610), wk = 0.0028409 k( 273) = ( 0.1976744 -0.2643105 -0.0250335), wk = 0.0028409 k( 274) = ( 0.2093023 -0.2798582 -0.0265061), wk = 0.0028409 k( 275) = ( 0.2209302 -0.2954058 -0.0279787), wk = 0.0028409 k( 276) = ( 0.2325581 -0.3109535 -0.0294512), wk = 0.0028409 k( 277) = ( 0.2441860 -0.3265012 -0.0309238), wk = 0.0028409 k( 278) = ( 0.2558140 -0.3420488 -0.0323964), wk = 0.0028409 k( 279) = ( 0.2674419 -0.3575965 -0.0338689), wk = 0.0028409 k( 280) = ( 0.2790698 -0.3731442 -0.0353415), wk = 0.0028409 k( 281) = ( 0.2906977 -0.3886919 -0.0368140), wk = 0.0028409 k( 282) = ( 0.3023256 -0.4042396 -0.0382866), wk = 0.0028409 k( 283) = ( 0.3139535 -0.4197872 -0.0397592), wk = 0.0028409 k( 284) = ( 0.3255814 -0.4353349 -0.0412317), wk = 0.0028409 k( 285) = ( 0.3372093 -0.4508826 -0.0427043), wk = 0.0028409 k( 286) = ( 0.3488372 -0.4664303 -0.0441768), wk = 0.0028409 k( 287) = ( 0.3604651 -0.4819779 -0.0456494), wk = 0.0028409 k( 288) = ( 0.3720930 -0.4975256 -0.0471220), wk = 0.0028409 k( 289) = ( 0.3837209 -0.5130733 -0.0485945), wk = 0.0028409 k( 290) = ( 0.3953488 -0.5286210 -0.0500671), wk = 0.0028409 k( 291) = ( 0.4069767 -0.5441686 -0.0515397), wk = 0.0028409 k( 292) = ( 0.4186047 -0.5597163 -0.0530122), wk = 0.0028409 k( 293) = ( 0.4302326 -0.5752640 -0.0544848), wk = 0.0028409 k( 294) = ( 0.4418605 -0.5908117 -0.0559573), wk = 0.0028409 k( 295) = ( 0.4534884 -0.6063593 -0.0574299), wk = 0.0028409 k( 296) = ( 0.4651163 -0.6219070 -0.0589025), wk = 0.0028409 k( 297) = ( 0.4767442 -0.6374547 -0.0603750), wk = 0.0028409 k( 298) = ( 0.4883721 -0.6530024 -0.0618476), wk = 0.0028409 k( 299) = ( 0.5000000 -0.6685500 -0.0633201), wk = 0.0028409 k( 300) = ( 0.5000000 -0.6685500 0.5868534), wk = 0.0028409 k( 301) = ( 0.4903846 -0.6556933 0.5755677), wk = 0.0028409 k( 302) = ( 0.4807692 -0.6428366 0.5642821), wk = 0.0028409 k( 303) = ( 0.4711538 -0.6299798 0.5529964), wk = 0.0028409 k( 304) = ( 0.4615385 -0.6171231 0.5417108), wk = 0.0028409 k( 305) = ( 0.4519231 -0.6042664 0.5304252), wk = 0.0028409 k( 306) = ( 0.4423077 -0.5914096 0.5191395), wk = 0.0028409 k( 307) = ( 0.4326923 -0.5785529 0.5078539), wk = 0.0028409 k( 308) = ( 0.4230769 -0.5656962 0.4965682), wk = 0.0028409 k( 309) = ( 0.4134615 -0.5528395 0.4852826), wk = 0.0028409 k( 310) = ( 0.4038462 -0.5399827 0.4739969), wk = 0.0028409 k( 311) = ( 0.3942308 -0.5271260 0.4627113), wk = 0.0028409 k( 312) = ( 0.3846154 -0.5142692 0.4514257), wk = 0.0028409 k( 313) = ( 0.3750000 -0.5014125 0.4401400), wk = 0.0028409 k( 314) = ( 0.3653846 -0.4885558 0.4288544), wk = 0.0028409 k( 315) = ( 0.3557692 -0.4756991 0.4175687), wk = 0.0028409 k( 316) = ( 0.3461538 -0.4628423 0.4062831), wk = 0.0028409 k( 317) = ( 0.3365385 -0.4499856 0.3949974), wk = 0.0028409 k( 318) = ( 0.3269231 -0.4371289 0.3837118), wk = 0.0028409 k( 319) = ( 0.3173077 -0.4242721 0.3724262), wk = 0.0028409 k( 320) = ( 0.3076923 -0.4114154 0.3611405), wk = 0.0028409 k( 321) = ( 0.2980769 -0.3985587 0.3498549), wk = 0.0028409 k( 322) = ( 0.2884615 -0.3857019 0.3385692), wk = 0.0028409 k( 323) = ( 0.2788462 -0.3728452 0.3272836), wk = 0.0028409 k( 324) = ( 0.2692308 -0.3599885 0.3159980), wk = 0.0028409 k( 325) = ( 0.2596154 -0.3471317 0.3047123), wk = 0.0028409 k( 326) = ( 0.2500000 -0.3342750 0.2934267), wk = 0.0028409 k( 327) = ( 0.2403846 -0.3214183 0.2821410), wk = 0.0028409 k( 328) = ( 0.2307692 -0.3085616 0.2708554), wk = 0.0028409 k( 329) = ( 0.2211539 -0.2957048 0.2595698), wk = 0.0028409 k( 330) = ( 0.2115385 -0.2828481 0.2482841), wk = 0.0028409 k( 331) = ( 0.2019231 -0.2699914 0.2369985), wk = 0.0028409 k( 332) = ( 0.1923077 -0.2571346 0.2257128), wk = 0.0028409 k( 333) = ( 0.1826923 -0.2442779 0.2144272), wk = 0.0028409 k( 334) = ( 0.1730769 -0.2314212 0.2031415), wk = 0.0028409 k( 335) = ( 0.1634615 -0.2185644 0.1918559), wk = 0.0028409 k( 336) = ( 0.1538461 -0.2057077 0.1805703), wk = 0.0028409 k( 337) = ( 0.1442308 -0.1928510 0.1692846), wk = 0.0028409 k( 338) = ( 0.1346154 -0.1799942 0.1579990), wk = 0.0028409 k( 339) = ( 0.1250000 -0.1671375 0.1467133), wk = 0.0028409 k( 340) = ( 0.1153846 -0.1542808 0.1354277), wk = 0.0028409 k( 341) = ( 0.1057692 -0.1414240 0.1241421), wk = 0.0028409 k( 342) = ( 0.0961538 -0.1285673 0.1128564), wk = 0.0028409 k( 343) = ( 0.0865385 -0.1157106 0.1015708), wk = 0.0028409 k( 344) = ( 0.0769231 -0.1028539 0.0902851), wk = 0.0028409 k( 345) = ( 0.0673077 -0.0899971 0.0789995), wk = 0.0028409 k( 346) = ( 0.0576923 -0.0771404 0.0677139), wk = 0.0028409 k( 347) = ( 0.0480769 -0.0642837 0.0564282), wk = 0.0028409 k( 348) = ( 0.0384615 -0.0514269 0.0451426), wk = 0.0028409 k( 349) = ( 0.0288462 -0.0385702 0.0338569), wk = 0.0028409 k( 350) = ( 0.0192308 -0.0257135 0.0225713), wk = 0.0028409 k( 351) = ( 0.0096154 -0.0128567 0.0112856), wk = 0.0028409 k( 352) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 2) = ( 0.0178571 0.0178571 0.0000000), wk = 0.0028409 k( 3) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0028409 k( 4) = ( 0.0535714 0.0535714 0.0000000), wk = 0.0028409 k( 5) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0028409 k( 6) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0028409 k( 7) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0028409 k( 8) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0028409 k( 9) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0028409 k( 10) = ( 0.1607143 0.1607143 0.0000000), wk = 0.0028409 k( 11) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0028409 k( 12) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0028409 k( 13) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0028409 k( 14) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0028409 k( 15) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0028409 k( 16) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0028409 k( 17) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0028409 k( 18) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0028409 k( 19) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0028409 k( 20) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0028409 k( 21) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0028409 k( 22) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0028409 k( 23) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0028409 k( 24) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0028409 k( 25) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0028409 k( 26) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0028409 k( 27) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0028409 k( 28) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0028409 k( 29) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 30) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 31) = ( 0.5042641 0.5042641 0.0152095), wk = 0.0028409 k( 32) = ( 0.5085282 0.5085282 0.0304190), wk = 0.0028409 k( 33) = ( 0.5127923 0.5127923 0.0456285), wk = 0.0028409 k( 34) = ( 0.5170564 0.5170564 0.0608380), wk = 0.0028409 k( 35) = ( 0.5213205 0.5213205 0.0760475), wk = 0.0028409 k( 36) = ( 0.5255845 0.5255845 0.0912570), wk = 0.0028409 k( 37) = ( 0.5298486 0.5298486 0.1064665), wk = 0.0028409 k( 38) = ( 0.5341127 0.5341127 0.1216760), wk = 0.0028409 k( 39) = ( 0.5383768 0.5383768 0.1368855), wk = 0.0028409 k( 40) = ( 0.5426409 0.5426409 0.1520950), wk = 0.0028409 k( 41) = ( 0.5469050 0.5469050 0.1673045), wk = 0.0028409 k( 42) = ( 0.5511691 0.5511691 0.1825140), wk = 0.0028409 k( 43) = ( 0.5554332 0.5554332 0.1977235), wk = 0.0028409 k( 44) = ( 0.5596973 0.5596973 0.2129330), wk = 0.0028409 k( 45) = ( 0.5639614 0.5639614 0.2281425), wk = 0.0028409 k( 46) = ( 0.5682254 0.5682254 0.2433520), wk = 0.0028409 k( 47) = ( 0.5724895 0.5724895 0.2585615), wk = 0.0028409 k( 48) = ( 0.5767536 0.5767536 0.2737710), wk = 0.0028409 k( 49) = ( 0.5810177 0.5810177 0.2889805), wk = 0.0028409 k( 50) = ( 0.5852818 0.5852818 0.3041900), wk = 0.0028409 k( 51) = ( 0.5895459 0.5895459 0.3193995), wk = 0.0028409 k( 52) = ( 0.5938100 0.5938100 0.3346090), wk = 0.0028409 k( 53) = ( 0.5980741 0.5980741 0.3498185), wk = 0.0028409 k( 54) = ( 0.6023382 0.6023381 0.3650280), wk = 0.0028409 k( 55) = ( 0.6066022 0.6066022 0.3802375), wk = 0.0028409 k( 56) = ( 0.6108663 0.6108663 0.3954470), wk = 0.0028409 k( 57) = ( 0.6151304 0.6151304 0.4106565), wk = 0.0028409 k( 58) = ( 0.6193945 0.6193945 0.4258660), wk = 0.0028409 k( 59) = ( 0.6193945 0.6193945 0.4258660), wk = 0.0028409 k( 60) = ( 0.6061285 0.6061284 0.4341031), wk = 0.0028409 k( 61) = ( 0.5928624 0.5928624 0.4423402), wk = 0.0028409 k( 62) = ( 0.5795963 0.5795963 0.4505773), wk = 0.0028409 k( 63) = ( 0.5663303 0.5663303 0.4588144), wk = 0.0028409 k( 64) = ( 0.5530642 0.5530642 0.4670515), wk = 0.0028409 k( 65) = ( 0.5397982 0.5397982 0.4752886), wk = 0.0028409 k( 66) = ( 0.5265321 0.5265321 0.4835258), wk = 0.0028409 k( 67) = ( 0.5132661 0.5132661 0.4917629), wk = 0.0028409 k( 68) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 69) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028409 k( 70) = ( 0.5062408 0.4937592 0.5000000), wk = 0.0028409 k( 71) = ( 0.5124816 0.4875184 0.5000000), wk = 0.0028409 k( 72) = ( 0.5187224 0.4812776 0.5000000), wk = 0.0028409 k( 73) = ( 0.5249633 0.4750367 0.5000000), wk = 0.0028409 k( 74) = ( 0.5312041 0.4687959 0.5000000), wk = 0.0028409 k( 75) = ( 0.5374449 0.4625551 0.5000000), wk = 0.0028409 k( 76) = ( 0.5436857 0.4563143 0.5000000), wk = 0.0028409 k( 77) = ( 0.5499265 0.4500735 0.5000000), wk = 0.0028409 k( 78) = ( 0.5561673 0.4438327 0.5000000), wk = 0.0028409 k( 79) = ( 0.5624081 0.4375919 0.5000000), wk = 0.0028409 k( 80) = ( 0.5686490 0.4313510 0.5000000), wk = 0.0028409 k( 81) = ( 0.5748898 0.4251102 0.5000000), wk = 0.0028409 k( 82) = ( 0.5811306 0.4188694 0.5000000), wk = 0.0028409 k( 83) = ( 0.5873714 0.4126286 0.5000000), wk = 0.0028409 k( 84) = ( 0.5936122 0.4063878 0.5000000), wk = 0.0028409 k( 85) = ( 0.5998530 0.4001470 0.5000000), wk = 0.0028409 k( 86) = ( 0.6060938 0.3939062 0.5000000), wk = 0.0028409 k( 87) = ( 0.6123346 0.3876654 0.5000000), wk = 0.0028409 k( 88) = ( 0.6185755 0.3814245 0.5000000), wk = 0.0028409 k( 89) = ( 0.6248163 0.3751837 0.5000000), wk = 0.0028409 k( 90) = ( 0.6310571 0.3689429 0.5000000), wk = 0.0028409 k( 91) = ( 0.6372979 0.3627021 0.5000000), wk = 0.0028409 k( 92) = ( 0.6435387 0.3564613 0.5000000), wk = 0.0028409 k( 93) = ( 0.6497795 0.3502205 0.5000000), wk = 0.0028409 k( 94) = ( 0.6560204 0.3439796 0.5000000), wk = 0.0028409 k( 95) = ( 0.6622612 0.3377388 0.5000000), wk = 0.0028409 k( 96) = ( 0.6685020 0.3314980 0.5000000), wk = 0.0028409 k( 97) = ( 0.6747428 0.3252572 0.5000000), wk = 0.0028409 k( 98) = ( 0.6809836 0.3190164 0.5000000), wk = 0.0028409 k( 99) = ( 0.6872244 0.3127756 0.5000000), wk = 0.0028409 k( 100) = ( 0.6934652 0.3065348 0.5000000), wk = 0.0028409 k( 101) = ( 0.6997060 0.3002939 0.5000000), wk = 0.0028409 k( 102) = ( 0.7059469 0.2940531 0.5000000), wk = 0.0028409 k( 103) = ( 0.7121877 0.2878123 0.5000000), wk = 0.0028409 k( 104) = ( 0.7184285 0.2815715 0.5000000), wk = 0.0028409 k( 105) = ( 0.7246693 0.2753307 0.5000000), wk = 0.0028409 k( 106) = ( 0.7309101 0.2690899 0.5000000), wk = 0.0028409 k( 107) = ( 0.7371509 0.2628491 0.5000000), wk = 0.0028409 k( 108) = ( 0.2628491 -0.2628491 0.5000000), wk = 0.0028409 k( 109) = ( 0.2565907 -0.2565907 0.5000000), wk = 0.0028409 k( 110) = ( 0.2503324 -0.2503324 0.5000000), wk = 0.0028409 k( 111) = ( 0.2440741 -0.2440741 0.5000000), wk = 0.0028409 k( 112) = ( 0.2378158 -0.2378158 0.5000000), wk = 0.0028409 k( 113) = ( 0.2315575 -0.2315575 0.5000000), wk = 0.0028409 k( 114) = ( 0.2252992 -0.2252992 0.5000000), wk = 0.0028409 k( 115) = ( 0.2190409 -0.2190409 0.5000000), wk = 0.0028409 k( 116) = ( 0.2127826 -0.2127826 0.5000000), wk = 0.0028409 k( 117) = ( 0.2065243 -0.2065243 0.5000000), wk = 0.0028409 k( 118) = ( 0.2002659 -0.2002660 0.5000000), wk = 0.0028409 k( 119) = ( 0.1940076 -0.1940076 0.5000000), wk = 0.0028409 k( 120) = ( 0.1877493 -0.1877493 0.5000000), wk = 0.0028409 k( 121) = ( 0.1814910 -0.1814910 0.5000000), wk = 0.0028409 k( 122) = ( 0.1752327 -0.1752327 0.5000000), wk = 0.0028409 k( 123) = ( 0.1689744 -0.1689744 0.5000000), wk = 0.0028409 k( 124) = ( 0.1627161 -0.1627161 0.5000000), wk = 0.0028409 k( 125) = ( 0.1564578 -0.1564578 0.5000000), wk = 0.0028409 k( 126) = ( 0.1501995 -0.1501995 0.5000000), wk = 0.0028409 k( 127) = ( 0.1439411 -0.1439411 0.5000000), wk = 0.0028409 k( 128) = ( 0.1376828 -0.1376828 0.5000000), wk = 0.0028409 k( 129) = ( 0.1314245 -0.1314245 0.5000000), wk = 0.0028409 k( 130) = ( 0.1251662 -0.1251662 0.5000000), wk = 0.0028409 k( 131) = ( 0.1189079 -0.1189079 0.5000000), wk = 0.0028409 k( 132) = ( 0.1126496 -0.1126496 0.5000000), wk = 0.0028409 k( 133) = ( 0.1063913 -0.1063913 0.5000000), wk = 0.0028409 k( 134) = ( 0.1001330 -0.1001330 0.5000000), wk = 0.0028409 k( 135) = ( 0.0938747 -0.0938747 0.5000000), wk = 0.0028409 k( 136) = ( 0.0876163 -0.0876163 0.5000000), wk = 0.0028409 k( 137) = ( 0.0813580 -0.0813580 0.5000000), wk = 0.0028409 k( 138) = ( 0.0750997 -0.0750997 0.5000000), wk = 0.0028409 k( 139) = ( 0.0688414 -0.0688414 0.5000000), wk = 0.0028409 k( 140) = ( 0.0625831 -0.0625831 0.5000000), wk = 0.0028409 k( 141) = ( 0.0563248 -0.0563248 0.5000000), wk = 0.0028409 k( 142) = ( 0.0500665 -0.0500665 0.5000000), wk = 0.0028409 k( 143) = ( 0.0438082 -0.0438082 0.5000000), wk = 0.0028409 k( 144) = ( 0.0375499 -0.0375499 0.5000000), wk = 0.0028409 k( 145) = ( 0.0312916 -0.0312916 0.5000000), wk = 0.0028409 k( 146) = ( 0.0250332 -0.0250332 0.5000000), wk = 0.0028409 k( 147) = ( 0.0187749 -0.0187749 0.5000000), wk = 0.0028409 k( 148) = ( 0.0125166 -0.0125166 0.5000000), wk = 0.0028409 k( 149) = ( 0.0062583 -0.0062583 0.5000000), wk = 0.0028409 k( 150) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 151) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028409 k( 152) = ( 0.0181241 0.0181241 0.5035302), wk = 0.0028409 k( 153) = ( 0.0362481 0.0362481 0.5070604), wk = 0.0028409 k( 154) = ( 0.0543722 0.0543722 0.5105906), wk = 0.0028409 k( 155) = ( 0.0724963 0.0724963 0.5141208), wk = 0.0028409 k( 156) = ( 0.0906204 0.0906204 0.5176510), wk = 0.0028409 k( 157) = ( 0.1087444 0.1087444 0.5211811), wk = 0.0028409 k( 158) = ( 0.1268685 0.1268685 0.5247114), wk = 0.0028409 k( 159) = ( 0.1449926 0.1449926 0.5282415), wk = 0.0028409 k( 160) = ( 0.1631166 0.1631166 0.5317717), wk = 0.0028409 k( 161) = ( 0.1812407 0.1812407 0.5353019), wk = 0.0028409 k( 162) = ( 0.1993648 0.1993648 0.5388321), wk = 0.0028409 k( 163) = ( 0.2174889 0.2174889 0.5423623), wk = 0.0028409 k( 164) = ( 0.2356129 0.2356129 0.5458925), wk = 0.0028409 k( 165) = ( 0.2537370 0.2537370 0.5494227), wk = 0.0028409 k( 166) = ( 0.2718611 0.2718611 0.5529529), wk = 0.0028409 k( 167) = ( 0.2899851 0.2899851 0.5564831), wk = 0.0028409 k( 168) = ( 0.3081092 0.3081092 0.5600133), wk = 0.0028409 k( 169) = ( 0.3262333 0.3262333 0.5635435), wk = 0.0028409 k( 170) = ( 0.3443574 0.3443574 0.5670737), wk = 0.0028409 k( 171) = ( 0.3624814 0.3624814 0.5706039), wk = 0.0028409 k( 172) = ( 0.3806055 0.3806055 0.5741340), wk = 0.0028409 k( 173) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028409 k( 174) = ( 0.5061319 0.4938680 -0.0000000), wk = 0.0028409 k( 175) = ( 0.5122639 0.4877361 -0.0000000), wk = 0.0028409 k( 176) = ( 0.5183958 0.4816042 -0.0000000), wk = 0.0028409 k( 177) = ( 0.5245278 0.4754722 -0.0000000), wk = 0.0028409 k( 178) = ( 0.5306597 0.4693403 -0.0000000), wk = 0.0028409 k( 179) = ( 0.5367917 0.4632083 -0.0000000), wk = 0.0028409 k( 180) = ( 0.5429236 0.4570764 -0.0000000), wk = 0.0028409 k( 181) = ( 0.5490556 0.4509444 -0.0000000), wk = 0.0028409 k( 182) = ( 0.5551875 0.4448125 -0.0000000), wk = 0.0028409 k( 183) = ( 0.5613195 0.4386805 -0.0000000), wk = 0.0028409 k( 184) = ( 0.5674514 0.4325486 -0.0000000), wk = 0.0028409 k( 185) = ( 0.5735834 0.4264166 -0.0000000), wk = 0.0028409 k( 186) = ( 0.5797153 0.4202847 -0.0000000), wk = 0.0028409 k( 187) = ( 0.5858473 0.4141527 -0.0000000), wk = 0.0028409 k( 188) = ( 0.5919792 0.4080208 -0.0000000), wk = 0.0028409 k( 189) = ( 0.5981112 0.4018888 -0.0000000), wk = 0.0028409 k( 190) = ( 0.6042431 0.3957569 -0.0000000), wk = 0.0028409 k( 191) = ( 0.6103751 0.3896249 -0.0000000), wk = 0.0028409 k( 192) = ( 0.6165070 0.3834930 -0.0000000), wk = 0.0028409 k( 193) = ( 0.6226390 0.3773610 0.0000000), wk = 0.0028409 k( 194) = ( 0.6287709 0.3712291 0.0000000), wk = 0.0028409 k( 195) = ( 0.6349029 0.3650971 0.0000000), wk = 0.0028409 k( 196) = ( 0.6410348 0.3589652 -0.0000000), wk = 0.0028409 k( 197) = ( 0.6471667 0.3528333 -0.0000000), wk = 0.0028409 k( 198) = ( 0.6532987 0.3467013 -0.0000000), wk = 0.0028409 k( 199) = ( 0.6594306 0.3405694 -0.0000000), wk = 0.0028409 k( 200) = ( 0.6655626 0.3344374 -0.0000000), wk = 0.0028409 k( 201) = ( 0.6716945 0.3283055 0.0000000), wk = 0.0028409 k( 202) = ( 0.6778265 0.3221735 -0.0000000), wk = 0.0028409 k( 203) = ( 0.6839584 0.3160416 0.0000000), wk = 0.0028409 k( 204) = ( 0.6900904 0.3099096 -0.0000000), wk = 0.0028409 k( 205) = ( 0.6962223 0.3037777 -0.0000000), wk = 0.0028409 k( 206) = ( 0.7023543 0.2976457 -0.0000000), wk = 0.0028409 k( 207) = ( 0.7084862 0.2915138 -0.0000000), wk = 0.0028409 k( 208) = ( 0.7146182 0.2853818 -0.0000000), wk = 0.0028409 k( 209) = ( 0.7207501 0.2792499 -0.0000000), wk = 0.0028409 k( 210) = ( 0.2792499 -0.2792499 -0.0000000), wk = 0.0028409 k( 211) = ( 0.2730443 -0.2730443 -0.0000000), wk = 0.0028409 k( 212) = ( 0.2668388 -0.2668388 0.0000000), wk = 0.0028409 k( 213) = ( 0.2606332 -0.2606332 -0.0000000), wk = 0.0028409 k( 214) = ( 0.2544277 -0.2544277 -0.0000000), wk = 0.0028409 k( 215) = ( 0.2482221 -0.2482221 -0.0000000), wk = 0.0028409 k( 216) = ( 0.2420166 -0.2420166 -0.0000000), wk = 0.0028409 k( 217) = ( 0.2358110 -0.2358110 0.0000000), wk = 0.0028409 k( 218) = ( 0.2296055 -0.2296055 -0.0000000), wk = 0.0028409 k( 219) = ( 0.2233999 -0.2233999 -0.0000000), wk = 0.0028409 k( 220) = ( 0.2171944 -0.2171944 -0.0000000), wk = 0.0028409 k( 221) = ( 0.2109888 -0.2109888 -0.0000000), wk = 0.0028409 k( 222) = ( 0.2047833 -0.2047833 -0.0000000), wk = 0.0028409 k( 223) = ( 0.1985777 -0.1985777 -0.0000000), wk = 0.0028409 k( 224) = ( 0.1923721 -0.1923721 -0.0000000), wk = 0.0028409 k( 225) = ( 0.1861666 -0.1861666 -0.0000000), wk = 0.0028409 k( 226) = ( 0.1799610 -0.1799610 -0.0000000), wk = 0.0028409 k( 227) = ( 0.1737555 -0.1737555 -0.0000000), wk = 0.0028409 k( 228) = ( 0.1675499 -0.1675499 -0.0000000), wk = 0.0028409 k( 229) = ( 0.1613444 -0.1613444 -0.0000000), wk = 0.0028409 k( 230) = ( 0.1551388 -0.1551388 -0.0000000), wk = 0.0028409 k( 231) = ( 0.1489333 -0.1489333 -0.0000000), wk = 0.0028409 k( 232) = ( 0.1427277 -0.1427277 -0.0000000), wk = 0.0028409 k( 233) = ( 0.1365222 -0.1365222 -0.0000000), wk = 0.0028409 k( 234) = ( 0.1303166 -0.1303166 -0.0000000), wk = 0.0028409 k( 235) = ( 0.1241111 -0.1241111 -0.0000000), wk = 0.0028409 k( 236) = ( 0.1179055 -0.1179055 -0.0000000), wk = 0.0028409 k( 237) = ( 0.1117000 -0.1116999 -0.0000000), wk = 0.0028409 k( 238) = ( 0.1054944 -0.1054944 -0.0000000), wk = 0.0028409 k( 239) = ( 0.0992888 -0.0992888 -0.0000000), wk = 0.0028409 k( 240) = ( 0.0930833 -0.0930833 -0.0000000), wk = 0.0028409 k( 241) = ( 0.0868777 -0.0868777 -0.0000000), wk = 0.0028409 k( 242) = ( 0.0806722 -0.0806722 -0.0000000), wk = 0.0028409 k( 243) = ( 0.0744666 -0.0744666 0.0000000), wk = 0.0028409 k( 244) = ( 0.0682611 -0.0682611 -0.0000000), wk = 0.0028409 k( 245) = ( 0.0620555 -0.0620555 -0.0000000), wk = 0.0028409 k( 246) = ( 0.0558500 -0.0558500 -0.0000000), wk = 0.0028409 k( 247) = ( 0.0496444 -0.0496444 -0.0000000), wk = 0.0028409 k( 248) = ( 0.0434389 -0.0434389 -0.0000000), wk = 0.0028409 k( 249) = ( 0.0372333 -0.0372333 0.0000000), wk = 0.0028409 k( 250) = ( 0.0310278 -0.0310278 -0.0000000), wk = 0.0028409 k( 251) = ( 0.0248222 -0.0248222 -0.0000000), wk = 0.0028409 k( 252) = ( 0.0186167 -0.0186167 0.0000000), wk = 0.0028409 k( 253) = ( 0.0124111 -0.0124111 -0.0000000), wk = 0.0028409 k( 254) = ( 0.0062055 -0.0062056 -0.0000000), wk = 0.0028409 k( 255) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 256) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 k( 257) = ( 0.0116279 -0.0000000 0.0000000), wk = 0.0028409 k( 258) = ( 0.0232558 -0.0000000 -0.0000000), wk = 0.0028409 k( 259) = ( 0.0348837 -0.0000000 -0.0000000), wk = 0.0028409 k( 260) = ( 0.0465116 -0.0000000 0.0000000), wk = 0.0028409 k( 261) = ( 0.0581395 0.0000000 0.0000000), wk = 0.0028409 k( 262) = ( 0.0697674 -0.0000000 -0.0000000), wk = 0.0028409 k( 263) = ( 0.0813954 0.0000000 -0.0000000), wk = 0.0028409 k( 264) = ( 0.0930233 -0.0000000 0.0000000), wk = 0.0028409 k( 265) = ( 0.1046512 -0.0000000 -0.0000000), wk = 0.0028409 k( 266) = ( 0.1162791 -0.0000000 -0.0000000), wk = 0.0028409 k( 267) = ( 0.1279070 0.0000000 -0.0000000), wk = 0.0028409 k( 268) = ( 0.1395349 -0.0000000 -0.0000000), wk = 0.0028409 k( 269) = ( 0.1511628 0.0000000 0.0000000), wk = 0.0028409 k( 270) = ( 0.1627907 0.0000000 -0.0000000), wk = 0.0028409 k( 271) = ( 0.1744186 0.0000000 0.0000000), wk = 0.0028409 k( 272) = ( 0.1860465 0.0000000 -0.0000000), wk = 0.0028409 k( 273) = ( 0.1976744 -0.0000000 -0.0000000), wk = 0.0028409 k( 274) = ( 0.2093023 -0.0000000 -0.0000000), wk = 0.0028409 k( 275) = ( 0.2209302 -0.0000000 -0.0000000), wk = 0.0028409 k( 276) = ( 0.2325581 -0.0000000 -0.0000000), wk = 0.0028409 k( 277) = ( 0.2441860 0.0000000 -0.0000000), wk = 0.0028409 k( 278) = ( 0.2558140 -0.0000000 -0.0000000), wk = 0.0028409 k( 279) = ( 0.2674419 -0.0000000 0.0000000), wk = 0.0028409 k( 280) = ( 0.2790698 0.0000000 -0.0000000), wk = 0.0028409 k( 281) = ( 0.2906977 -0.0000000 -0.0000000), wk = 0.0028409 k( 282) = ( 0.3023256 0.0000000 0.0000000), wk = 0.0028409 k( 283) = ( 0.3139535 0.0000000 -0.0000000), wk = 0.0028409 k( 284) = ( 0.3255814 0.0000000 -0.0000000), wk = 0.0028409 k( 285) = ( 0.3372093 0.0000000 -0.0000000), wk = 0.0028409 k( 286) = ( 0.3488372 0.0000000 -0.0000000), wk = 0.0028409 k( 287) = ( 0.3604651 -0.0000000 0.0000000), wk = 0.0028409 k( 288) = ( 0.3720930 0.0000000 -0.0000000), wk = 0.0028409 k( 289) = ( 0.3837209 -0.0000000 -0.0000000), wk = 0.0028409 k( 290) = ( 0.3953488 -0.0000000 -0.0000000), wk = 0.0028409 k( 291) = ( 0.4069767 -0.0000000 -0.0000000), wk = 0.0028409 k( 292) = ( 0.4186047 -0.0000000 -0.0000000), wk = 0.0028409 k( 293) = ( 0.4302326 -0.0000000 -0.0000000), wk = 0.0028409 k( 294) = ( 0.4418605 0.0000000 -0.0000000), wk = 0.0028409 k( 295) = ( 0.4534884 -0.0000000 -0.0000000), wk = 0.0028409 k( 296) = ( 0.4651163 -0.0000000 -0.0000000), wk = 0.0028409 k( 297) = ( 0.4767442 0.0000000 0.0000000), wk = 0.0028409 k( 298) = ( 0.4883721 -0.0000000 -0.0000000), wk = 0.0028409 k( 299) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0028409 k( 300) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0028409 k( 301) = ( 0.4903846 -0.0000000 0.4903846), wk = 0.0028409 k( 302) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0028409 k( 303) = ( 0.4711538 -0.0000000 0.4711538), wk = 0.0028409 k( 304) = ( 0.4615385 -0.0000000 0.4615385), wk = 0.0028409 k( 305) = ( 0.4519231 -0.0000000 0.4519231), wk = 0.0028409 k( 306) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0028409 k( 307) = ( 0.4326923 0.0000000 0.4326923), wk = 0.0028409 k( 308) = ( 0.4230769 0.0000000 0.4230769), wk = 0.0028409 k( 309) = ( 0.4134615 0.0000000 0.4134615), wk = 0.0028409 k( 310) = ( 0.4038462 0.0000000 0.4038462), wk = 0.0028409 k( 311) = ( 0.3942308 -0.0000000 0.3942308), wk = 0.0028409 k( 312) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0028409 k( 313) = ( 0.3750000 -0.0000000 0.3750000), wk = 0.0028409 k( 314) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0028409 k( 315) = ( 0.3557692 0.0000000 0.3557692), wk = 0.0028409 k( 316) = ( 0.3461538 0.0000000 0.3461538), wk = 0.0028409 k( 317) = ( 0.3365385 0.0000000 0.3365385), wk = 0.0028409 k( 318) = ( 0.3269231 0.0000000 0.3269231), wk = 0.0028409 k( 319) = ( 0.3173077 0.0000000 0.3173077), wk = 0.0028409 k( 320) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0028409 k( 321) = ( 0.2980769 -0.0000000 0.2980769), wk = 0.0028409 k( 322) = ( 0.2884615 0.0000000 0.2884615), wk = 0.0028409 k( 323) = ( 0.2788462 -0.0000000 0.2788462), wk = 0.0028409 k( 324) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0028409 k( 325) = ( 0.2596154 -0.0000000 0.2596154), wk = 0.0028409 k( 326) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0028409 k( 327) = ( 0.2403846 -0.0000000 0.2403846), wk = 0.0028409 k( 328) = ( 0.2307692 -0.0000000 0.2307692), wk = 0.0028409 k( 329) = ( 0.2211539 -0.0000000 0.2211538), wk = 0.0028409 k( 330) = ( 0.2115385 0.0000000 0.2115385), wk = 0.0028409 k( 331) = ( 0.2019231 0.0000000 0.2019231), wk = 0.0028409 k( 332) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0028409 k( 333) = ( 0.1826923 -0.0000000 0.1826923), wk = 0.0028409 k( 334) = ( 0.1730769 0.0000000 0.1730769), wk = 0.0028409 k( 335) = ( 0.1634615 0.0000000 0.1634615), wk = 0.0028409 k( 336) = ( 0.1538461 -0.0000000 0.1538461), wk = 0.0028409 k( 337) = ( 0.1442308 0.0000000 0.1442308), wk = 0.0028409 k( 338) = ( 0.1346154 -0.0000000 0.1346154), wk = 0.0028409 k( 339) = ( 0.1250000 -0.0000000 0.1250000), wk = 0.0028409 k( 340) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0028409 k( 341) = ( 0.1057692 0.0000000 0.1057692), wk = 0.0028409 k( 342) = ( 0.0961538 0.0000000 0.0961538), wk = 0.0028409 k( 343) = ( 0.0865385 0.0000000 0.0865385), wk = 0.0028409 k( 344) = ( 0.0769231 -0.0000000 0.0769231), wk = 0.0028409 k( 345) = ( 0.0673077 -0.0000000 0.0673077), wk = 0.0028409 k( 346) = ( 0.0576923 -0.0000000 0.0576923), wk = 0.0028409 k( 347) = ( 0.0480769 0.0000000 0.0480769), wk = 0.0028409 k( 348) = ( 0.0384615 -0.0000000 0.0384615), wk = 0.0028409 k( 349) = ( 0.0288462 -0.0000000 0.0288461), wk = 0.0028409 k( 350) = ( 0.0192308 -0.0000000 0.0192308), wk = 0.0028409 k( 351) = ( 0.0096154 0.0000000 0.0096154), wk = 0.0028409 k( 352) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028409 Dense grid: 46789 G-vectors FFT dimensions: ( 60, 60, 45) Smooth grid: 31771 G-vectors FFT dimensions: ( 54, 54, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.15 Mb ( 170, 58) NL pseudopotentials 0.25 Mb ( 85, 192) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 972) G-vector shells 0.01 Mb ( 880) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.60 Mb ( 170, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.34 Mb ( 192, 2, 58) The potential is recalculated from file : ./FeGe.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 43.9 secs Computing kpt #: 2 total cpu time spent up to now is 47.0 secs Computing kpt #: 3 total cpu time spent up to now is 50.0 secs Computing kpt #: 4 total cpu time spent up to now is 53.0 secs Computing kpt #: 5 total cpu time spent up to now is 55.9 secs Computing kpt #: 6 total cpu time spent up to now is 58.8 secs Computing kpt #: 7 total cpu time spent up to now is 61.3 secs Computing kpt #: 8 total cpu time spent up to now is 64.0 secs Computing kpt #: 9 total cpu time spent up to now is 66.6 secs Computing kpt #: 10 total cpu time spent up to now is 69.7 secs Computing kpt #: 11 total cpu time spent up to now is 72.4 secs Computing kpt #: 12 total cpu time spent up to now is 75.1 secs Computing kpt #: 13 total cpu time spent up to now is 78.0 secs Computing kpt #: 14 total cpu time spent up to now is 81.1 secs Computing kpt #: 15 total cpu time spent up to now is 84.0 secs Computing kpt #: 16 total cpu time spent up to now is 87.7 secs Computing kpt #: 17 total cpu time spent up to now is 92.1 secs Computing kpt #: 18 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 97.3 secs Computing kpt #: 19 total cpu time spent up to now is 101.8 secs Computing kpt #: 20 total cpu time spent up to now is 105.4 secs Computing kpt #: 21 total cpu time spent up to now is 109.0 secs Computing kpt #: 22 total cpu time spent up to now is 112.6 secs Computing kpt #: 23 total cpu time spent up to now is 116.3 secs Computing kpt #: 24 total cpu time spent up to now is 120.4 secs Computing kpt #: 25 total cpu time spent up to now is 124.5 secs Computing kpt #: 26 total cpu time spent up to now is 129.7 secs Computing kpt #: 27 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 135.0 secs Computing kpt #: 28 total cpu time spent up to now is 139.4 secs Computing kpt #: 29 total cpu time spent up to now is 143.3 secs Computing kpt #: 30 total cpu time spent up to now is 147.3 secs Computing kpt #: 31 total cpu time spent up to now is 152.2 secs Computing kpt #: 32 total cpu time spent up to now is 156.5 secs Computing kpt #: 33 total cpu time spent up to now is 160.6 secs Computing kpt #: 34 total cpu time spent up to now is 163.9 secs Computing kpt #: 35 total cpu time spent up to now is 166.9 secs Computing kpt #: 36 total cpu time spent up to now is 169.7 secs Computing kpt #: 37 total cpu time spent up to now is 172.2 secs Computing kpt #: 38 total cpu time spent up to now is 174.6 secs Computing kpt #: 39 total cpu time spent up to now is 177.1 secs Computing kpt #: 40 total cpu time spent up to now is 179.5 secs Computing kpt #: 41 total cpu time spent up to now is 182.0 secs Computing kpt #: 42 total cpu time spent up to now is 184.5 secs Computing kpt #: 43 total cpu time spent up to now is 186.9 secs Computing kpt #: 44 total cpu time spent up to now is 189.3 secs Computing kpt #: 45 total cpu time spent up to now is 192.1 secs Computing kpt #: 46 total cpu time spent up to now is 194.6 secs Computing kpt #: 47 total cpu time spent up to now is 197.2 secs Computing kpt #: 48 total cpu time spent up to now is 199.7 secs Computing kpt #: 49 total cpu time spent up to now is 202.3 secs Computing kpt #: 50 total cpu time spent up to now is 205.0 secs Computing kpt #: 51 total cpu time spent up to now is 207.7 secs Computing kpt #: 52 total cpu time spent up to now is 210.7 secs Computing kpt #: 53 total cpu time spent up to now is 214.5 secs Computing kpt #: 54 total cpu time spent up to now is 218.4 secs Computing kpt #: 55 total cpu time spent up to now is 221.4 secs Computing kpt #: 56 total cpu time spent up to now is 223.8 secs Computing kpt #: 57 total cpu time spent up to now is 226.2 secs Computing kpt #: 58 total cpu time spent up to now is 228.5 secs Computing kpt #: 59 total cpu time spent up to now is 230.8 secs Computing kpt #: 60 total cpu time spent up to now is 233.2 secs Computing kpt #: 61 total cpu time spent up to now is 235.4 secs Computing kpt #: 62 total cpu time spent up to now is 238.3 secs Computing kpt #: 63 total cpu time spent up to now is 240.5 secs Computing kpt #: 64 total cpu time spent up to now is 242.7 secs Computing kpt #: 65 total cpu time spent up to now is 244.9 secs Computing kpt #: 66 total cpu time spent up to now is 247.2 secs Computing kpt #: 67 total cpu time spent up to now is 249.4 secs Computing kpt #: 68 total cpu time spent up to now is 251.5 secs Computing kpt #: 69 total cpu time spent up to now is 253.9 secs Computing kpt #: 70 total cpu time spent up to now is 256.2 secs Computing kpt #: 71 total cpu time spent up to now is 258.5 secs Computing kpt #: 72 total cpu time spent up to now is 260.7 secs Computing kpt #: 73 total cpu time spent up to now is 262.9 secs Computing kpt #: 74 total cpu time spent up to now is 265.2 secs Computing kpt #: 75 total cpu time spent up to now is 267.5 secs Computing kpt #: 76 total cpu time spent up to now is 269.8 secs Computing kpt #: 77 total cpu time spent up to now is 272.2 secs Computing kpt #: 78 total cpu time spent up to now is 274.6 secs Computing kpt #: 79 total cpu time spent up to now is 277.6 secs Computing kpt #: 80 total cpu time spent up to now is 280.9 secs Computing kpt #: 81 total cpu time spent up to now is 283.5 secs Computing kpt #: 82 total cpu time spent up to now is 286.4 secs Computing kpt #: 83 total cpu time spent up to now is 289.5 secs Computing kpt #: 84 total cpu time spent up to now is 293.1 secs Computing kpt #: 85 total cpu time spent up to now is 297.0 secs Computing kpt #: 86 total cpu time spent up to now is 301.3 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 306.8 secs Computing kpt #: 88 total cpu time spent up to now is 309.9 secs Computing kpt #: 89 total cpu time spent up to now is 312.9 secs Computing kpt #: 90 total cpu time spent up to now is 316.1 secs Computing kpt #: 91 total cpu time spent up to now is 318.9 secs Computing kpt #: 92 total cpu time spent up to now is 322.0 secs Computing kpt #: 93 total cpu time spent up to now is 324.5 secs Computing kpt #: 94 total cpu time spent up to now is 327.4 secs Computing kpt #: 95 total cpu time spent up to now is 330.9 secs Computing kpt #: 96 total cpu time spent up to now is 334.4 secs Computing kpt #: 97 total cpu time spent up to now is 339.2 secs Computing kpt #: 98 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 344.3 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 349.6 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 355.2 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 360.5 secs Computing kpt #: 102 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 366.3 secs Computing kpt #: 103 total cpu time spent up to now is 370.1 secs Computing kpt #: 104 total cpu time spent up to now is 373.8 secs Computing kpt #: 105 total cpu time spent up to now is 376.7 secs Computing kpt #: 106 total cpu time spent up to now is 379.3 secs Computing kpt #: 107 total cpu time spent up to now is 382.3 secs Computing kpt #: 108 total cpu time spent up to now is 384.8 secs Computing kpt #: 109 total cpu time spent up to now is 387.5 secs Computing kpt #: 110 total cpu time spent up to now is 389.9 secs Computing kpt #: 111 total cpu time spent up to now is 392.4 secs Computing kpt #: 112 total cpu time spent up to now is 394.9 secs Computing kpt #: 113 total cpu time spent up to now is 397.3 secs Computing kpt #: 114 total cpu time spent up to now is 400.0 secs Computing kpt #: 115 total cpu time spent up to now is 402.4 secs Computing kpt #: 116 total cpu time spent up to now is 404.8 secs Computing kpt #: 117 total cpu time spent up to now is 407.8 secs Computing kpt #: 118 total cpu time spent up to now is 410.5 secs Computing kpt #: 119 total cpu time spent up to now is 412.9 secs Computing kpt #: 120 total cpu time spent up to now is 415.4 secs Computing kpt #: 121 total cpu time spent up to now is 418.2 secs Computing kpt #: 122 total cpu time spent up to now is 421.2 secs Computing kpt #: 123 total cpu time spent up to now is 424.0 secs Computing kpt #: 124 total cpu time spent up to now is 426.9 secs Computing kpt #: 125 total cpu time spent up to now is 429.9 secs Computing kpt #: 126 total cpu time spent up to now is 432.7 secs Computing kpt #: 127 total cpu time spent up to now is 435.7 secs Computing kpt #: 128 total cpu time spent up to now is 438.5 secs Computing kpt #: 129 total cpu time spent up to now is 441.4 secs Computing kpt #: 130 total cpu time spent up to now is 444.2 secs Computing kpt #: 131 total cpu time spent up to now is 447.0 secs Computing kpt #: 132 total cpu time spent up to now is 449.7 secs Computing kpt #: 133 total cpu time spent up to now is 452.6 secs Computing kpt #: 134 total cpu time spent up to now is 455.0 secs Computing kpt #: 135 total cpu time spent up to now is 457.4 secs Computing kpt #: 136 total cpu time spent up to now is 459.8 secs Computing kpt #: 137 total cpu time spent up to now is 462.2 secs Computing kpt #: 138 total cpu time spent up to now is 464.5 secs Computing kpt #: 139 total cpu time spent up to now is 466.9 secs Computing kpt #: 140 total cpu time spent up to now is 469.3 secs Computing kpt #: 141 total cpu time spent up to now is 471.8 secs Computing kpt #: 142 total cpu time spent up to now is 474.4 secs Computing kpt #: 143 total cpu time spent up to now is 477.7 secs Computing kpt #: 144 total cpu time spent up to now is 480.8 secs Computing kpt #: 145 total cpu time spent up to now is 483.4 secs Computing kpt #: 146 total cpu time spent up to now is 485.7 secs Computing kpt #: 147 total cpu time spent up to now is 488.0 secs Computing kpt #: 148 total cpu time spent up to now is 490.3 secs Computing kpt #: 149 total cpu time spent up to now is 492.4 secs Computing kpt #: 150 total cpu time spent up to now is 494.8 secs Computing kpt #: 151 total cpu time spent up to now is 496.9 secs Computing kpt #: 152 total cpu time spent up to now is 499.2 secs Computing kpt #: 153 total cpu time spent up to now is 501.7 secs Computing kpt #: 154 total cpu time spent up to now is 503.9 secs Computing kpt #: 155 total cpu time spent up to now is 506.2 secs Computing kpt #: 156 total cpu time spent up to now is 508.4 secs Computing kpt #: 157 total cpu time spent up to now is 510.7 secs Computing kpt #: 158 total cpu time spent up to now is 512.9 secs Computing kpt #: 159 total cpu time spent up to now is 515.1 secs Computing kpt #: 160 total cpu time spent up to now is 517.6 secs Computing kpt #: 161 total cpu time spent up to now is 519.9 secs Computing kpt #: 162 total cpu time spent up to now is 522.1 secs Computing kpt #: 163 total cpu time spent up to now is 524.4 secs Computing kpt #: 164 total cpu time spent up to now is 526.7 secs Computing kpt #: 165 total cpu time spent up to now is 528.9 secs Computing kpt #: 166 total cpu time spent up to now is 531.3 secs Computing kpt #: 167 total cpu time spent up to now is 533.7 secs Computing kpt #: 168 total cpu time spent up to now is 536.3 secs Computing kpt #: 169 total cpu time spent up to now is 538.8 secs Computing kpt #: 170 total cpu time spent up to now is 541.3 secs Computing kpt #: 171 total cpu time spent up to now is 543.7 secs Computing kpt #: 172 total cpu time spent up to now is 546.1 secs Computing kpt #: 173 total cpu time spent up to now is 550.6 secs Computing kpt #: 174 total cpu time spent up to now is 554.3 secs Computing kpt #: 175 total cpu time spent up to now is 557.9 secs Computing kpt #: 176 total cpu time spent up to now is 560.8 secs Computing kpt #: 177 total cpu time spent up to now is 563.4 secs Computing kpt #: 178 total cpu time spent up to now is 565.9 secs Computing kpt #: 179 total cpu time spent up to now is 568.3 secs Computing kpt #: 180 total cpu time spent up to now is 570.7 secs Computing kpt #: 181 total cpu time spent up to now is 573.1 secs Computing kpt #: 182 total cpu time spent up to now is 575.4 secs Computing kpt #: 183 total cpu time spent up to now is 577.8 secs Computing kpt #: 184 total cpu time spent up to now is 580.1 secs Computing kpt #: 185 total cpu time spent up to now is 582.4 secs Computing kpt #: 186 total cpu time spent up to now is 584.8 secs Computing kpt #: 187 total cpu time spent up to now is 587.1 secs Computing kpt #: 188 total cpu time spent up to now is 589.7 secs Computing kpt #: 189 total cpu time spent up to now is 592.1 secs Computing kpt #: 190 total cpu time spent up to now is 594.5 secs Computing kpt #: 191 total cpu time spent up to now is 596.9 secs Computing kpt #: 192 total cpu time spent up to now is 599.3 secs Computing kpt #: 193 total cpu time spent up to now is 601.5 secs Computing kpt #: 194 total cpu time spent up to now is 603.9 secs Computing kpt #: 195 total cpu time spent up to now is 606.2 secs Computing kpt #: 196 total cpu time spent up to now is 608.5 secs Computing kpt #: 197 total cpu time spent up to now is 611.7 secs Computing kpt #: 198 total cpu time spent up to now is 614.1 secs Computing kpt #: 199 total cpu time spent up to now is 616.5 secs Computing kpt #: 200 total cpu time spent up to now is 618.8 secs Computing kpt #: 201 total cpu time spent up to now is 621.3 secs Computing kpt #: 202 total cpu time spent up to now is 623.6 secs Computing kpt #: 203 total cpu time spent up to now is 626.1 secs Computing kpt #: 204 total cpu time spent up to now is 628.5 secs Computing kpt #: 205 total cpu time spent up to now is 630.9 secs Computing kpt #: 206 total cpu time spent up to now is 633.4 secs Computing kpt #: 207 total cpu time spent up to now is 635.9 secs Computing kpt #: 208 total cpu time spent up to now is 638.5 secs Computing kpt #: 209 total cpu time spent up to now is 641.0 secs Computing kpt #: 210 total cpu time spent up to now is 643.4 secs Computing kpt #: 211 total cpu time spent up to now is 645.9 secs Computing kpt #: 212 total cpu time spent up to now is 648.5 secs Computing kpt #: 213 total cpu time spent up to now is 651.1 secs Computing kpt #: 214 total cpu time spent up to now is 653.7 secs Computing kpt #: 215 total cpu time spent up to now is 656.3 secs Computing kpt #: 216 total cpu time spent up to now is 659.1 secs Computing kpt #: 217 total cpu time spent up to now is 661.8 secs Computing kpt #: 218 total cpu time spent up to now is 664.4 secs Computing kpt #: 219 total cpu time spent up to now is 666.9 secs Computing kpt #: 220 total cpu time spent up to now is 669.4 secs Computing kpt #: 221 total cpu time spent up to now is 671.7 secs Computing kpt #: 222 total cpu time spent up to now is 674.3 secs Computing kpt #: 223 total cpu time spent up to now is 676.6 secs Computing kpt #: 224 total cpu time spent up to now is 678.8 secs Computing kpt #: 225 total cpu time spent up to now is 681.1 secs Computing kpt #: 226 total cpu time spent up to now is 683.4 secs Computing kpt #: 227 total cpu time spent up to now is 685.8 secs Computing kpt #: 228 total cpu time spent up to now is 688.1 secs Computing kpt #: 229 total cpu time spent up to now is 690.4 secs Computing kpt #: 230 total cpu time spent up to now is 692.8 secs Computing kpt #: 231 total cpu time spent up to now is 695.1 secs Computing kpt #: 232 total cpu time spent up to now is 697.4 secs Computing kpt #: 233 total cpu time spent up to now is 699.6 secs Computing kpt #: 234 total cpu time spent up to now is 701.8 secs Computing kpt #: 235 total cpu time spent up to now is 704.2 secs Computing kpt #: 236 total cpu time spent up to now is 706.4 secs Computing kpt #: 237 total cpu time spent up to now is 708.6 secs Computing kpt #: 238 total cpu time spent up to now is 710.8 secs Computing kpt #: 239 total cpu time spent up to now is 713.0 secs Computing kpt #: 240 total cpu time spent up to now is 715.4 secs Computing kpt #: 241 total cpu time spent up to now is 717.6 secs Computing kpt #: 242 total cpu time spent up to now is 719.8 secs Computing kpt #: 243 total cpu time spent up to now is 722.1 secs Computing kpt #: 244 total cpu time spent up to now is 724.4 secs Computing kpt #: 245 total cpu time spent up to now is 726.6 secs Computing kpt #: 246 total cpu time spent up to now is 729.3 secs Computing kpt #: 247 total cpu time spent up to now is 731.6 secs Computing kpt #: 248 total cpu time spent up to now is 734.0 secs Computing kpt #: 249 total cpu time spent up to now is 736.3 secs Computing kpt #: 250 total cpu time spent up to now is 739.4 secs Computing kpt #: 251 total cpu time spent up to now is 742.8 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 748.1 secs Computing kpt #: 253 total cpu time spent up to now is 751.8 secs Computing kpt #: 254 total cpu time spent up to now is 754.8 secs Computing kpt #: 255 total cpu time spent up to now is 758.0 secs Computing kpt #: 256 total cpu time spent up to now is 761.0 secs Computing kpt #: 257 total cpu time spent up to now is 764.5 secs Computing kpt #: 258 total cpu time spent up to now is 768.1 secs Computing kpt #: 259 total cpu time spent up to now is 772.3 secs Computing kpt #: 260 total cpu time spent up to now is 775.4 secs Computing kpt #: 261 total cpu time spent up to now is 778.6 secs Computing kpt #: 262 total cpu time spent up to now is 781.0 secs Computing kpt #: 263 total cpu time spent up to now is 783.4 secs Computing kpt #: 264 total cpu time spent up to now is 785.8 secs Computing kpt #: 265 total cpu time spent up to now is 788.1 secs Computing kpt #: 266 total cpu time spent up to now is 791.0 secs Computing kpt #: 267 total cpu time spent up to now is 793.3 secs Computing kpt #: 268 total cpu time spent up to now is 795.7 secs Computing kpt #: 269 total cpu time spent up to now is 797.9 secs Computing kpt #: 270 total cpu time spent up to now is 800.2 secs Computing kpt #: 271 total cpu time spent up to now is 802.4 secs Computing kpt #: 272 total cpu time spent up to now is 804.6 secs Computing kpt #: 273 total cpu time spent up to now is 806.9 secs Computing kpt #: 274 total cpu time spent up to now is 809.3 secs Computing kpt #: 275 total cpu time spent up to now is 811.7 secs Computing kpt #: 276 total cpu time spent up to now is 814.0 secs Computing kpt #: 277 total cpu time spent up to now is 816.3 secs Computing kpt #: 278 total cpu time spent up to now is 818.6 secs Computing kpt #: 279 total cpu time spent up to now is 821.0 secs Computing kpt #: 280 total cpu time spent up to now is 823.4 secs Computing kpt #: 281 total cpu time spent up to now is 825.7 secs Computing kpt #: 282 total cpu time spent up to now is 828.1 secs Computing kpt #: 283 total cpu time spent up to now is 830.4 secs Computing kpt #: 284 total cpu time spent up to now is 832.7 secs Computing kpt #: 285 total cpu time spent up to now is 835.4 secs Computing kpt #: 286 total cpu time spent up to now is 838.0 secs Computing kpt #: 287 total cpu time spent up to now is 840.5 secs Computing kpt #: 288 total cpu time spent up to now is 843.1 secs Computing kpt #: 289 total cpu time spent up to now is 845.6 secs Computing kpt #: 290 total cpu time spent up to now is 848.3 secs Computing kpt #: 291 total cpu time spent up to now is 850.8 secs Computing kpt #: 292 total cpu time spent up to now is 853.2 secs Computing kpt #: 293 total cpu time spent up to now is 856.0 secs Computing kpt #: 294 total cpu time spent up to now is 858.5 secs Computing kpt #: 295 total cpu time spent up to now is 861.2 secs Computing kpt #: 296 total cpu time spent up to now is 864.3 secs Computing kpt #: 297 total cpu time spent up to now is 866.8 secs Computing kpt #: 298 total cpu time spent up to now is 869.1 secs Computing kpt #: 299 total cpu time spent up to now is 871.6 secs Computing kpt #: 300 total cpu time spent up to now is 874.2 secs Computing kpt #: 301 total cpu time spent up to now is 876.5 secs Computing kpt #: 302 total cpu time spent up to now is 878.8 secs Computing kpt #: 303 total cpu time spent up to now is 881.1 secs Computing kpt #: 304 total cpu time spent up to now is 883.4 secs Computing kpt #: 305 total cpu time spent up to now is 885.8 secs Computing kpt #: 306 total cpu time spent up to now is 888.1 secs Computing kpt #: 307 total cpu time spent up to now is 890.4 secs Computing kpt #: 308 total cpu time spent up to now is 892.7 secs Computing kpt #: 309 total cpu time spent up to now is 894.9 secs Computing kpt #: 310 total cpu time spent up to now is 897.4 secs Computing kpt #: 311 total cpu time spent up to now is 899.9 secs Computing kpt #: 312 total cpu time spent up to now is 902.2 secs Computing kpt #: 313 total cpu time spent up to now is 904.5 secs Computing kpt #: 314 total cpu time spent up to now is 906.8 secs Computing kpt #: 315 total cpu time spent up to now is 909.1 secs Computing kpt #: 316 total cpu time spent up to now is 911.3 secs Computing kpt #: 317 total cpu time spent up to now is 913.6 secs Computing kpt #: 318 total cpu time spent up to now is 915.9 secs Computing kpt #: 319 total cpu time spent up to now is 918.8 secs Computing kpt #: 320 total cpu time spent up to now is 921.2 secs Computing kpt #: 321 total cpu time spent up to now is 923.5 secs Computing kpt #: 322 total cpu time spent up to now is 925.8 secs Computing kpt #: 323 total cpu time spent up to now is 928.1 secs Computing kpt #: 324 total cpu time spent up to now is 930.4 secs Computing kpt #: 325 total cpu time spent up to now is 932.6 secs Computing kpt #: 326 total cpu time spent up to now is 934.9 secs Computing kpt #: 327 total cpu time spent up to now is 937.1 secs Computing kpt #: 328 total cpu time spent up to now is 939.4 secs Computing kpt #: 329 total cpu time spent up to now is 941.6 secs Computing kpt #: 330 total cpu time spent up to now is 943.9 secs Computing kpt #: 331 total cpu time spent up to now is 946.3 secs Computing kpt #: 332 total cpu time spent up to now is 948.6 secs Computing kpt #: 333 total cpu time spent up to now is 951.2 secs Computing kpt #: 334 total cpu time spent up to now is 953.6 secs Computing kpt #: 335 total cpu time spent up to now is 956.2 secs Computing kpt #: 336 total cpu time spent up to now is 959.1 secs Computing kpt #: 337 total cpu time spent up to now is 962.2 secs Computing kpt #: 338 total cpu time spent up to now is 965.8 secs Computing kpt #: 339 total cpu time spent up to now is 969.1 secs Computing kpt #: 340 total cpu time spent up to now is 972.0 secs Computing kpt #: 341 total cpu time spent up to now is 975.1 secs Computing kpt #: 342 total cpu time spent up to now is 978.5 secs Computing kpt #: 343 total cpu time spent up to now is 981.5 secs Computing kpt #: 344 total cpu time spent up to now is 984.4 secs Computing kpt #: 345 total cpu time spent up to now is 987.5 secs Computing kpt #: 346 total cpu time spent up to now is 990.6 secs Computing kpt #: 347 total cpu time spent up to now is 993.6 secs Computing kpt #: 348 total cpu time spent up to now is 996.7 secs Computing kpt #: 349 total cpu time spent up to now is 999.8 secs Computing kpt #: 350 total cpu time spent up to now is 1002.9 secs Computing kpt #: 351 total cpu time spent up to now is 1006.0 secs Computing kpt #: 352 total cpu time spent up to now is 1009.0 secs ethr = 2.08E-11, avg # of iterations = 36.7 total cpu time spent up to now is 1009.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3933 PWs) bands (ev): -1.7767 -1.7767 1.4514 1.4514 2.4396 2.4396 3.3026 3.3026 5.5616 5.5616 5.9646 5.9646 6.9805 6.9805 7.0390 7.0390 7.4308 7.4308 7.6491 7.6491 7.9896 7.9896 8.0724 8.0724 8.1773 8.1773 8.5169 8.5169 8.6866 8.6866 8.7081 8.7081 9.5614 9.5614 9.5936 9.5936 9.7993 9.7993 9.9333 9.9333 10.1203 10.1203 10.4776 10.4776 10.7334 10.7334 10.7901 10.7901 11.3040 11.3040 11.5289 11.5289 11.6552 11.6552 11.6702 11.6702 12.2577 12.2577 k = 0.0179 0.0059-0.0045 ( 3939 PWs) bands (ev): -1.7754 -1.7754 1.4420 1.4420 2.4465 2.4465 3.3024 3.3024 5.5640 5.5640 5.9653 5.9653 6.9798 6.9798 7.0392 7.0392 7.4301 7.4301 7.6500 7.6500 7.9906 7.9906 8.0739 8.0739 8.1779 8.1779 8.5170 8.5170 8.6870 8.6870 8.7084 8.7084 9.5560 9.5560 9.5972 9.5972 9.7987 9.7987 9.9325 9.9325 10.1208 10.1208 10.4782 10.4782 10.7338 10.7338 10.7902 10.7902 11.3036 11.3036 11.5058 11.5058 11.6541 11.6541 11.6950 11.6950 12.2542 12.2542 k = 0.0357 0.0119-0.0090 ( 3937 PWs) bands (ev): -1.7712 -1.7712 1.4145 1.4145 2.4664 2.4664 3.3019 3.3019 5.5712 5.5712 5.9676 5.9676 6.9776 6.9776 7.0398 7.0398 7.4282 7.4282 7.6529 7.6529 7.9932 7.9932 8.0786 8.0786 8.1798 8.1798 8.5174 8.5174 8.6881 8.6881 8.7094 8.7094 9.5436 9.5436 9.6039 9.6039 9.7971 9.7971 9.9303 9.9303 10.1224 10.1224 10.4802 10.4802 10.7351 10.7351 10.7905 10.7905 11.3023 11.3023 11.4583 11.4583 11.6524 11.6524 11.7462 11.7462 12.2452 12.2452 k = 0.0536 0.0178-0.0136 ( 3933 PWs) bands (ev): -1.7644 -1.7644 1.3714 1.3714 2.4970 2.4970 3.3011 3.3011 5.5828 5.5828 5.9715 5.9715 6.9741 6.9741 7.0410 7.0410 7.4251 7.4251 7.6577 7.6577 7.9966 7.9966 8.0870 8.0870 8.1830 8.1830 8.5181 8.5181 8.6899 8.6899 8.7112 8.7112 9.5281 9.5281 9.6102 9.6102 9.7945 9.7945 9.9268 9.9268 10.1250 10.1250 10.4834 10.4834 10.7373 10.7373 10.7909 10.7909 11.3002 11.3002 11.4048 11.4048 11.6498 11.6498 11.8058 11.8058 12.2331 12.2331 k = 0.0714 0.0238-0.0181 ( 3935 PWs) bands (ev): -1.7548 -1.7548 1.3154 1.3154 2.5356 2.5356 3.2999 3.2999 5.5983 5.5983 5.9777 5.9777 6.9694 6.9694 7.0428 7.0428 7.4214 7.4214 7.6642 7.6642 7.9995 7.9995 8.0993 8.0993 8.1875 8.1875 8.5189 8.5189 8.6926 8.6926 8.7137 8.7137 9.5108 9.5108 9.6147 9.6147 9.7905 9.7905 9.9223 9.9223 10.1286 10.1286 10.4877 10.4877 10.7401 10.7401 10.7916 10.7916 11.2971 11.2971 11.3503 11.3503 11.6462 11.6462 11.8685 11.8685 12.2202 12.2202 k = 0.0893 0.0297-0.0226 ( 3937 PWs) bands (ev): -1.7424 -1.7424 1.2493 1.2493 2.5793 2.5793 3.2985 3.2985 5.6167 5.6167 5.9867 5.9867 6.9636 6.9636 7.0456 7.0456 7.4174 7.4174 7.6722 7.6722 8.0014 8.0014 8.1156 8.1156 8.1932 8.1932 8.5198 8.5198 8.6960 8.6960 8.7169 8.7169 9.4922 9.4922 9.6171 9.6171 9.7853 9.7853 9.9169 9.9169 10.1329 10.1329 10.4930 10.4930 10.7436 10.7436 10.7926 10.7926 11.2911 11.2911 11.2987 11.2987 11.6416 11.6416 11.9328 11.9328 12.2075 12.2075 k = 0.1071 0.0356-0.0271 ( 3939 PWs) bands (ev): -1.7273 -1.7273 1.1756 1.1756 2.6259 2.6259 3.2967 3.2967 5.6369 5.6369 5.9994 5.9994 6.9569 6.9569 7.0496 7.0496 7.4136 7.4136 7.6816 7.6816 8.0018 8.0018 8.1353 8.1353 8.2001 8.2001 8.5208 8.5208 8.7004 8.7004 8.7209 8.7209 9.4728 9.4728 9.6173 9.6173 9.7787 9.7787 9.9112 9.9112 10.1378 10.1378 10.4994 10.4994 10.7474 10.7474 10.7940 10.7940 11.2434 11.2434 11.2893 11.2893 11.6361 11.6361 11.9979 11.9979 12.1961 12.1961 k = 0.1250 0.0416-0.0317 ( 3941 PWs) bands (ev): -1.7095 -1.7095 1.0961 1.0961 2.6737 2.6737 3.2948 3.2948 5.6575 5.6575 6.0169 6.0169 6.9494 6.9494 7.0552 7.0552 7.4102 7.4102 7.6922 7.6922 8.0006 8.0006 8.1574 8.1574 8.2083 8.2083 8.5216 8.5216 8.7056 8.7056 8.7259 8.7259 9.4528 9.4528 9.6152 9.6152 9.7706 9.7706 9.9055 9.9055 10.1431 10.1431 10.5065 10.5065 10.7515 10.7515 10.7958 10.7958 11.1929 11.1929 11.2838 11.2838 11.6298 11.6298 12.0630 12.0630 12.1865 12.1865 k = 0.1429 0.0475-0.0362 ( 3937 PWs) bands (ev): -1.6890 -1.6890 1.0122 1.0122 2.7212 2.7212 3.2926 3.2926 5.6768 5.6768 6.0402 6.0402 6.9413 6.9413 7.0627 7.0627 7.4076 7.4076 7.7038 7.7038 7.9977 7.9977 8.1812 8.1812 8.2177 8.2177 8.5222 8.5222 8.7117 8.7117 8.7320 8.7320 9.4325 9.4325 9.6109 9.6109 9.7610 9.7610 9.9000 9.9000 10.1486 10.1486 10.5143 10.5143 10.7555 10.7555 10.7982 10.7982 11.1445 11.1445 11.2777 11.2777 11.6227 11.6227 12.1271 12.1271 12.1798 12.1798 k = 0.1607 0.0535-0.0407 ( 3937 PWs) bands (ev): -1.6657 -1.6657 0.9253 0.9253 2.7675 2.7675 3.2902 3.2902 5.6935 5.6935 6.0705 6.0705 6.9327 6.9327 7.0726 7.0726 7.4059 7.4059 7.7162 7.7162 7.9932 7.9932 8.2054 8.2054 8.2282 8.2282 8.5225 8.5225 8.7183 8.7183 8.7396 8.7396 9.4122 9.4122 9.6044 9.6044 9.7501 9.7501 9.8953 9.8953 10.1539 10.1539 10.5225 10.5225 10.7592 10.7592 10.8012 10.8012 11.0984 11.0984 11.2710 11.2710 11.6150 11.6150 12.1668 12.1668 12.1993 12.1993 k = 0.1786 0.0594-0.0452 ( 3941 PWs) bands (ev): -1.6398 -1.6398 0.8361 0.8361 2.8118 2.8118 3.2876 3.2876 5.7066 5.7066 6.1081 6.1081 6.9238 6.9238 7.0852 7.0852 7.4053 7.4053 7.7290 7.7290 7.9869 7.9869 8.2293 8.2293 8.2401 8.2401 8.5221 8.5221 8.7251 8.7251 8.7491 8.7491 9.3921 9.3921 9.5960 9.5960 9.7377 9.7377 9.8913 9.8913 10.1587 10.1587 10.5312 10.5312 10.7624 10.7624 10.8048 10.8048 11.0549 11.0549 11.2637 11.2637 11.6069 11.6069 12.1662 12.1662 12.2606 12.2606 k = 0.1964 0.0653-0.0498 ( 3939 PWs) bands (ev): -1.6112 -1.6112 0.7455 0.7455 2.8539 2.8539 3.2850 3.2850 5.7156 5.7156 6.1529 6.1529 6.9148 6.9148 7.1007 7.1007 7.4060 7.4060 7.7422 7.7422 7.9789 7.9789 8.2500 8.2500 8.2555 8.2555 8.5210 8.5210 8.7318 8.7318 8.7609 8.7609 9.3725 9.3725 9.5858 9.5858 9.7243 9.7243 9.8882 9.8882 10.1628 10.1628 10.5401 10.5401 10.7650 10.7650 10.8090 10.8090 11.0143 11.0143 11.2562 11.2562 11.5985 11.5985 12.1652 12.1652 12.3234 12.3234 k = 0.2143 0.0713-0.0543 ( 3940 PWs) bands (ev): -1.5800 -1.5800 0.6538 0.6538 2.8932 2.8932 3.2822 3.2822 5.7207 5.7207 6.2039 6.2039 6.9057 6.9057 7.1193 7.1193 7.4081 7.4081 7.7556 7.7556 7.9690 7.9690 8.2648 8.2648 8.2762 8.2762 8.5189 8.5189 8.7381 8.7381 8.7751 8.7751 9.3536 9.3536 9.5739 9.5739 9.7100 9.7100 9.8860 9.8860 10.1659 10.1659 10.5492 10.5492 10.7670 10.7670 10.8133 10.8133 10.9768 10.9768 11.2484 11.2484 11.5901 11.5901 12.1658 12.1658 12.3851 12.3851 k = 0.2321 0.0772-0.0588 ( 3945 PWs) bands (ev): -1.5461 -1.5461 0.5618 0.5618 2.9298 2.9298 3.2794 3.2794 5.7225 5.7225 6.2600 6.2600 6.8966 6.8966 7.1410 7.1410 7.4118 7.4118 7.7689 7.7689 7.9572 7.9572 8.2793 8.2793 8.2964 8.2964 8.5156 8.5156 8.7439 8.7439 8.7916 8.7916 9.3357 9.3357 9.5607 9.5607 9.6953 9.6953 9.8847 9.8847 10.1678 10.1678 10.5583 10.5583 10.7684 10.7684 10.8174 10.8174 10.9428 10.9428 11.2407 11.2407 11.5817 11.5817 12.1681 12.1681 12.4451 12.4451 k = 0.2500 0.0831-0.0633 ( 3943 PWs) bands (ev): -1.5096 -1.5096 0.4696 0.4696 2.9634 2.9634 3.2766 3.2766 5.7214 5.7214 6.3198 6.3198 6.8878 6.8878 7.1657 7.1657 7.4175 7.4175 7.7820 7.7820 7.9435 7.9435 8.2945 8.2945 8.3149 8.3149 8.5111 8.5111 8.7492 8.7492 8.8103 8.8103 9.3191 9.3191 9.5463 9.5463 9.6803 9.6803 9.8841 9.8841 10.1683 10.1683 10.5673 10.5673 10.7694 10.7694 10.8206 10.8206 10.9126 10.9126 11.2334 11.2334 11.5735 11.5735 12.1718 12.1718 12.5029 12.5029 k = 0.2679 0.0891-0.0678 ( 3951 PWs) bands (ev): -1.4705 -1.4705 0.3778 0.3778 2.9941 2.9941 3.2739 3.2739 5.7183 5.7183 6.3821 6.3821 6.8791 6.8791 7.1927 7.1927 7.4255 7.4255 7.7947 7.7947 7.9280 7.9280 8.3101 8.3101 8.3314 8.3314 8.5050 8.5050 8.7537 8.7537 8.8305 8.8305 9.3039 9.3039 9.5310 9.5310 9.6654 9.6654 9.8841 9.8841 10.1672 10.1672 10.5762 10.5762 10.7699 10.7699 10.8221 10.8221 10.8868 10.8868 11.2267 11.2267 11.5654 11.5654 12.1764 12.1764 12.5576 12.5576 k = 0.2857 0.0950-0.0724 ( 3952 PWs) bands (ev): -1.4288 -1.4288 0.2865 0.2865 3.0220 3.0220 3.2712 3.2712 5.7135 5.7135 6.4454 6.4454 6.8709 6.8709 7.2214 7.2214 7.4367 7.4367 7.8066 7.8066 7.9108 7.9108 8.3261 8.3261 8.3459 8.3459 8.4976 8.4976 8.7575 8.7575 8.8520 8.8520 9.2905 9.2905 9.5149 9.5149 9.6508 9.6508 9.8847 9.8847 10.1645 10.1645 10.5850 10.5850 10.7700 10.7700 10.8202 10.8202 10.8670 10.8670 11.2208 11.2208 11.5576 11.5576 12.1815 12.1815 12.6074 12.6074 k = 0.3036 0.1010-0.0769 ( 3952 PWs) bands (ev): -1.3847 -1.3847 0.1960 0.1960 3.0470 3.0470 3.2685 3.2685 5.7076 5.7076 6.5086 6.5086 6.8632 6.8632 7.2504 7.2504 7.4520 7.4520 7.8172 7.8172 7.8927 7.8927 8.3424 8.3424 8.3586 8.3586 8.4885 8.4885 8.7604 8.7604 8.8743 8.8743 9.2792 9.2792 9.4982 9.4982 9.6368 9.6368 9.8857 9.8857 10.1603 10.1603 10.5935 10.5935 10.7697 10.7697 10.8132 10.8132 10.8545 10.8545 11.2160 11.2160 11.5500 11.5500 12.1864 12.1864 12.6478 12.6478 k = 0.3214 0.1069-0.0814 ( 3952 PWs) bands (ev): -1.3381 -1.3381 0.1066 0.1066 3.0694 3.0694 3.2660 3.2660 5.7010 5.7010 6.5705 6.5705 6.8559 6.8559 7.2781 7.2781 7.4723 7.4723 7.8250 7.8250 7.8752 7.8752 8.3584 8.3584 8.3696 8.3696 8.4780 8.4780 8.7621 8.7621 8.8969 8.8969 9.2701 9.2701 9.4813 9.4813 9.6234 9.6234 9.8870 9.8870 10.1547 10.1547 10.6018 10.6018 10.7690 10.7690 10.8021 10.8021 10.8482 10.8482 11.2124 11.2124 11.5426 11.5426 12.1904 12.1904 12.6764 12.6764 k = 0.3393 0.1128-0.0859 ( 3954 PWs) bands (ev): -1.2891 -1.2891 0.0185 0.0185 3.0892 3.0892 3.2637 3.2637 5.6940 5.6940 6.6302 6.6302 6.8493 6.8493 7.3032 7.3032 7.4978 7.4978 7.8254 7.8254 7.8637 7.8637 8.3728 8.3728 8.3801 8.3801 8.4661 8.4661 8.7628 8.7628 8.9193 8.9193 9.2634 9.2634 9.4640 9.4640 9.6110 9.6110 9.8885 9.8885 10.1479 10.1479 10.6100 10.6100 10.7675 10.7675 10.7906 10.7906 10.8445 10.8445 11.2099 11.2099 11.5352 11.5352 12.1929 12.1929 12.7007 12.7007 k = 0.3571 0.1188-0.0905 ( 3953 PWs) bands (ev): -1.2379 -1.2379 -0.0681 -0.0681 3.1065 3.1065 3.2615 3.2615 5.6870 5.6870 6.6866 6.6866 6.8436 6.8436 7.3250 7.3250 7.5276 7.5276 7.8140 7.8140 7.8636 7.8636 8.3821 8.3821 8.3934 8.3934 8.4532 8.4532 8.7622 8.7622 8.9411 8.9411 9.2592 9.2592 9.4467 9.4467 9.5994 9.5994 9.8901 9.8901 10.1403 10.1403 10.6179 10.6179 10.7648 10.7648 10.7810 10.7810 10.8414 10.8414 11.2085 11.2085 11.5279 11.5279 12.1935 12.1935 12.7254 12.7254 k = 0.3750 0.1247-0.0950 ( 3947 PWs) bands (ev): -1.1844 -1.1844 -0.1530 -0.1530 3.1215 3.1215 3.2595 3.2595 5.6803 5.6803 6.7386 6.7386 6.8390 6.8390 7.3439 7.3439 7.5588 7.5588 7.7987 7.7987 7.8691 7.8691 8.3867 8.3867 8.4080 8.4080 8.4405 8.4405 8.7606 8.7606 8.9618 8.9618 9.2575 9.2575 9.4296 9.4296 9.5891 9.5891 9.8917 9.8917 10.1322 10.1322 10.6256 10.6256 10.7604 10.7604 10.7744 10.7744 10.8380 10.8380 11.2081 11.2081 11.5207 11.5207 12.1920 12.1920 12.7520 12.7520 k = 0.3929 0.1307-0.0995 ( 3945 PWs) bands (ev): -1.1290 -1.1290 -0.2358 -0.2358 3.1343 3.1343 3.2578 3.2578 5.6740 5.6740 6.7840 6.7840 6.8371 6.8371 7.3606 7.3606 7.5857 7.5857 7.7877 7.7877 7.8755 7.8755 8.3864 8.3864 8.4205 8.4205 8.4311 8.4311 8.7579 8.7579 8.9809 8.9809 9.2582 9.2582 9.4128 9.4128 9.5797 9.5797 9.8932 9.8932 10.1241 10.1241 10.6330 10.6330 10.7549 10.7549 10.7703 10.7703 10.8346 10.8346 11.2083 11.2083 11.5135 11.5135 12.1883 12.1883 12.7811 12.7811 k = 0.4107 0.1366-0.1040 ( 3942 PWs) bands (ev): -1.0719 -1.0719 -0.3162 -0.3162 3.1449 3.1449 3.2563 3.2563 5.6683 5.6683 6.8132 6.8132 6.8466 6.8466 7.3762 7.3762 7.6014 7.6014 7.7874 7.7874 7.8816 7.8816 8.3793 8.3793 8.4210 8.4210 8.4376 8.4376 8.7547 8.7547 8.9980 8.9980 9.2612 9.2612 9.3965 9.3965 9.5715 9.5715 9.8945 9.8945 10.1164 10.1164 10.6400 10.6400 10.7495 10.7495 10.7672 10.7672 10.8311 10.8311 11.2090 11.2090 11.5067 11.5067 12.1831 12.1831 12.8126 12.8126 k = 0.4286 0.1425-0.1085 ( 3944 PWs) bands (ev): -1.0136 -1.0136 -0.3937 -0.3937 3.1534 3.1534 3.2550 3.2550 5.6635 5.6635 6.8183 6.8183 6.8747 6.8747 7.3914 7.3914 7.6020 7.6020 7.8004 7.8004 7.8868 7.8868 8.3665 8.3665 8.4199 8.4199 8.4487 8.4487 8.7511 8.7511 9.0127 9.0127 9.2659 9.2659 9.3809 9.3809 9.5646 9.5646 9.8957 9.8957 10.1095 10.1095 10.6465 10.6465 10.7448 10.7448 10.7645 10.7645 10.8279 10.8279 11.2098 11.2098 11.5003 11.5003 12.1771 12.1771 12.8455 12.8455 k = 0.4464 0.1485-0.1131 ( 3944 PWs) bands (ev): -0.9553 -0.9553 -0.4670 -0.4670 3.1600 3.1600 3.2540 3.2540 5.6596 5.6596 6.8176 6.8176 6.9023 6.9023 7.4063 7.4063 7.5913 7.5913 7.8214 7.8214 7.8910 7.8910 8.3519 8.3519 8.4203 8.4203 8.4583 8.4583 8.7477 8.7477 9.0246 9.0246 9.2721 9.2721 9.3665 9.3665 9.5591 9.5591 9.8966 9.8966 10.1038 10.1038 10.6522 10.6522 10.7410 10.7410 10.7621 10.7621 10.8252 10.8252 11.2107 11.2107 11.4949 11.4949 12.1712 12.1712 12.8779 12.8779 k = 0.4643 0.1544-0.1176 ( 3940 PWs) bands (ev): -0.8994 -0.8994 -0.5335 -0.5335 3.1647 3.1647 3.2533 3.2533 5.6568 5.6568 6.8163 6.8163 6.9235 6.9235 7.4203 7.4203 7.5762 7.5762 7.8427 7.8427 7.8941 7.8941 8.3387 8.3387 8.4211 8.4211 8.4656 8.4656 8.7448 8.7448 9.0333 9.0333 9.2789 9.2789 9.3540 9.3540 9.5551 9.5551 9.8974 9.8974 10.0995 10.0995 10.6568 10.6568 10.7381 10.7381 10.7601 10.7601 10.8232 10.8232 11.2115 11.2115 11.4906 11.4906 12.1662 12.1662 12.9056 12.9056 k = 0.4821 0.1604-0.1221 ( 3939 PWs) bands (ev): -0.8529 -0.8529 -0.5864 -0.5864 3.1674 3.1674 3.2528 3.2528 5.6551 5.6551 6.8155 6.8155 6.9366 6.9366 7.4313 7.4313 7.5631 7.5631 7.8580 7.8580 7.8960 7.8960 8.3296 8.3296 8.4217 8.4217 8.4702 8.4702 8.7429 8.7429 9.0387 9.0387 9.2848 9.2848 9.3447 9.3447 9.5526 9.5526 9.8978 9.8978 10.0968 10.0968 10.6599 10.6599 10.7363 10.7363 10.7587 10.7587 10.8219 10.8219 11.2120 11.2120 11.4880 11.4880 12.1630 12.1630 12.9234 12.9234 k = 0.5000 0.1663-0.1266 ( 3936 PWs) bands (ev): -0.8326 -0.8326 -0.6089 -0.6089 3.1684 3.1684 3.2527 3.2527 5.6545 5.6545 6.8152 6.8152 6.9410 6.9410 7.4357 7.4357 7.5578 7.5578 7.8636 7.8636 7.8966 7.8966 8.3263 8.3263 8.4219 8.4219 8.4717 8.4717 8.7422 8.7422 9.0406 9.0406 9.2873 9.2873 9.3411 9.3411 9.5517 9.5517 9.8979 9.8979 10.0959 10.0959 10.6609 10.6609 10.7357 10.7357 10.7583 10.7583 10.8215 10.8215 11.2122 11.2122 11.4870 11.4870 12.1618 12.1618 12.9292 12.9292 k = 0.5000 0.1663-0.1266 ( 3936 PWs) bands (ev): -0.8326 -0.8326 -0.6089 -0.6089 3.1684 3.1684 3.2527 3.2527 5.6545 5.6545 6.8152 6.8152 6.9410 6.9410 7.4357 7.4357 7.5578 7.5578 7.8636 7.8636 7.8966 7.8966 8.3263 8.3263 8.4219 8.4219 8.4717 8.4717 8.7422 8.7422 9.0406 9.0406 9.2873 9.2873 9.3411 9.3411 9.5517 9.5517 9.8979 9.8979 10.0959 10.0959 10.6609 10.6609 10.7357 10.7357 10.7583 10.7583 10.8215 10.8215 11.2122 11.2122 11.4870 11.4870 12.1618 12.1618 12.9292 12.9292 k = 0.5043 0.1677-0.1079 ( 3937 PWs) bands (ev): -0.8314 -0.8314 -0.6075 -0.6075 3.1323 3.1323 3.2818 3.2818 5.6597 5.6597 6.8156 6.8156 6.9369 6.9369 7.4296 7.4296 7.5666 7.5666 7.8634 7.8634 7.8958 7.8958 8.3130 8.3130 8.4346 8.4346 8.4718 8.4718 8.7409 8.7409 9.0401 9.0401 9.2743 9.2743 9.3564 9.3564 9.5526 9.5526 9.8966 9.8966 10.0963 10.0963 10.6583 10.6583 10.7369 10.7369 10.7606 10.7606 10.8235 10.8235 11.2115 11.2115 11.4897 11.4897 12.1601 12.1601 12.9264 12.9264 k = 0.5085 0.1691-0.0892 ( 3940 PWs) bands (ev): -0.8278 -0.8278 -0.6035 -0.6035 3.0667 3.0667 3.3268 3.3268 5.6751 5.6751 6.8170 6.8170 6.9248 6.9248 7.4157 7.4157 7.5882 7.5882 7.8628 7.8628 7.8933 7.8933 8.2846 8.2846 8.4592 8.4592 8.4737 8.4737 8.7373 8.7373 9.0389 9.0389 9.2515 9.2515 9.3861 9.3861 9.5549 9.5549 9.8928 9.8928 10.0975 10.0975 10.6518 10.6518 10.7389 10.7389 10.7667 10.7667 10.8308 10.8308 11.2095 11.2095 11.4975 11.4975 12.1550 12.1550 12.9127 12.9127 k = 0.5128 0.1705-0.0705 ( 3943 PWs) bands (ev): -0.8217 -0.8217 -0.5968 -0.5968 2.9911 2.9911 3.3683 3.3683 5.7003 5.7003 6.8190 6.8190 6.9055 6.9055 7.4005 7.4005 7.6152 7.6152 7.8617 7.8617 7.8894 7.8894 8.2529 8.2529 8.4675 8.4675 8.4947 8.4947 8.7312 8.7312 9.0370 9.0370 9.2289 9.2289 9.4201 9.4201 9.5587 9.5587 9.8868 9.8868 10.0994 10.0994 10.6435 10.6435 10.7397 10.7397 10.7735 10.7735 10.8457 10.8457 11.2063 11.2063 11.5106 11.5106 12.1466 12.1466 12.8828 12.8828 k = 0.5171 0.1720-0.0518 ( 3939 PWs) bands (ev): -0.8132 -0.8132 -0.5875 -0.5875 2.9090 2.9090 3.4036 3.4036 5.7345 5.7345 6.8212 6.8212 6.8807 6.8807 7.3872 7.3872 7.6424 7.6424 7.8603 7.8603 7.8842 7.8842 8.2224 8.2224 8.4663 8.4663 8.5239 8.5239 8.7231 8.7231 9.0345 9.0345 9.2086 9.2086 9.4562 9.4562 9.5639 9.5639 9.8789 9.8789 10.1019 10.1019 10.6348 10.6348 10.7386 10.7386 10.7787 10.7787 10.8693 10.8693 11.2020 11.2020 11.5285 11.5285 12.1351 12.1351 12.8449 12.8449 k = 0.5213 0.1734-0.0332 ( 3943 PWs) bands (ev): -0.8023 -0.8023 -0.5755 -0.5755 2.8215 2.8215 3.4322 3.4322 5.7767 5.7767 6.8203 6.8203 6.8550 6.8550 7.3771 7.3771 7.6657 7.6657 7.8586 7.8586 7.8786 7.8786 8.1958 8.1958 8.4634 8.4634 8.5516 8.5516 8.7133 8.7133 9.0317 9.0317 9.1913 9.1913 9.4932 9.4932 9.5704 9.5704 9.8696 9.8696 10.1050 10.1050 10.6261 10.6261 10.7351 10.7351 10.7834 10.7834 10.8993 10.8993 11.1969 11.1969 11.5511 11.5511 12.1210 12.1210 12.8064 12.8064 k = 0.5256 0.1748-0.0145 ( 3942 PWs) bands (ev): -0.7890 -0.7890 -0.5608 -0.5608 2.7294 2.7294 3.4540 3.4540 5.8256 5.8256 6.8023 6.8023 6.8440 6.8440 7.3702 7.3702 7.6808 7.6808 7.8563 7.8563 7.8745 7.8745 8.1752 8.1752 8.4585 8.4585 8.5768 8.5768 8.7022 8.7022 9.0286 9.0286 9.1773 9.1773 9.5291 9.5291 9.5794 9.5794 9.8596 9.8596 10.1086 10.1086 10.6176 10.6176 10.7288 10.7288 10.7891 10.7891 10.9335 10.9335 11.1915 11.1915 11.5780 11.5780 12.1047 12.1047 12.7703 12.7703 k = 0.5298 0.1762 0.0042 ( 3942 PWs) bands (ev): -0.7734 -0.7734 -0.5435 -0.5435 2.6335 2.6335 3.4693 3.4693 5.8798 5.8798 6.7697 6.7697 6.8469 6.8469 7.3662 7.3662 7.6839 7.6839 7.8513 7.8513 7.8767 7.8767 8.1620 8.1620 8.4514 8.4514 8.5988 8.5988 8.6905 8.6905 9.0255 9.0255 9.1667 9.1667 9.5579 9.5579 9.5963 9.5963 9.8495 9.8495 10.1125 10.1125 10.6091 10.6091 10.7199 10.7199 10.7966 10.7966 10.9692 10.9692 11.1864 11.1864 11.6083 11.6083 12.0869 12.0869 12.7377 12.7377 k = 0.5341 0.1776 0.0229 ( 3939 PWs) bands (ev): -0.7554 -0.7554 -0.5235 -0.5235 2.5345 2.5345 3.4783 3.4783 5.9377 5.9377 6.7345 6.7345 6.8536 6.8536 7.3647 7.3647 7.6732 7.6732 7.8431 7.8431 7.8869 7.8869 8.1569 8.1569 8.4415 8.4415 8.6174 8.6174 8.6790 8.6790 9.0225 9.0225 9.1595 9.1595 9.5721 9.5721 9.6275 9.6275 9.8402 9.8402 10.1164 10.1164 10.6005 10.6005 10.7089 10.7089 10.8065 10.8065 11.0040 11.0040 11.1829 11.1829 11.6410 11.6410 12.0681 12.0681 12.7095 12.7095 k = 0.5384 0.1791 0.0416 ( 3941 PWs) bands (ev): -0.7351 -0.7351 -0.5009 -0.5009 2.4328 2.4328 3.4812 3.4812 5.9974 5.9974 6.7008 6.7008 6.8619 6.8619 7.3652 7.3652 7.6504 7.6504 7.8330 7.8330 7.9025 7.9025 8.1595 8.1595 8.4282 8.4282 8.6319 8.6319 8.6686 8.6686 9.0194 9.0194 9.1557 9.1557 9.5781 9.5781 9.6657 9.6657 9.8322 9.8322 10.1202 10.1202 10.5917 10.5917 10.6960 10.6960 10.8185 10.8185 11.0344 11.0344 11.1834 11.1834 11.6747 11.6747 12.0494 12.0494 12.6858 12.6858 k = 0.5426 0.1805 0.0603 ( 3941 PWs) bands (ev): -0.7126 -0.7126 -0.4757 -0.4757 2.3291 2.3291 3.4783 3.4783 6.0566 6.0566 6.6709 6.6709 6.8715 6.8715 7.3672 7.3672 7.6185 7.6185 7.8221 7.8221 7.9208 7.9208 8.1689 8.1689 8.4114 8.4114 8.6410 8.6410 8.6614 8.6614 9.0163 9.0163 9.1551 9.1551 9.5801 9.5801 9.7057 9.7057 9.8264 9.8264 10.1237 10.1237 10.5825 10.5825 10.6815 10.6815 10.8331 10.8331 11.0565 11.0565 11.1912 11.1912 11.7073 11.7073 12.0314 12.0314 12.6671 12.6671 k = 0.5469 0.1819 0.0790 ( 3947 PWs) bands (ev): -0.6879 -0.6879 -0.4478 -0.4478 2.2239 2.2239 3.4699 3.4699 6.1125 6.1125 6.6475 6.6475 6.8821 6.8821 7.3704 7.3704 7.5807 7.5807 7.8105 7.8105 7.9401 7.9401 8.1837 8.1837 8.3910 8.3910 8.6409 8.6409 8.6612 8.6612 9.0131 9.0131 9.1576 9.1576 9.5789 9.5789 9.7459 9.7459 9.8235 9.8235 10.1267 10.1267 10.5727 10.5727 10.6659 10.6659 10.8502 10.8502 11.0673 11.0673 11.2088 11.2088 11.7367 11.7367 12.0150 12.0150 12.6539 12.6539 k = 0.5512 0.1833 0.0977 ( 3945 PWs) bands (ev): -0.6610 -0.6610 -0.4174 -0.4174 2.1175 2.1175 3.4562 3.4562 6.1618 6.1618 6.6336 6.6336 6.8938 6.8938 7.3745 7.3745 7.5395 7.5395 7.7986 7.7986 7.9598 7.9598 8.2026 8.2026 8.3673 8.3673 8.6355 8.6355 8.6645 8.6645 9.0096 9.0096 9.1631 9.1631 9.5744 9.5744 9.7844 9.7844 9.8253 9.8253 10.1290 10.1290 10.5621 10.5621 10.6493 10.6493 10.8702 10.8702 11.0683 11.0683 11.2342 11.2342 11.7606 11.7606 12.0006 12.0006 12.6470 12.6470 k = 0.5554 0.1847 0.1164 ( 3947 PWs) bands (ev): -0.6321 -0.6321 -0.3844 -0.3844 2.0105 2.0105 3.4375 3.4375 6.2008 6.2008 6.6321 6.6321 6.9064 6.9064 7.3788 7.3788 7.4970 7.4970 7.7866 7.7866 7.9795 7.9795 8.2243 8.2243 8.3405 8.3405 8.6296 8.6296 8.6663 8.6663 9.0059 9.0059 9.1714 9.1714 9.5667 9.5667 9.8130 9.8130 9.8396 9.8396 10.1303 10.1303 10.5504 10.5504 10.6321 10.6321 10.8931 10.8931 11.0635 11.0635 11.2636 11.2636 11.7773 11.7773 11.9881 11.9881 12.6473 12.6473 k = 0.5597 0.1861 0.1351 ( 3948 PWs) bands (ev): -0.6012 -0.6012 -0.3489 -0.3489 1.9031 1.9031 3.4141 3.4141 6.2271 6.2271 6.6445 6.6445 6.9199 6.9199 7.3825 7.3825 7.4558 7.4558 7.7745 7.7745 7.9992 7.9992 8.2477 8.2477 8.3113 8.3113 8.6242 8.6242 8.6657 8.6657 9.0017 9.0017 9.1823 9.1823 9.5562 9.5562 9.8248 9.8248 9.8727 9.8727 10.1306 10.1306 10.5374 10.5374 10.6144 10.6144 10.9191 10.9191 11.0556 11.0556 11.2939 11.2939 11.7865 11.7865 11.9768 11.9768 12.6557 12.6557 k = 0.5640 0.1876 0.1538 ( 3946 PWs) bands (ev): -0.5684 -0.5684 -0.3109 -0.3109 1.7958 1.7958 3.3862 3.3862 6.2408 6.2408 6.6694 6.6694 6.9342 6.9342 7.3805 7.3805 7.4227 7.4227 7.7626 7.7626 8.0190 8.0190 8.2704 8.2704 8.2819 8.2819 8.6193 8.6193 8.6627 8.6627 8.9970 8.9970 9.1956 9.1956 9.5433 9.5433 9.8342 9.8342 9.9097 9.9097 10.1295 10.1295 10.5228 10.5228 10.5964 10.5964 10.9483 10.9483 11.0464 11.0464 11.3235 11.3235 11.7889 11.7889 11.9653 11.9653 12.6727 12.6727 k = 0.5682 0.1890 0.1725 ( 3945 PWs) bands (ev): -0.5338 -0.5338 -0.2703 -0.2703 1.6890 1.6890 3.3541 3.3541 6.2447 6.2447 6.7021 6.7021 6.9493 6.9493 7.3600 7.3600 7.4121 7.4121 7.7510 7.7510 8.0387 8.0387 8.2459 8.2459 8.2986 8.2986 8.6148 8.6148 8.6572 8.6572 8.9920 8.9920 9.2112 9.2112 9.5284 9.5284 9.8447 9.8447 9.9462 9.9462 10.1271 10.1271 10.5063 10.5063 10.5783 10.5783 10.9806 10.9806 11.0373 11.0373 11.3512 11.3512 11.7860 11.7860 11.9531 11.9531 12.6983 12.6983 k = 0.5725 0.1904 0.1912 ( 3949 PWs) bands (ev): -0.4976 -0.4976 -0.2273 -0.2273 1.5829 1.5829 3.3180 3.3180 6.2423 6.2423 6.7369 6.7369 6.9651 6.9651 7.3316 7.3316 7.4160 7.4160 7.7398 7.7398 8.0582 8.0582 8.2117 8.2117 8.3238 8.3238 8.6107 8.6107 8.6495 8.6495 8.9865 8.9865 9.2287 9.2287 9.5121 9.5121 9.8566 9.8566 9.9813 9.9813 10.1232 10.1232 10.4878 10.4878 10.5600 10.5600 11.0132 11.0132 11.0318 11.0318 11.3761 11.3761 11.7793 11.7793 11.9403 11.9403 12.7321 12.7321 k = 0.5768 0.1918 0.2099 ( 3952 PWs) bands (ev): -0.4599 -0.4599 -0.1820 -0.1820 1.4778 1.4778 3.2784 3.2784 6.2365 6.2365 6.7680 6.7680 6.9815 6.9815 7.3084 7.3084 7.4240 7.4240 7.7290 7.7290 8.0773 8.0773 8.1765 8.1765 8.3492 8.3492 8.6067 8.6067 8.6399 8.6399 8.9808 8.9808 9.2482 9.2482 9.4948 9.4948 9.8696 9.8696 10.0145 10.0145 10.1179 10.1179 10.4671 10.4671 10.5420 10.5420 11.0162 11.0162 11.0602 11.0602 11.3974 11.3974 11.7697 11.7697 11.9286 11.9286 12.7733 12.7733 k = 0.5810 0.1932 0.2286 ( 3949 PWs) bands (ev): -0.4209 -0.4209 -0.1342 -0.1342 1.3743 1.3743 3.2356 3.2356 6.2290 6.2290 6.7906 6.7906 6.9987 6.9987 7.2943 7.2943 7.4348 7.4348 7.7187 7.7187 8.0956 8.0956 8.1407 8.1407 8.3742 8.3742 8.6029 8.6029 8.6288 8.6288 8.9752 8.9752 9.2695 9.2695 9.4768 9.4768 9.8836 9.8836 10.0451 10.0451 10.1117 10.1117 10.4440 10.4440 10.5240 10.5240 11.0095 11.0095 11.1032 11.1032 11.4143 11.4143 11.7575 11.7575 11.9199 11.9199 12.8211 12.8211 k = 0.5853 0.1947 0.2473 ( 3949 PWs) bands (ev): -0.3810 -0.3810 -0.0842 -0.0842 1.2726 1.2726 3.1899 3.1899 6.2208 6.2208 6.8022 6.8022 7.0164 7.0164 7.2903 7.2903 7.4488 7.4488 7.7090 7.7090 8.1021 8.1021 8.1152 8.1152 8.3984 8.3984 8.5989 8.5989 8.6170 8.6170 8.9696 8.9696 9.2923 9.2923 9.4584 9.4584 9.8983 9.8983 10.0702 10.0702 10.1072 10.1072 10.4187 10.4187 10.5065 10.5065 11.0032 11.0032 11.1505 11.1505 11.4261 11.4261 11.7435 11.7435 11.9163 11.9163 12.8744 12.8744 k = 0.5895 0.1961 0.2660 ( 3961 PWs) bands (ev): -0.3404 -0.3404 -0.0320 -0.0320 1.1733 1.1733 3.1417 3.1417 6.2119 6.2119 6.8029 6.8029 7.0347 7.0347 7.2944 7.2944 7.4671 7.4671 7.7000 7.7000 8.0671 8.0671 8.1295 8.1295 8.4215 8.4215 8.5942 8.5942 8.6058 8.6058 8.9644 8.9644 9.3164 9.3164 9.4399 9.4399 9.9136 9.9136 10.0779 10.0779 10.1162 10.1162 10.3911 10.3911 10.4895 10.4895 10.9980 10.9980 11.2016 11.2016 11.4321 11.4321 11.7281 11.7281 11.9187 11.9187 12.9321 12.9321 k = 0.5938 0.1975 0.2847 ( 3961 PWs) bands (ev): -0.2996 -0.2996 0.0223 0.0223 1.0769 1.0769 3.0914 3.0914 6.2020 6.2020 6.7953 6.7953 7.0537 7.0537 7.3027 7.3027 7.4911 7.4911 7.6915 7.6915 8.0308 8.0308 8.1431 8.1431 8.4428 8.4428 8.5873 8.5873 8.5978 8.5978 8.9598 8.9598 9.3418 9.3418 9.4216 9.4216 9.9294 9.9294 10.0695 10.0695 10.1377 10.1377 10.3616 10.3616 10.4730 10.4730 10.9939 10.9939 11.2561 11.2561 11.4325 11.4325 11.7127 11.7127 11.9277 11.9277 12.9920 12.9920 k = 0.5981 0.1989 0.3034 ( 3965 PWs) bands (ev): -0.2593 -0.2593 0.0784 0.0784 0.9842 0.9842 3.0395 3.0395 6.1907 6.1907 6.7835 6.7835 7.0732 7.0732 7.3110 7.3110 7.5209 7.5209 7.6838 7.6838 7.9949 7.9949 8.1541 8.1541 8.4610 8.4610 8.5797 8.5797 8.5932 8.5932 8.9560 8.9560 9.3676 9.3676 9.4043 9.4043 9.9455 9.9455 10.0564 10.0564 10.1602 10.1602 10.3304 10.3304 10.4571 10.4571 10.9910 10.9910 11.3139 11.3139 11.4276 11.4276 11.6978 11.6978 11.9428 11.9428 13.0433 13.0433 k = 0.6023 0.2003 0.3221 ( 3970 PWs) bands (ev): -0.2202 -0.2202 0.1361 0.1361 0.8962 0.8962 2.9864 2.9864 6.1769 6.1769 6.7709 6.7709 7.0930 7.0930 7.3168 7.3168 7.5557 7.5557 7.6768 7.6768 7.9597 7.9597 8.1617 8.1617 8.4742 8.4742 8.5760 8.5760 8.5900 8.5900 8.9534 8.9534 9.3805 9.3805 9.4014 9.4014 9.9617 9.9617 10.0412 10.0412 10.1812 10.1812 10.2980 10.2980 10.4417 10.4417 10.9890 10.9890 11.3736 11.3736 11.4193 11.4193 11.6841 11.6841 11.9635 11.9635 13.0200 13.0200 k = 0.6066 0.2017 0.3408 ( 3974 PWs) bands (ev): -0.1836 -0.1836 0.1949 0.1949 0.8147 0.8147 2.9326 2.9326 6.1599 6.1599 6.7606 6.7606 7.1131 7.1131 7.3191 7.3191 7.5933 7.5933 7.6708 7.6708 7.9255 7.9255 8.1657 8.1657 8.4806 8.4806 8.5790 8.5790 8.5875 8.5875 8.9522 8.9522 9.3658 9.3658 9.4275 9.4275 9.9773 9.9773 10.0252 10.0252 10.2002 10.2002 10.2651 10.2651 10.4269 10.4269 10.9880 10.9880 11.4018 11.4018 11.4422 11.4422 11.6716 11.6716 11.9890 11.9890 12.9634 12.9634 k = 0.6109 0.2032 0.3595 ( 3974 PWs) bands (ev): -0.1512 -0.1512 0.2539 0.2539 0.7420 0.7420 2.8784 2.8784 6.1392 6.1392 6.7547 6.7547 7.1334 7.1334 7.3176 7.3176 7.6288 7.6288 7.6685 7.6685 7.8930 7.8930 8.1658 8.1658 8.4807 8.4807 8.5843 8.5843 8.5899 8.5899 8.9525 8.9525 9.3496 9.3496 9.4568 9.4568 9.9876 9.9876 10.0133 10.0133 10.2140 10.2140 10.2353 10.2353 10.4127 10.4127 10.9878 10.9878 11.3890 11.3890 11.5068 11.5068 11.6601 11.6601 12.0185 12.0185 12.9010 12.9010 k = 0.6151 0.2046 0.3782 ( 3966 PWs) bands (ev): -0.1253 -0.1253 0.3114 0.3114 0.6821 0.6821 2.8244 2.8244 6.1143 6.1143 6.7544 6.7544 7.1538 7.1538 7.3126 7.3126 7.6439 7.6439 7.6860 7.6860 7.8626 7.8626 8.1622 8.1622 8.4769 8.4769 8.5828 8.5828 8.6037 8.6037 8.9545 8.9545 9.3340 9.3340 9.4873 9.4873 9.9783 9.9783 10.0200 10.0200 10.1945 10.1945 10.2373 10.2373 10.3989 10.3989 10.9885 10.9885 11.3743 11.3743 11.5746 11.5746 11.6492 11.6492 12.0514 12.0514 12.8359 12.8359 k = 0.6194 0.2060 0.3969 ( 3966 PWs) bands (ev): -0.1091 -0.1091 0.3640 0.3640 0.6412 0.6412 2.7710 2.7710 6.0855 6.0855 6.7600 6.7600 7.1739 7.1739 7.3040 7.3040 7.6395 7.6395 7.7203 7.7203 7.8353 7.8353 8.1553 8.1553 8.4714 8.4714 8.5813 8.5813 8.6199 8.6199 8.9581 8.9581 9.3195 9.3195 9.5185 9.5185 9.9593 9.9593 10.0353 10.0353 10.1631 10.1631 10.2502 10.2502 10.3856 10.3856 10.9899 10.9899 11.3601 11.3601 11.6367 11.6367 11.6459 11.6459 12.0871 12.0871 12.7700 12.7700 k = 0.6194 0.2060 0.3969 ( 3966 PWs) bands (ev): -0.1091 -0.1091 0.3640 0.3640 0.6412 0.6412 2.7710 2.7710 6.0855 6.0855 6.7600 6.7600 7.1739 7.1739 7.3040 7.3040 7.6395 7.6395 7.7203 7.7203 7.8353 7.8353 8.1553 8.1553 8.4714 8.4714 8.5813 8.5813 8.6199 8.6199 8.9581 8.9581 9.3195 9.3195 9.5185 9.5185 9.9593 9.9593 10.0353 10.0353 10.1631 10.1631 10.2502 10.2502 10.3856 10.3856 10.9899 10.9899 11.3601 11.3601 11.6367 11.6367 11.6459 11.6459 12.0871 12.0871 12.7700 12.7700 k = 0.6061 0.2016 0.4110 ( 3971 PWs) bands (ev): -0.1004 -0.1004 0.4118 0.4118 0.6193 0.6193 2.6825 2.6825 6.1228 6.1228 6.7974 6.7974 7.1892 7.1892 7.3103 7.3103 7.6391 7.6391 7.7228 7.7228 7.8078 7.8078 8.1289 8.1289 8.4568 8.4568 8.5805 8.5805 8.6383 8.6383 8.9690 8.9690 9.2999 9.2999 9.5525 9.5525 9.9527 9.9527 10.0393 10.0393 10.1372 10.1372 10.2516 10.2516 10.3628 10.3628 11.0033 11.0033 11.3447 11.3447 11.6574 11.6574 11.6784 11.6784 12.0989 12.0989 12.7214 12.7214 k = 0.5929 0.1972 0.4250 ( 3969 PWs) bands (ev): -0.0978 -0.0978 0.4641 0.4641 0.6015 0.6015 2.5969 2.5969 6.1594 6.1594 6.8289 6.8289 7.2046 7.2046 7.3149 7.3149 7.6375 7.6375 7.7270 7.7270 7.7838 7.7838 8.1020 8.1020 8.4435 8.4435 8.5798 8.5798 8.6571 8.6571 8.9790 8.9790 9.2807 9.2807 9.5865 9.5865 9.9442 9.9442 10.0413 10.0413 10.1137 10.1137 10.2528 10.2528 10.3419 10.3419 11.0155 11.0155 11.3308 11.3308 11.6759 11.6759 11.7112 11.7112 12.1089 12.1089 12.6741 12.6741 k = 0.5796 0.1928 0.4391 ( 3984 PWs) bands (ev): -0.0987 -0.0987 0.5133 0.5133 0.5913 0.5913 2.5159 2.5159 6.1943 6.1943 6.8545 6.8545 7.2198 7.2198 7.3184 7.3184 7.6343 7.6343 7.7306 7.7306 7.7658 7.7658 8.0756 8.0756 8.4320 8.4320 8.5793 8.5793 8.6750 8.6750 8.9880 8.9880 9.2621 9.2621 9.6202 9.6202 9.9335 9.9335 10.0404 10.0404 10.0938 10.0938 10.2535 10.2535 10.3233 10.3233 11.0261 11.0261 11.3184 11.3184 11.6928 11.6928 11.7431 11.7431 12.1171 12.1171 12.6290 12.6290 k = 0.5663 0.1884 0.4532 ( 3989 PWs) bands (ev): -0.1015 -0.1015 0.5400 0.5400 0.6052 0.6052 2.4413 2.4413 6.2266 6.2266 6.8739 6.8739 7.2344 7.2344 7.3213 7.3213 7.6289 7.6289 7.7279 7.7279 7.7599 7.7599 8.0503 8.0503 8.4228 8.4228 8.5788 8.5788 8.6915 8.6915 8.9959 8.9959 9.2450 9.2450 9.6534 9.6534 9.9204 9.9204 10.0358 10.0358 10.0793 10.0793 10.2540 10.2540 10.3073 10.3073 11.0351 11.0351 11.3080 11.3080 11.7079 11.7079 11.7732 11.7732 12.1235 12.1235 12.5871 12.5871 k = 0.5531 0.1839 0.4672 ( 3987 PWs) bands (ev): -0.1050 -0.1050 0.5393 0.5393 0.6449 0.6449 2.3753 2.3753 6.2554 6.2554 6.8877 6.8877 7.2479 7.2479 7.3242 7.3242 7.6216 7.6216 7.7196 7.7196 7.7649 7.7649 8.0272 8.0272 8.4156 8.4156 8.5785 8.5785 8.7058 8.7058 9.0026 9.0026 9.2297 9.2297 9.6860 9.6860 9.9046 9.9046 10.0274 10.0274 10.0709 10.0709 10.2542 10.2542 10.2944 10.2944 11.0425 11.0425 11.2994 11.2994 11.7207 11.7207 11.8006 11.8006 12.1283 12.1283 12.5497 12.5497 k = 0.5398 0.1795 0.4813 ( 3986 PWs) bands (ev): -0.1083 -0.1083 0.5331 0.5331 0.6857 0.6857 2.3202 2.3202 6.2794 6.2794 6.8967 6.8967 7.2595 7.2595 7.3270 7.3270 7.6133 7.6133 7.7122 7.7122 7.7731 7.7731 8.0071 8.0071 8.4104 8.4104 8.5782 8.5782 8.7176 8.7176 9.0080 9.0080 9.2170 9.2170 9.7175 9.7175 9.8863 9.8863 10.0177 10.0177 10.0666 10.0666 10.2541 10.2541 10.2845 10.2845 11.0483 11.0483 11.2928 11.2928 11.7311 11.7311 11.8241 11.8241 12.1316 12.1316 12.5182 12.5182 k = 0.5265 0.1751 0.4954 ( 3990 PWs) bands (ev): -0.1109 -0.1109 0.5276 0.5276 0.7185 0.7185 2.2784 2.2784 6.2975 6.2975 6.9019 6.9019 7.2686 7.2686 7.3295 7.3295 7.6054 7.6054 7.7073 7.7073 7.7809 7.7809 7.9913 7.9913 8.4069 8.4069 8.5780 8.5780 8.7263 8.7263 9.0119 9.0119 9.2074 9.2074 9.7473 9.7473 9.8659 9.8659 10.0094 10.0094 10.0646 10.0646 10.2538 10.2538 10.2777 10.2777 11.0523 11.0523 11.2881 11.2881 11.7388 11.7388 11.8423 11.8423 12.1337 12.1337 12.4941 12.4941 k = 0.5133 0.1707 0.5095 ( 3990 PWs) bands (ev): -0.1126 -0.1126 0.5241 0.5241 0.7395 0.7395 2.2522 2.2522 6.3089 6.3089 6.9044 6.9044 7.2743 7.2743 7.3313 7.3313 7.5999 7.5999 7.7046 7.7046 7.7864 7.7864 7.9810 7.9810 8.4049 8.4049 8.5778 8.5778 8.7317 8.7317 9.0143 9.0143 9.2015 9.2015 9.7735 9.7735 9.8453 9.8453 10.0040 10.0040 10.0636 10.0636 10.2534 10.2534 10.2737 10.2737 11.0548 11.0548 11.2853 11.2853 11.7435 11.7435 11.8540 11.8540 12.1349 12.1349 12.4789 12.4789 k = 0.5000 0.1663 0.5235 ( 3994 PWs) bands (ev): -0.1132 -0.1132 0.5229 0.5229 0.7468 0.7468 2.2433 2.2433 6.3127 6.3127 6.9051 6.9051 7.2763 7.2763 7.3320 7.3320 7.5979 7.5979 7.7038 7.7038 7.7884 7.7884 7.9775 7.9775 8.4043 8.4043 8.5777 8.5777 8.7335 8.7335 9.0151 9.0151 9.1995 9.1995 9.7871 9.7871 9.8335 9.8335 10.0022 10.0022 10.0632 10.0632 10.2532 10.2532 10.2725 10.2725 11.0556 11.0556 11.2844 11.2844 11.7450 11.7450 11.8580 11.8580 12.1353 12.1353 12.4736 12.4736 k = 0.5000 0.1663 0.5235 ( 3994 PWs) bands (ev): -0.1132 -0.1132 0.5229 0.5229 0.7468 0.7468 2.2433 2.2433 6.3127 6.3127 6.9051 6.9051 7.2763 7.2763 7.3320 7.3320 7.5979 7.5979 7.7038 7.7038 7.7884 7.7884 7.9775 7.9775 8.4043 8.4043 8.5777 8.5777 8.7335 8.7335 9.0151 9.0151 9.1995 9.1995 9.7871 9.7871 9.8335 9.8335 10.0022 10.0022 10.0632 10.0632 10.2532 10.2532 10.2725 10.2725 11.0556 11.0556 11.2844 11.2844 11.7450 11.7450 11.8580 11.8580 12.1353 12.1353 12.4736 12.4736 k = 0.5062 0.1475 0.5235 ( 3986 PWs) bands (ev): -0.1119 -0.1119 0.5241 0.5241 0.7479 0.7479 2.2441 2.2441 6.3108 6.3108 6.9027 6.9027 7.2740 7.2740 7.3317 7.3317 7.5955 7.5955 7.6862 7.6862 7.7876 7.7876 7.9948 7.9948 8.4027 8.4027 8.5806 8.5806 8.7336 8.7336 9.0152 9.0152 9.2003 9.2003 9.7867 9.7867 9.8322 9.8322 10.0036 10.0036 10.0626 10.0626 10.2517 10.2517 10.2740 10.2740 11.0553 11.0553 11.2851 11.2851 11.7446 11.7446 11.8509 11.8509 12.1324 12.1324 12.4777 12.4777 k = 0.5125 0.1288 0.5235 ( 3970 PWs) bands (ev): -0.1080 -0.1080 0.5278 0.5278 0.7510 0.7510 2.2467 2.2467 6.3048 6.3048 6.8955 6.8955 7.2668 7.2668 7.3307 7.3307 7.5885 7.5885 7.6418 7.6418 7.7877 7.7877 8.0364 8.0364 8.3985 8.3985 8.5889 8.5889 8.7341 8.7341 9.0157 9.0157 9.2026 9.2026 9.7851 9.7851 9.8284 9.8284 10.0077 10.0077 10.0604 10.0604 10.2471 10.2471 10.2780 10.2780 11.0542 11.0542 11.2873 11.2873 11.7425 11.7425 11.8308 11.8308 12.1243 12.1243 12.4892 12.4892 k = 0.5187 0.1100 0.5235 ( 3976 PWs) bands (ev): -0.1016 -0.1016 0.5339 0.5339 0.7562 0.7562 2.2510 2.2510 6.2945 6.2945 6.8832 6.8832 7.2536 7.2536 7.3291 7.3291 7.5747 7.5747 7.5876 7.5876 7.7898 7.7898 8.0876 8.0876 8.3924 8.3924 8.6012 8.6012 8.7348 8.7348 9.0164 9.0164 9.2064 9.2064 9.7823 9.7823 9.8220 9.8220 10.0145 10.0145 10.0571 10.0571 10.2402 10.2402 10.2840 10.2840 11.0523 11.0523 11.2907 11.2907 11.7346 11.7346 11.8035 11.8035 12.1124 12.1124 12.5065 12.5065 k = 0.5250 0.0912 0.5235 ( 3976 PWs) bands (ev): -0.0925 -0.0925 0.5424 0.5424 0.7636 0.7636 2.2569 2.2569 6.2797 6.2797 6.8654 6.8654 7.2331 7.2331 7.3271 7.3271 7.5232 7.5232 7.5653 7.5653 7.7933 7.7933 8.1410 8.1410 8.3856 8.3856 8.6168 8.6168 8.7358 8.7358 9.0173 9.0173 9.2116 9.2116 9.7785 9.7785 9.8131 9.8131 10.0236 10.0236 10.0529 10.0529 10.2314 10.2314 10.2918 10.2918 11.0494 11.0494 11.2953 11.2953 11.7094 11.7094 11.7827 11.7827 12.0985 12.0985 12.5278 12.5278 k = 0.5312 0.0725 0.5235 ( 3988 PWs) bands (ev): -0.0809 -0.0809 0.5533 0.5533 0.7729 0.7729 2.2645 2.2645 6.2597 6.2597 6.8418 6.8418 7.2032 7.2032 7.3243 7.3243 7.4675 7.4675 7.5489 7.5489 7.7979 7.7979 8.1933 8.1933 8.3787 8.3787 8.6345 8.6345 8.7371 8.7371 9.0184 9.0184 9.2179 9.2179 9.7734 9.7734 9.8018 9.8018 10.0347 10.0347 10.0482 10.0482 10.2211 10.2211 10.3009 10.3009 11.0455 11.0455 11.3007 11.3007 11.6620 11.6620 11.7759 11.7759 12.0841 12.0841 12.5514 12.5514 k = 0.5374 0.0537 0.5235 ( 3984 PWs) bands (ev): -0.0668 -0.0668 0.5666 0.5666 0.7843 0.7843 2.2737 2.2737 6.2341 6.2341 6.8119 6.8119 7.1623 7.1623 7.3208 7.3208 7.4199 7.4199 7.5318 7.5318 7.8034 7.8034 8.2430 8.2430 8.3726 8.3726 8.6537 8.6537 8.7389 8.7389 9.0198 9.0198 9.2253 9.2253 9.7672 9.7672 9.7885 9.7885 10.0419 10.0419 10.0491 10.0491 10.2098 10.2098 10.3114 10.3114 11.0404 11.0404 11.3065 11.3065 11.6018 11.6018 11.7760 11.7760 12.0704 12.0704 12.5758 12.5758 k = 0.5437 0.0349 0.5235 ( 3980 PWs) bands (ev): -0.0500 -0.0500 0.5822 0.5822 0.7977 0.7977 2.2843 2.2843 6.2022 6.2022 6.7753 6.7753 7.1105 7.1105 7.3161 7.3161 7.3827 7.3827 7.5150 7.5150 7.8096 7.8096 8.2888 8.2888 8.3675 8.3675 8.6738 8.6738 8.7413 8.7413 9.0214 9.0214 9.2334 9.2334 9.7593 9.7593 9.7735 9.7735 10.0374 10.0374 10.0632 10.0632 10.1979 10.1979 10.3230 10.3230 11.0341 11.0341 11.3125 11.3125 11.5351 11.5351 11.7787 11.7787 12.0583 12.0583 12.6000 12.6000 k = 0.5499 0.0162 0.5235 ( 3980 PWs) bands (ev): -0.0307 -0.0307 0.6002 0.6002 0.8131 0.8131 2.2964 2.2964 6.1634 6.1634 6.7317 6.7317 7.0504 7.0504 7.3097 7.3097 7.3554 7.3554 7.4993 7.4993 7.8166 7.8166 8.3294 8.3294 8.3646 8.3646 8.6945 8.6945 8.7444 8.7444 9.0233 9.0233 9.2420 9.2420 9.7480 9.7480 9.7587 9.7587 10.0327 10.0327 10.0788 10.0788 10.1856 10.1856 10.3353 10.3353 11.0266 11.0266 11.3179 11.3179 11.4652 11.4652 11.7828 11.7828 12.0483 12.0483 12.6233 12.6233 k = 0.5562-0.0026 0.5235 ( 3978 PWs) bands (ev): -0.0089 -0.0089 0.6205 0.6205 0.8303 0.8303 2.3097 2.3097 6.1171 6.1171 6.6810 6.6810 6.9858 6.9858 7.3012 7.3012 7.3360 7.3360 7.4854 7.4854 7.8243 7.8243 8.3535 8.3535 8.3747 8.3747 8.7156 8.7156 8.7488 8.7488 9.0253 9.0253 9.2508 9.2508 9.7309 9.7309 9.7469 9.7469 10.0284 10.0284 10.0951 10.0951 10.1736 10.1736 10.3484 10.3484 11.0177 11.0177 11.3217 11.3217 11.3945 11.3945 11.7876 11.7876 12.0406 12.0406 12.6452 12.6452 k = 0.5624-0.0214 0.5235 ( 3978 PWs) bands (ev): 0.0155 0.0155 0.6429 0.6429 0.8494 0.8494 2.3243 2.3243 6.0632 6.0632 6.6234 6.6234 6.9196 6.9196 7.2914 7.2914 7.3221 7.3221 7.4738 7.4738 7.8327 7.8327 8.3550 8.3550 8.4034 8.4034 8.7365 8.7365 8.7549 8.7549 9.0274 9.0274 9.2597 9.2597 9.7101 9.7101 9.7360 9.7360 10.0248 10.0248 10.1113 10.1113 10.1624 10.1624 10.3619 10.3619 11.0076 11.0076 11.3098 11.3098 11.3380 11.3380 11.7927 11.7927 12.0351 12.0351 12.6654 12.6654 k = 0.5686-0.0401 0.5235 ( 3974 PWs) bands (ev): 0.0423 0.0423 0.6676 0.6676 0.8703 0.8703 2.3399 2.3399 6.0016 6.0016 6.5591 6.5591 6.8538 6.8538 7.2815 7.2815 7.3110 7.3110 7.4647 7.4647 7.8419 7.8419 8.3548 8.3548 8.4293 8.4293 8.7558 8.7558 8.7645 8.7645 9.0297 9.0297 9.2683 9.2683 9.6875 9.6875 9.7250 9.7250 10.0220 10.0220 10.1253 10.1253 10.1540 10.1540 10.3760 10.3760 10.9963 10.9963 11.2461 11.2461 11.3327 11.3327 11.7979 11.7979 12.0314 12.0314 12.6838 12.6838 k = 0.5749-0.0589 0.5235 ( 3982 PWs) bands (ev): 0.0717 0.0717 0.6944 0.6944 0.8929 0.8929 2.3564 2.3564 5.9327 5.9327 6.4886 6.4886 6.7895 6.7895 7.2724 7.2724 7.3013 7.3013 7.4579 7.4579 7.8518 7.8518 8.3554 8.3554 8.4497 8.4497 8.7693 8.7693 8.7821 8.7821 9.0321 9.0321 9.2762 9.2762 9.6635 9.6635 9.7132 9.7132 10.0202 10.0202 10.1289 10.1289 10.1561 10.1561 10.3903 10.3903 10.9838 10.9838 11.1771 11.1771 11.3322 11.3322 11.8027 11.8027 12.0282 12.0282 12.7001 12.7001 k = 0.5811-0.0777 0.5235 ( 3976 PWs) bands (ev): 0.1036 0.1036 0.7232 0.7232 0.9171 0.9171 2.3735 2.3735 5.8574 5.8574 6.4126 6.4126 6.7272 6.7272 7.2641 7.2641 7.2929 7.2929 7.4531 7.4531 7.8625 7.8625 8.3570 8.3570 8.4641 8.4641 8.7820 8.7820 8.8029 8.8029 9.0346 9.0346 9.2835 9.2835 9.6385 9.6385 9.7009 9.7009 10.0194 10.0194 10.1221 10.1221 10.1689 10.1689 10.4049 10.4049 10.9702 10.9702 11.1095 11.1095 11.3303 11.3303 11.8066 11.8066 12.0239 12.0239 12.7141 12.7141 k = 0.5874-0.0964 0.5235 ( 3976 PWs) bands (ev): 0.1379 0.1379 0.7541 0.7541 0.9429 0.9429 2.3911 2.3911 5.7766 5.7766 6.3318 6.3318 6.6670 6.6670 7.2555 7.2555 7.2866 7.2866 7.4500 7.4500 7.8739 7.8739 8.3597 8.3597 8.4725 8.4725 8.7965 8.7965 8.8240 8.8240 9.0372 9.0372 9.2899 9.2899 9.6131 9.6131 9.6882 9.6882 10.0197 10.0197 10.1131 10.1131 10.1837 10.1837 10.4197 10.4197 10.9554 10.9554 11.0443 11.0443 11.3262 11.3262 11.8090 11.8090 12.0157 12.0157 12.7252 12.7252 k = 0.5936-0.1152 0.5235 ( 3980 PWs) bands (ev): 0.1747 0.1747 0.7868 0.7868 0.9700 0.9700 2.4089 2.4089 5.6915 5.6915 6.2467 6.2467 6.6085 6.6085 7.2457 7.2457 7.2833 7.2833 7.4480 7.4480 7.8861 7.8861 8.3635 8.3635 8.4751 8.4751 8.8130 8.8130 8.8451 8.8451 9.0399 9.0399 9.2950 9.2950 9.5875 9.5875 9.6751 9.6751 10.0208 10.0208 10.1040 10.1040 10.1981 10.1981 10.4346 10.4346 10.9394 10.9394 10.9819 10.9819 11.3197 11.3197 11.8092 11.8092 12.0003 12.0003 12.7300 12.7300 k = 0.5999-0.1339 0.5235 ( 3980 PWs) bands (ev): 0.2139 0.2139 0.8212 0.8212 0.9985 0.9985 2.4266 2.4266 5.6035 5.6035 6.1582 6.1582 6.5516 6.5516 7.2339 7.2339 7.2834 7.2834 7.4468 7.4468 7.8990 7.8990 8.3683 8.3683 8.4724 8.4724 8.8311 8.8311 8.8660 8.8660 9.0427 9.0427 9.2990 9.2990 9.5619 9.5619 9.6620 9.6620 10.0227 10.0227 10.0956 10.0956 10.2116 10.2116 10.4495 10.4495 10.9184 10.9184 10.9266 10.9266 11.3107 11.3107 11.8059 11.8059 11.9739 11.9739 12.7154 12.7154 k = 0.6061-0.1527 0.5235 ( 3976 PWs) bands (ev): 0.2555 0.2555 0.8574 0.8574 1.0282 1.0282 2.4438 2.4438 5.5138 5.5138 6.0670 6.0670 6.4961 6.4961 7.2204 7.2204 7.2867 7.2867 7.4461 7.4461 7.9128 7.9128 8.3742 8.3742 8.4649 8.4649 8.8501 8.8501 8.8866 8.8866 9.0457 9.0457 9.3015 9.3015 9.5368 9.5368 9.6491 9.6491 10.0252 10.0252 10.0879 10.0879 10.2239 10.2239 10.4644 10.4644 10.8654 10.8654 10.9056 10.9056 11.2992 11.2992 11.7978 11.7978 11.9342 11.9342 12.6844 12.6844 k = 0.6123-0.1715 0.5235 ( 3980 PWs) bands (ev): 0.2995 0.2995 0.8951 0.8951 1.0588 1.0588 2.4602 2.4602 5.4235 5.4235 5.9738 5.9738 6.4417 6.4417 7.2052 7.2052 7.2925 7.2925 7.4455 7.4455 7.9273 7.9273 8.3810 8.3810 8.4530 8.4530 8.8697 8.8697 8.9068 8.9068 9.0489 9.0489 9.3025 9.3025 9.5125 9.5125 9.6365 9.6365 10.0277 10.0277 10.0814 10.0814 10.2349 10.2349 10.4792 10.4792 10.8127 10.8127 10.8865 10.8865 11.2849 11.2849 11.7830 11.7830 11.8812 11.8812 12.6625 12.6625 k = 0.6186-0.1902 0.5235 ( 3976 PWs) bands (ev): 0.3458 0.3458 0.9342 0.9342 1.0903 1.0903 2.4755 2.4755 5.3341 5.3341 5.8791 5.8791 6.3885 6.3885 7.1885 7.1885 7.3005 7.3005 7.4448 7.4448 7.9426 7.9426 8.3886 8.3886 8.4373 8.4373 8.8891 8.8891 8.9263 8.9263 9.0524 9.0524 9.3021 9.3021 9.4891 9.4891 9.6248 9.6248 10.0295 10.0295 10.0767 10.0767 10.2447 10.2447 10.4939 10.4939 10.7636 10.7636 10.8666 10.8666 11.2677 11.2677 11.7593 11.7593 11.8183 11.8183 12.6312 12.6312 k = 0.6248-0.2090 0.5235 ( 3976 PWs) bands (ev): 0.3944 0.3944 0.9745 0.9745 1.1225 1.1225 2.4890 2.4890 5.2464 5.2464 5.7838 5.7838 6.3363 6.3363 7.1702 7.1702 7.3104 7.3104 7.4436 7.4436 7.9588 7.9588 8.3966 8.3966 8.4184 8.4184 8.9081 8.9081 8.9452 8.9452 9.0562 9.0562 9.3001 9.3001 9.4671 9.4671 9.6141 9.6141 10.0297 10.0297 10.0744 10.0744 10.2530 10.2530 10.5083 10.5083 10.7181 10.7181 10.8456 10.8456 11.2472 11.2472 11.7221 11.7221 11.7522 11.7522 12.5747 12.5747 k = 0.6311-0.2278 0.5235 ( 3974 PWs) bands (ev): 0.4453 0.4453 1.0159 1.0159 1.1551 1.1551 2.5004 2.5004 5.1617 5.1617 5.6883 5.6883 6.2852 6.2852 7.1503 7.1503 7.3218 7.3218 7.4419 7.4419 7.9758 7.9758 8.3924 8.3924 8.4091 8.4091 8.9261 8.9261 8.9631 8.9631 9.0607 9.0607 9.2966 9.2966 9.4468 9.4468 9.6049 9.6049 10.0278 10.0278 10.0750 10.0750 10.2600 10.2600 10.5221 10.5221 10.6766 10.6766 10.8235 10.8235 11.2228 11.2228 11.6629 11.6629 11.6947 11.6947 12.5299 12.5299 k = 0.6373-0.2465 0.5235 ( 3978 PWs) bands (ev): 0.4983 0.4983 1.0580 1.0580 1.1880 1.1880 2.5090 2.5090 5.0810 5.0810 5.5933 5.5933 6.2355 6.2355 7.1285 7.1285 7.3344 7.3344 7.4395 7.4395 7.9936 7.9936 8.3672 8.3672 8.4180 8.4180 8.9426 8.9426 8.9798 8.9798 9.0657 9.0657 9.2917 9.2917 9.4286 9.4286 9.5975 9.5975 10.0238 10.0238 10.0779 10.0779 10.2658 10.2658 10.5347 10.5347 10.6397 10.6397 10.8001 10.8001 11.1940 11.1940 11.5930 11.5930 11.6382 11.6382 12.4987 12.4987 k = 0.6435-0.2653 0.5235 ( 3982 PWs) bands (ev): 0.5536 0.5536 1.1007 1.1007 1.2208 1.2208 2.5145 2.5145 5.0052 5.0052 5.4995 5.4995 6.1872 6.1872 7.1048 7.1048 7.3480 7.3480 7.4363 7.4363 8.0122 8.0122 8.3379 8.3379 8.4284 8.4284 8.9574 8.9574 8.9952 8.9952 9.0716 9.0716 9.2854 9.2854 9.4126 9.4126 9.5921 9.5921 10.0184 10.0184 10.0823 10.0823 10.2705 10.2705 10.5440 10.5440 10.6096 10.6096 10.7752 10.7752 11.1601 11.1601 11.5248 11.5248 11.5746 11.5746 12.4803 12.4803 k = 0.6498-0.2841 0.5235 ( 3978 PWs) bands (ev): 0.6109 0.6109 1.1437 1.1437 1.2533 1.2533 2.5163 2.5163 4.9352 4.9352 5.4074 5.4074 6.1407 6.1407 7.0789 7.0789 7.3624 7.3624 7.4321 7.4321 8.0318 8.0318 8.3055 8.3055 8.4393 8.4393 8.9700 8.9700 9.0091 9.0091 9.0783 9.0783 9.2780 9.2780 9.3996 9.3996 9.5892 9.5892 10.0123 10.0123 10.0872 10.0872 10.2741 10.2741 10.5431 10.5431 10.5933 10.5933 10.7487 10.7487 11.1208 11.1208 11.4614 11.4614 11.5050 11.5050 12.4734 12.4734 k = 0.6560-0.3028 0.5235 ( 3976 PWs) bands (ev): 0.6703 0.6703 1.1866 1.1866 1.2853 1.2853 2.5140 2.5140 4.8718 4.8718 5.3176 5.3176 6.0962 6.0962 7.0508 7.0508 7.3772 7.3772 7.4271 7.4271 8.0521 8.0521 8.2701 8.2701 8.4502 8.4502 8.9805 8.9805 9.0215 9.0215 9.0853 9.0853 9.2698 9.2698 9.3898 9.3898 9.5889 9.5889 10.0058 10.0058 10.0920 10.0920 10.2767 10.2767 10.5272 10.5272 10.5950 10.5950 10.7204 10.7204 11.0766 11.0766 11.4020 11.4020 11.4336 11.4336 12.4759 12.4759 k = 0.6623-0.3216 0.5235 ( 3980 PWs) bands (ev): 0.7316 0.7316 1.2290 1.2290 1.3164 1.3164 2.5072 2.5072 4.8157 4.8157 5.2307 5.2307 6.0541 6.0541 7.0201 7.0201 7.3922 7.3922 7.4213 7.4213 8.0731 8.0731 8.2320 8.2320 8.4611 8.4611 8.9886 8.9886 9.0327 9.0327 9.0923 9.0923 9.2608 9.2608 9.3835 9.3835 9.5912 9.5912 9.9989 9.9989 10.0961 10.0961 10.2785 10.2785 10.5067 10.5067 10.6043 10.6043 10.6900 10.6900 11.0287 11.0287 11.3370 11.3370 11.3722 11.3722 12.4859 12.4859 k = 0.6685-0.3404 0.5235 ( 3974 PWs) bands (ev): 0.7947 0.7947 1.2704 1.2704 1.3462 1.3462 2.4959 2.4959 4.7674 4.7674 5.1474 5.1474 6.0147 6.0147 6.9870 6.9870 7.4060 7.4060 7.4158 7.4158 8.0947 8.0947 8.1915 8.1915 8.4715 8.4715 8.9947 8.9947 9.0427 9.0427 9.0985 9.0985 9.2514 9.2514 9.3813 9.3813 9.5963 9.5963 9.9917 9.9917 10.0991 10.0991 10.2796 10.2796 10.4872 10.4872 10.6144 10.6144 10.6582 10.6582 10.9794 10.9794 11.2618 11.2618 11.3265 11.3265 12.5013 12.5013 k = 0.6747-0.3591 0.5235 ( 3976 PWs) bands (ev): 0.8596 0.8596 1.3103 1.3103 1.3745 1.3745 2.4800 2.4800 4.7274 4.7274 5.0683 5.0683 5.9784 5.9784 6.9512 6.9512 7.4049 7.4049 7.4242 7.4242 8.1146 8.1146 8.1507 8.1507 8.4812 8.4812 8.9988 8.9988 9.0521 9.0521 9.1034 9.1034 9.2419 9.2419 9.3832 9.3832 9.6039 9.6039 9.9841 9.9841 10.1007 10.1007 10.2800 10.2800 10.4699 10.4699 10.6115 10.6115 10.6371 10.6371 10.9308 10.9308 11.1847 11.1847 11.2886 11.2886 12.5195 12.5195 k = 0.6810-0.3779 0.5235 ( 3976 PWs) bands (ev): 0.9260 0.9260 1.3479 1.3479 1.4009 1.4009 2.4598 2.4598 4.6956 4.6956 4.9938 4.9938 5.9456 5.9456 6.9126 6.9126 7.3965 7.3965 7.4387 7.4387 8.0971 8.0971 8.1457 8.1457 8.4899 8.4899 9.0015 9.0015 9.0612 9.0612 9.1065 9.1065 9.2324 9.2324 9.3894 9.3894 9.6140 9.6140 9.9760 9.9760 10.1005 10.1005 10.2798 10.2798 10.4548 10.4548 10.5778 10.5778 10.6441 10.6441 10.8851 10.8851 11.1094 11.1094 11.2550 11.2550 12.5347 12.5347 k = 0.6872-0.3967 0.5235 ( 3976 PWs) bands (ev): 0.9936 0.9936 1.3824 1.3824 1.4252 1.4252 2.4361 2.4361 4.6722 4.6722 4.9248 4.9248 5.9168 5.9168 6.8713 6.8713 7.3868 7.3868 7.4532 7.4532 8.0505 8.0505 8.1681 8.1681 8.4973 8.4973 9.0027 9.0027 9.0702 9.0702 9.1079 9.1079 9.2232 9.2232 9.3994 9.3994 9.6260 9.6260 9.9670 9.9670 10.0985 10.0985 10.2791 10.2791 10.4416 10.4416 10.5378 10.5378 10.6548 10.6548 10.8435 10.8435 11.0382 11.0382 11.2243 11.2243 12.5236 12.5236 k = 0.6935-0.4154 0.5235 ( 3978 PWs) bands (ev): 1.0621 1.0621 1.4129 1.4129 1.4473 1.4473 2.4096 2.4096 4.6567 4.6567 4.8617 4.8617 5.8924 5.8924 6.8271 6.8271 7.3763 7.3763 7.4673 7.4673 8.0003 8.0003 8.1924 8.1924 8.5033 8.5033 9.0029 9.0029 9.0793 9.0793 9.1080 9.1080 9.2146 9.2146 9.4129 9.4129 9.6396 9.6396 9.9566 9.9566 10.0945 10.0945 10.2778 10.2778 10.4294 10.4294 10.4965 10.4965 10.6651 10.6651 10.8066 10.8066 10.9727 10.9727 11.1955 11.1955 12.4924 12.4924 k = 0.6997-0.4342 0.5235 ( 3978 PWs) bands (ev): 1.1308 1.1308 1.4382 1.4382 1.4672 1.4672 2.3816 2.3816 4.6489 4.6489 4.8052 4.8052 5.8729 5.8729 6.7802 6.7802 7.3648 7.3648 7.4807 7.4807 7.9478 7.9478 8.2176 8.2176 8.5077 8.5077 9.0021 9.0021 9.0885 9.0885 9.1073 9.1073 9.2070 9.2070 9.4292 9.4292 9.6543 9.6543 9.9445 9.9445 10.0885 10.0885 10.2759 10.2759 10.4172 10.4172 10.4559 10.4559 10.6742 10.6742 10.7746 10.7746 10.9152 10.9152 11.1681 11.1681 12.4521 12.4521 k = 0.7059-0.4529 0.5235 ( 3976 PWs) bands (ev): 1.1986 1.1986 1.4570 1.4570 1.4857 1.4857 2.3537 2.3537 4.6481 4.6481 4.7558 4.7558 5.8587 5.8587 6.7307 6.7307 7.3526 7.3526 7.4934 7.4934 7.8934 7.8934 8.2432 8.2432 8.5104 8.5104 9.0004 9.0004 9.0961 9.0961 9.1076 9.1076 9.2011 9.2011 9.4479 9.4479 9.6693 9.6693 9.9300 9.9300 10.0809 10.0809 10.2732 10.2732 10.4017 10.4017 10.4202 10.4202 10.6811 10.6811 10.7473 10.7473 10.8675 10.8675 11.1417 11.1417 12.4065 12.4065 k = 0.7122-0.4717 0.5235 ( 3972 PWs) bands (ev): 1.2631 1.2631 1.4680 1.4680 1.5045 1.5045 2.3273 2.3273 4.6538 4.6538 4.7140 4.7140 5.8503 5.8503 6.6785 6.6785 7.3396 7.3396 7.5052 7.5052 7.8373 7.8373 8.2691 8.2691 8.5115 8.5115 8.9979 8.9979 9.0979 9.0979 9.1126 9.1126 9.1981 9.1981 9.4685 9.4685 9.6838 9.6838 9.9125 9.9125 10.0721 10.0721 10.2695 10.2695 10.3743 10.3743 10.3989 10.3989 10.6848 10.6848 10.7246 10.7246 10.8319 10.8319 11.1162 11.1162 12.3607 12.3607 k = 0.7184-0.4905 0.5235 ( 3968 PWs) bands (ev): 1.3199 1.3199 1.4700 1.4700 1.5277 1.5277 2.3041 2.3041 4.6650 4.6650 4.6805 4.6805 5.8480 5.8480 6.6239 6.6239 7.3258 7.3258 7.5161 7.5161 7.7798 7.7798 8.2952 8.2952 8.5110 8.5110 8.9946 8.9946 9.0959 9.0959 9.1190 9.1190 9.1996 9.1996 9.4905 9.4905 9.6967 9.6967 9.8913 9.8913 10.0629 10.0629 10.2637 10.2637 10.3445 10.3445 10.3841 10.3841 10.6844 10.6844 10.7062 10.7062 10.8096 10.8096 11.0915 11.0915 12.3164 12.3164 k = 0.7247-0.5092 0.5235 ( 3968 PWs) bands (ev): 1.3619 1.3619 1.4619 1.4619 1.5620 1.5620 2.2852 2.2852 4.6543 4.6543 4.6824 4.6824 5.8521 5.8521 6.5671 6.5671 7.3113 7.3113 7.5259 7.5259 7.7210 7.7210 8.3212 8.3212 8.5093 8.5093 8.9906 8.9906 9.0929 9.0929 9.1228 9.1228 9.2073 9.2073 9.5136 9.5136 9.7069 9.7069 9.8662 9.8662 10.0545 10.0545 10.2543 10.2543 10.3205 10.3205 10.3702 10.3702 10.6808 10.6808 10.6917 10.6917 10.7997 10.7997 11.0676 11.0676 12.2745 12.2745 k = 0.7309-0.5280 0.5235 ( 3970 PWs) bands (ev): 1.3841 1.3841 1.4435 1.4435 1.6121 1.6121 2.2714 2.2714 4.6374 4.6374 4.7037 4.7037 5.8629 5.8629 6.5081 6.5081 7.2962 7.2962 7.5347 7.5347 7.6613 7.6613 8.3471 8.3471 8.5065 8.5065 8.9860 8.9860 9.0897 9.0897 9.1231 9.1231 9.2215 9.2215 9.5371 9.5371 9.7130 9.7130 9.8373 9.8373 10.0484 10.0484 10.2396 10.2396 10.3044 10.3044 10.3573 10.3573 10.6763 10.6763 10.6815 10.6815 10.7987 10.7987 11.0447 11.0447 12.2350 12.2350 k = 0.7372-0.5468 0.5235 ( 3976 PWs) bands (ev): 1.3886 1.3886 1.4149 1.4149 1.6757 1.6757 2.2626 2.2626 4.6292 4.6292 4.7295 4.7295 5.8805 5.8805 6.4472 6.4472 7.2803 7.2803 7.5417 7.5417 7.6014 7.6014 8.3726 8.3726 8.5028 8.5028 8.9809 8.9809 9.0862 9.0862 9.1209 9.1209 9.2411 9.2411 9.5604 9.5604 9.7143 9.7143 9.8053 9.8053 10.0461 10.0461 10.2204 10.2204 10.2952 10.2952 10.3467 10.3467 10.6710 10.6710 10.6773 10.6773 10.8030 10.8030 11.0231 11.0231 12.1981 12.1981 k = 0.2628-0.7903 0.6502 ( 3976 PWs) bands (ev): 1.3886 1.3886 1.4149 1.4149 1.6757 1.6757 2.2626 2.2626 4.6292 4.6292 4.7295 4.7295 5.8805 5.8805 6.4472 6.4472 7.2803 7.2803 7.5417 7.5417 7.6014 7.6014 8.3726 8.3726 8.5028 8.5028 8.9809 8.9809 9.0862 9.0862 9.1209 9.1209 9.2411 9.2411 9.5604 9.5604 9.7143 9.7143 9.8053 9.8053 10.0461 10.0461 10.2204 10.2204 10.2952 10.2952 10.3467 10.3467 10.6710 10.6710 10.6773 10.6773 10.8030 10.8030 11.0231 11.0231 12.1981 12.1981 k = 0.2566-0.7715 0.6502 ( 3984 PWs) bands (ev): 1.3758 1.3758 1.3815 1.3815 1.7480 1.7480 2.2582 2.2582 4.6297 4.6297 4.7592 4.7592 5.9050 5.9050 6.3845 6.3845 7.2638 7.2638 7.5325 7.5325 7.5559 7.5559 8.3975 8.3975 8.4987 8.4987 8.9753 8.9753 9.0826 9.0826 9.1173 9.1173 9.2649 9.2649 9.5820 9.5820 9.7108 9.7108 9.7713 9.7713 10.0487 10.0487 10.1988 10.1988 10.2899 10.2899 10.3390 10.3390 10.6668 10.6668 10.6779 10.6779 10.8102 10.8102 11.0029 11.0029 12.1636 12.1636 k = 0.2503-0.7527 0.6502 ( 3990 PWs) bands (ev): 1.3305 1.3305 1.3635 1.3635 1.8251 1.8251 2.2573 2.2573 4.6387 4.6387 4.7928 4.7928 5.9363 5.9363 6.3205 6.3205 7.2467 7.2467 7.4746 7.4746 7.5576 7.5576 8.4215 8.4215 8.4944 8.4944 8.9694 8.9694 9.0791 9.0791 9.1133 9.1133 9.2920 9.2920 9.5984 9.5984 9.7034 9.7034 9.7391 9.7391 10.0562 10.0562 10.1763 10.1763 10.2868 10.2868 10.3350 10.3350 10.6652 10.6652 10.6815 10.6815 10.8190 10.8190 10.9849 10.9849 12.1316 12.1316 k = 0.2441-0.7339 0.6502 ( 3988 PWs) bands (ev): 1.2778 1.2778 1.3391 1.3391 1.9051 1.9051 2.2585 2.2585 4.6562 4.6562 4.8300 4.8300 5.9742 5.9742 6.2553 6.2553 7.2290 7.2290 7.4129 7.4129 7.5620 7.5620 8.4443 8.4443 8.4904 8.4904 8.9633 8.9633 9.0753 9.0753 9.1094 9.1094 9.3217 9.3217 9.6034 9.6034 9.6847 9.6847 9.7246 9.7246 10.0680 10.0680 10.1535 10.1535 10.2853 10.2853 10.3346 10.3346 10.6656 10.6656 10.6875 10.6875 10.8287 10.8287 10.9699 10.9699 12.1019 12.1019 k = 0.2378-0.7151 0.6502 ( 3986 PWs) bands (ev): 1.2199 1.2199 1.3089 1.3089 1.9870 1.9870 2.2607 2.2607 4.6819 4.6819 4.8708 4.8708 6.0180 6.0180 6.1895 6.1895 7.2108 7.2108 7.3510 7.3510 7.5657 7.5657 8.4642 8.4642 8.4882 8.4882 8.9570 8.9570 9.0715 9.0715 9.1059 9.1059 9.3534 9.3534 9.5926 9.5926 9.6531 9.6531 9.7356 9.7356 10.0826 10.0826 10.1306 10.1306 10.2854 10.2854 10.3376 10.3376 10.6671 10.6671 10.6949 10.6949 10.8388 10.8388 10.9589 10.9589 12.0744 12.0744 k = 0.2316-0.6962 0.6502 ( 3984 PWs) bands (ev): 1.1580 1.1580 1.2738 1.2738 2.0699 2.0699 2.2629 2.2629 4.7153 4.7153 4.9152 4.9152 6.0652 6.0652 6.1256 6.1256 7.1917 7.1917 7.2897 7.2897 7.5687 7.5687 8.4741 8.4741 8.4951 8.4951 8.9506 8.9506 9.0676 9.0676 9.1029 9.1029 9.3866 9.3866 9.5691 9.5691 9.6208 9.6208 9.7595 9.7595 10.0966 10.0966 10.1097 10.1097 10.2870 10.2870 10.3442 10.3442 10.6687 10.6687 10.7031 10.7031 10.8492 10.8492 10.9532 10.9532 12.0490 12.0490 k = 0.2253-0.6774 0.6502 ( 3986 PWs) bands (ev): 1.0933 1.0933 1.2344 1.2344 2.1534 2.1534 2.2643 2.2643 4.7561 4.7561 4.9632 4.9632 6.0497 6.0497 6.1294 6.1294 7.1704 7.1704 7.2306 7.2306 7.5708 7.5708 8.4731 8.4731 8.5116 8.5116 8.9443 8.9443 9.0634 9.0634 9.1005 9.1005 9.4197 9.4197 9.5393 9.5393 9.5909 9.5909 9.7899 9.7899 10.0822 10.0822 10.1170 10.1170 10.2899 10.2899 10.3547 10.3547 10.6692 10.6692 10.7113 10.7113 10.8597 10.8597 10.9539 10.9539 12.0256 12.0256 k = 0.2190-0.6586 0.6502 ( 3984 PWs) bands (ev): 1.0265 1.0265 1.1915 1.1915 2.2369 2.2369 2.2646 2.2646 4.8038 4.8038 5.0147 5.0147 5.9839 5.9839 6.1883 6.1883 7.1403 7.1403 7.1810 7.1810 7.5721 7.5721 8.4704 8.4704 8.5288 8.5288 8.9381 8.9381 9.0591 9.0591 9.0986 9.0986 9.4460 9.4460 9.5134 9.5134 9.5637 9.5637 9.8244 9.8244 10.0593 10.0593 10.1317 10.1317 10.2938 10.2938 10.3700 10.3700 10.6674 10.6674 10.7190 10.7190 10.8705 10.8705 10.9620 10.9620 12.0041 12.0041 k = 0.2128-0.6398 0.6502 ( 3982 PWs) bands (ev): 0.9585 0.9585 1.1456 1.1456 2.2618 2.2618 2.3214 2.3214 4.8581 4.8581 5.0698 5.0698 5.9165 5.9165 6.2535 6.2535 7.0911 7.0911 7.1513 7.1513 7.5727 7.5727 8.4677 8.4677 8.5449 8.5449 8.9320 8.9320 9.0546 9.0546 9.0973 9.0973 9.4397 9.4397 9.5163 9.5163 9.5419 9.5419 9.8619 9.8619 10.0362 10.0362 10.1449 10.1449 10.2980 10.2980 10.3905 10.3905 10.6628 10.6628 10.7262 10.7262 10.8815 10.8815 10.9777 10.9777 11.9843 11.9843 k = 0.2065-0.6210 0.6502 ( 3984 PWs) bands (ev): 0.8898 0.8898 1.0972 1.0972 2.2578 2.2578 2.4046 2.4046 4.9183 4.9183 5.1283 5.1283 5.8489 5.8489 6.3230 6.3230 7.0338 7.0338 7.1309 7.1309 7.5726 7.5726 8.4652 8.4652 8.5594 8.5594 8.9260 8.9260 9.0499 9.0499 9.0964 9.0964 9.4076 9.4076 9.5107 9.5107 9.5578 9.5578 9.9019 9.9019 10.0134 10.0134 10.1558 10.1558 10.3022 10.3022 10.4166 10.4166 10.6550 10.6550 10.7331 10.7331 10.8927 10.8927 11.0005 11.0005 11.9663 11.9663 k = 0.2003-0.6022 0.6502 ( 3978 PWs) bands (ev): 0.8210 0.8210 1.0468 1.0468 2.2515 2.2515 2.4872 2.4872 4.9842 4.9842 5.1900 5.1900 5.7817 5.7817 6.3961 6.3961 6.9754 6.9754 7.1133 7.1133 7.5720 7.5720 8.4630 8.4630 8.5724 8.5724 8.9204 8.9204 9.0450 9.0450 9.0958 9.0958 9.3702 9.3702 9.4916 9.4916 9.5961 9.5961 9.9432 9.9432 9.9921 9.9921 10.1647 10.1647 10.3061 10.3061 10.4481 10.4481 10.6446 10.6446 10.7399 10.7399 10.9041 10.9041 11.0297 11.0297 11.9499 11.9499 k = 0.1940-0.5833 0.6502 ( 3980 PWs) bands (ev): 0.7525 0.7525 0.9949 0.9949 2.2429 2.2429 2.5689 2.5689 5.0553 5.0553 5.2547 5.2547 5.7149 5.7149 6.4722 6.4722 6.9176 6.9176 7.0971 7.0971 7.5709 7.5709 8.4611 8.4611 8.5839 8.5839 8.9150 8.9150 9.0398 9.0398 9.0953 9.0953 9.3318 9.3318 9.4743 9.4743 9.6378 9.6378 9.9625 9.9625 9.9955 9.9955 10.1716 10.1716 10.3096 10.3096 10.4845 10.4845 10.6322 10.6322 10.7466 10.7466 10.9154 10.9154 11.0643 11.0643 11.9349 11.9349 k = 0.1877-0.5645 0.6502 ( 3978 PWs) bands (ev): 0.6845 0.6845 0.9419 0.9419 2.2321 2.2321 2.6493 2.6493 5.1312 5.1312 5.3221 5.3221 5.6490 5.6490 6.5508 6.5508 6.8608 6.8608 7.0823 7.0823 7.5695 7.5695 8.4594 8.4594 8.5940 8.5940 8.9099 8.9099 9.0344 9.0344 9.0946 9.0946 9.2935 9.2935 9.4599 9.4599 9.6809 9.6809 9.9434 9.9434 10.0402 10.0402 10.1769 10.1769 10.3129 10.3129 10.5253 10.5253 10.6186 10.6186 10.7532 10.7532 10.9268 10.9268 11.1034 11.1034 11.9215 11.9215 k = 0.1815-0.5457 0.6502 ( 3984 PWs) bands (ev): 0.6174 0.6174 0.8883 0.8883 2.2192 2.2192 2.7281 2.7281 5.2114 5.2114 5.3918 5.3918 5.5841 5.5841 6.6311 6.6311 6.8057 6.8057 7.0688 7.0688 7.5679 7.5679 8.4577 8.4577 8.6029 8.6029 8.9051 8.9051 9.0286 9.0286 9.0936 9.0936 9.2558 9.2558 9.4487 9.4487 9.7248 9.7248 9.9224 9.9224 10.0896 10.0896 10.1810 10.1810 10.3160 10.3160 10.5693 10.5693 10.6052 10.6052 10.7597 10.7597 10.9382 10.9382 11.1463 11.1463 11.9094 11.9094 k = 0.1752-0.5269 0.6502 ( 3982 PWs) bands (ev): 0.5515 0.5515 0.8342 0.8342 2.2044 2.2044 2.8051 2.8051 5.2955 5.2955 5.4630 5.4630 5.5209 5.5209 6.7105 6.7105 6.7547 6.7547 7.0569 7.0569 7.5665 7.5665 8.4560 8.4560 8.6107 8.6107 8.9006 8.9006 9.0223 9.0223 9.0921 9.0921 9.2191 9.2191 9.4409 9.4409 9.7689 9.7689 9.9019 9.9019 10.1414 10.1414 10.1843 10.1843 10.3191 10.3191 10.5867 10.5867 10.6220 10.6220 10.7662 10.7662 10.9495 10.9495 11.1924 11.1924 11.8988 11.8988 k = 0.1690-0.5081 0.6502 ( 3992 PWs) bands (ev): 0.4868 0.4868 0.7802 0.7802 2.1879 2.1879 2.8799 2.8799 5.3816 5.3816 5.4595 5.4595 5.5369 5.5369 6.6983 6.6983 6.7981 6.7981 7.0465 7.0465 7.5653 7.5653 8.4541 8.4541 8.6177 8.6177 8.8965 8.8965 9.0151 9.0151 9.0901 9.0901 9.1837 9.1837 9.4361 9.4361 9.8124 9.8124 9.8824 9.8824 10.1832 10.1832 10.1985 10.1985 10.3224 10.3224 10.5734 10.5734 10.6731 10.6731 10.7728 10.7728 10.9609 10.9609 11.2412 11.2412 11.8894 11.8894 k = 0.1627-0.4893 0.6502 ( 3996 PWs) bands (ev): 0.4237 0.4237 0.7265 0.7265 2.1700 2.1700 2.9523 2.9523 5.3918 5.3918 5.4802 5.4802 5.6102 5.6102 6.6500 6.6500 6.8801 6.8801 7.0379 7.0379 7.5647 7.5647 8.4519 8.4519 8.6239 8.6239 8.8926 8.8926 9.0068 9.0068 9.0878 9.0878 9.1502 9.1502 9.4344 9.4344 9.8472 9.8472 9.8720 9.8720 10.1863 10.1863 10.2513 10.2513 10.3276 10.3276 10.5598 10.5598 10.7270 10.7270 10.7811 10.7811 10.9723 10.9723 11.2923 11.2923 11.8815 11.8815 k = 0.1565-0.4704 0.6502 ( 4002 PWs) bands (ev): 0.3622 0.3622 0.6733 0.6733 2.1509 2.1509 3.0221 3.0221 5.3340 5.3340 5.5734 5.5734 5.6834 5.6834 6.6042 6.6042 6.9617 6.9617 7.0316 7.0316 7.5651 7.5651 8.4493 8.4493 8.6295 8.6295 8.8888 8.8888 8.9965 8.9965 9.0852 9.0852 9.1195 9.1195 9.4353 9.4353 9.8384 9.8384 9.9053 9.9053 10.1871 10.1871 10.2973 10.2973 10.3431 10.3431 10.5474 10.5474 10.7689 10.7689 10.8051 10.8051 10.9838 10.9838 11.3453 11.3453 11.8750 11.8750 k = 0.1502-0.4516 0.6502 ( 3994 PWs) bands (ev): 0.3025 0.3025 0.6208 0.6208 2.1308 2.1308 3.0890 3.0890 5.2763 5.2763 5.6713 5.6713 5.7553 5.7553 6.5621 6.5621 7.0223 7.0223 7.0466 7.0466 7.5673 7.5673 8.4464 8.4464 8.6346 8.6346 8.8851 8.8851 8.9836 8.9836 9.0825 9.0825 9.0928 9.0928 9.4385 9.4385 9.8208 9.8208 9.9473 9.9473 10.1872 10.1872 10.3152 10.3152 10.3878 10.3878 10.5376 10.5376 10.7814 10.7814 10.8618 10.8618 10.9957 10.9957 11.3996 11.3996 11.8701 11.8701 k = 0.1439-0.4328 0.6502 ( 3994 PWs) bands (ev): 0.2446 0.2446 0.5694 0.5694 2.1099 2.1099 3.1528 3.1528 5.2202 5.2202 5.7720 5.7720 5.8245 5.8245 6.5249 6.5249 7.0218 7.0218 7.1218 7.1218 7.5723 7.5723 8.4430 8.4430 8.6391 8.6391 8.8809 8.8809 8.9672 8.9672 9.0707 9.0707 9.0803 9.0803 9.4436 9.4436 9.8031 9.8031 9.9886 9.9886 10.1868 10.1868 10.3205 10.3205 10.4411 10.4411 10.5355 10.5355 10.7875 10.7875 10.9269 10.9269 11.0092 11.0092 11.4545 11.4545 11.8668 11.8668 k = 0.1377-0.4140 0.6502 ( 3996 PWs) bands (ev): 0.1887 0.1887 0.5191 0.5191 2.0885 2.0885 3.2132 3.2132 5.1660 5.1660 5.8749 5.8749 5.8892 5.8892 6.4944 6.4944 7.0211 7.0211 7.1945 7.1945 7.5815 7.5815 8.4392 8.4392 8.6431 8.6431 8.8754 8.8754 8.9479 8.9479 9.0540 9.0540 9.0783 9.0783 9.4503 9.4503 9.7857 9.7857 10.0284 10.0284 10.1863 10.1863 10.3232 10.3232 10.4739 10.4739 10.5601 10.5601 10.7925 10.7925 10.9874 10.9874 11.0320 11.0320 11.5089 11.5089 11.8654 11.8654 k = 0.1314-0.3952 0.6502 ( 3994 PWs) bands (ev): 0.1349 0.1349 0.4702 0.4702 2.0668 2.0668 3.2702 3.2702 5.1138 5.1138 5.9448 5.9448 5.9816 5.9816 6.4729 6.4729 7.0220 7.0220 7.2602 7.2602 7.5974 7.5974 8.4349 8.4349 8.6463 8.6463 8.8669 8.8669 8.9282 8.9282 9.0417 9.0417 9.0770 9.0770 9.4582 9.4582 9.7689 9.7689 10.0657 10.0657 10.1864 10.1864 10.3253 10.3253 10.4776 10.4776 10.6185 10.6185 10.7970 10.7970 11.0167 11.0167 11.0900 11.0900 11.5610 11.5610 11.8664 11.8664 k = 0.1252-0.3763 0.6502 ( 3990 PWs) bands (ev): 0.0832 0.0832 0.4228 0.4228 2.0449 2.0449 3.3237 3.3237 5.0637 5.0637 5.9903 5.9903 6.0891 6.0891 6.4637 6.4637 7.0249 7.0249 7.3154 7.3154 7.6228 7.6228 8.4304 8.4304 8.6487 8.6487 8.8527 8.8527 8.9121 8.9121 9.0326 9.0326 9.0766 9.0766 9.4671 9.4671 9.7526 9.7526 10.0986 10.0986 10.1888 10.1888 10.3273 10.3273 10.4723 10.4723 10.6895 10.6895 10.8019 10.8019 11.0308 11.0308 11.1666 11.1666 11.6085 11.6085 11.8701 11.8701 k = 0.1189-0.3575 0.6502 ( 3990 PWs) bands (ev): 0.0338 0.0338 0.3770 0.3770 2.0231 2.0231 3.3734 3.3734 5.0159 5.0159 6.0208 6.0208 6.1985 6.1985 6.4699 6.4699 7.0296 7.0296 7.3579 7.3579 7.6599 7.6599 8.4255 8.4255 8.6501 8.6501 8.8316 8.8316 8.9018 8.9018 9.0256 9.0256 9.0773 9.0773 9.4765 9.4765 9.7368 9.7368 10.1235 10.1235 10.1969 10.1969 10.3294 10.3294 10.4653 10.4653 10.7618 10.7618 10.8109 10.8109 11.0424 11.0424 11.2485 11.2485 11.6484 11.6484 11.8769 11.8769 k = 0.1126-0.3387 0.6502 ( 3980 PWs) bands (ev): -0.0134 -0.0134 0.3330 0.3330 2.0015 2.0015 3.4195 3.4195 4.9703 4.9703 6.0354 6.0354 6.3092 6.3092 6.4924 6.4924 7.0360 7.0360 7.3878 7.3878 7.7082 7.7082 8.4204 8.4204 8.6504 8.6504 8.8059 8.8059 8.8955 8.8955 9.0201 9.0201 9.0792 9.0792 9.4863 9.4863 9.7217 9.7217 10.1364 10.1364 10.2147 10.2147 10.3320 10.3320 10.4583 10.4583 10.7979 10.7979 10.8599 10.8599 11.0534 11.0534 11.3329 11.3329 11.6786 11.6786 11.8876 11.8876 k = 0.1064-0.3199 0.6502 ( 3980 PWs) bands (ev): -0.0583 -0.0583 0.2909 0.2909 1.9803 1.9803 3.4619 3.4619 4.9272 4.9272 6.0359 6.0359 6.4209 6.4209 6.5288 6.5288 7.0440 7.0440 7.4079 7.4079 7.7649 7.7649 8.4151 8.4151 8.6492 8.6492 8.7779 8.7779 8.8911 8.8911 9.0159 9.0159 9.0822 9.0822 9.4963 9.4963 9.7070 9.7070 10.1394 10.1394 10.2395 10.2395 10.3354 10.3354 10.4517 10.4517 10.8042 10.8042 10.9409 10.9409 11.0648 11.0648 11.4173 11.4173 11.6988 11.6988 11.9035 11.9035 k = 0.1001-0.3011 0.6502 ( 3980 PWs) bands (ev): -0.1009 -0.1009 0.2507 0.2507 1.9596 1.9596 3.5006 3.5006 4.8865 4.8865 6.0263 6.0263 6.5328 6.5328 6.5750 6.5750 7.0535 7.0535 7.4215 7.4215 7.8265 7.8265 8.4098 8.4098 8.6467 8.6467 8.7490 8.7490 8.8873 8.8873 9.0128 9.0128 9.0865 9.0865 9.5063 9.5063 9.6929 9.6929 10.1374 10.1374 10.2659 10.2659 10.3406 10.3406 10.4456 10.4456 10.8073 10.8073 11.0229 11.0229 11.0808 11.0808 11.4988 11.4988 11.7111 11.7111 11.9273 11.9273 k = 0.0939-0.2823 0.6502 ( 3982 PWs) bands (ev): -0.1410 -0.1410 0.2126 0.2126 1.9396 1.9396 3.5356 3.5356 4.8483 4.8483 6.0104 6.0104 6.6237 6.6237 6.6476 6.6476 7.0642 7.0642 7.4314 7.4314 7.8900 7.8900 8.4044 8.4044 8.6424 8.6424 8.7201 8.7201 8.8833 8.8833 9.0107 9.0107 9.0920 9.0920 9.5162 9.5162 9.6793 9.6793 10.1330 10.1330 10.2896 10.2896 10.3494 10.3494 10.4401 10.4401 10.8095 10.8095 11.0692 11.0692 11.1357 11.1357 11.5727 11.5727 11.7179 11.7179 11.9635 11.9635 k = 0.0876-0.2634 0.6502 ( 3980 PWs) bands (ev): -0.1787 -0.1787 0.1766 0.1766 1.9204 1.9204 3.5672 3.5672 4.8126 4.8126 5.9912 5.9912 6.6776 6.6776 6.7588 6.7588 7.0761 7.0761 7.4394 7.4394 7.9537 7.9537 8.3990 8.3990 8.6366 8.6366 8.6916 8.6916 8.8788 8.8788 9.0097 9.0097 9.0986 9.0986 9.5259 9.5259 9.6663 9.6663 10.1273 10.1273 10.3074 10.3074 10.3641 10.3641 10.4352 10.4352 10.8112 10.8112 11.0828 11.0828 11.2254 11.2254 11.6338 11.6338 11.7219 11.7219 12.0171 12.0171 k = 0.0814-0.2446 0.6502 ( 3976 PWs) bands (ev): -0.2139 -0.2139 0.1428 0.1428 1.9020 1.9020 3.5954 3.5954 4.7796 4.7796 5.9704 5.9704 6.7303 6.7303 6.8697 6.8697 7.0892 7.0892 7.4469 7.4469 8.0162 8.0162 8.3938 8.3938 8.6287 8.6287 8.6638 8.6638 8.8734 8.8734 9.0098 9.0098 9.1060 9.1060 9.5354 9.5354 9.6538 9.6538 10.1208 10.1208 10.3187 10.3187 10.3850 10.3850 10.4309 10.4309 10.8124 10.8124 11.0921 11.0921 11.3210 11.3210 11.6789 11.6789 11.7254 11.7254 12.0904 12.0904 k = 0.0751-0.2258 0.6502 ( 3976 PWs) bands (ev): -0.2466 -0.2466 0.1113 0.1113 1.8847 1.8847 3.6203 3.6203 4.7491 4.7491 5.9492 5.9492 6.7810 6.7810 6.9777 6.9777 7.1045 7.1045 7.4544 7.4544 8.0766 8.0766 8.3888 8.3888 8.6188 8.6188 8.6373 8.6373 8.8667 8.8667 9.0109 9.0109 9.1142 9.1142 9.5443 9.5443 9.6421 9.6421 10.1138 10.1138 10.3261 10.3261 10.4089 10.4089 10.4274 10.4274 10.8132 10.8132 11.1000 11.1000 11.4177 11.4177 11.7073 11.7073 11.7326 11.7326 12.1819 12.1819 k = 0.0688-0.2070 0.6502 ( 3980 PWs) bands (ev): -0.2768 -0.2768 0.0822 0.0822 1.8684 1.8684 3.6423 3.6423 4.7212 4.7212 5.9285 5.9285 6.8285 6.8285 7.0731 7.0731 7.1309 7.1309 7.4626 7.4626 8.1343 8.1343 8.3840 8.3840 8.6052 8.6052 8.6135 8.6135 8.8586 8.8586 9.0129 9.0129 9.1228 9.1228 9.5528 9.5528 9.6310 9.6310 10.1065 10.1065 10.3318 10.3318 10.4217 10.4217 10.4363 10.4363 10.8137 10.8137 11.1071 11.1071 11.5118 11.5118 11.7230 11.7230 11.7468 11.7468 12.2874 12.2874 k = 0.0626-0.1882 0.6502 ( 3984 PWs) bands (ev): -0.3044 -0.3044 0.0554 0.0554 1.8533 1.8533 3.6614 3.6614 4.6959 4.6959 5.9087 5.9087 6.8722 6.8722 7.1146 7.1146 7.2086 7.2086 7.4718 7.4718 8.1887 8.1887 8.3794 8.3794 8.5847 8.5847 8.5963 8.5963 8.8492 8.8492 9.0158 9.0158 9.1317 9.1317 9.5606 9.5606 9.6206 9.6206 10.0991 10.0991 10.3369 10.3369 10.4190 10.4190 10.4610 10.4610 10.8138 10.8138 11.1134 11.1134 11.5928 11.5928 11.7441 11.7441 11.7634 11.7634 12.4029 12.4029 k = 0.0563-0.1694 0.6502 ( 3978 PWs) bands (ev): -0.3294 -0.3294 0.0310 0.0310 1.8394 1.8394 3.6778 3.6778 4.6732 4.6732 5.8903 5.8903 6.9114 6.9114 7.1315 7.1315 7.3074 7.3074 7.4822 7.4822 8.2394 8.2394 8.3753 8.3753 8.5632 8.5632 8.5803 8.5803 8.8383 8.8383 9.0194 9.0194 9.1406 9.1406 9.5676 9.5676 9.6114 9.6114 10.0917 10.0917 10.3418 10.3418 10.4159 10.4159 10.4857 10.4857 10.8137 10.8137 11.1191 11.1191 11.6413 11.6413 11.7688 11.7688 11.8057 11.8057 12.5254 12.5254 k = 0.0501-0.1505 0.6502 ( 3982 PWs) bands (ev): -0.3519 -0.3519 0.0091 0.0091 1.8268 1.8268 3.6918 3.6918 4.6530 4.6530 5.8733 5.8733 6.9458 6.9458 7.1447 7.1447 7.4051 7.4051 7.4938 7.4938 8.2855 8.2855 8.3716 8.3716 8.5440 8.5440 8.5627 8.5627 8.8260 8.8260 9.0235 9.0235 9.1493 9.1493 9.5733 9.5733 9.6036 9.6036 10.0846 10.0846 10.3466 10.3466 10.4128 10.4128 10.5095 10.5095 10.8133 10.8133 11.1242 11.1242 11.6591 11.6591 11.7802 11.7802 11.8892 11.8892 12.6523 12.6523 k = 0.0438-0.1317 0.6502 ( 3982 PWs) bands (ev): -0.3717 -0.3717 -0.0103 -0.0103 1.8156 1.8156 3.7036 3.7036 4.6353 4.6353 5.8581 5.8581 6.9753 6.9753 7.1564 7.1564 7.4952 7.4952 7.5097 7.5097 8.3257 8.3257 8.3686 8.3686 8.5287 8.5287 8.5434 8.5434 8.8124 8.8124 9.0278 9.0278 9.1576 9.1576 9.5767 9.5767 9.5984 9.5984 10.0778 10.0778 10.3514 10.3514 10.4097 10.4097 10.5320 10.5320 10.8128 10.8128 11.1286 11.1286 11.6645 11.6645 11.7889 11.7889 11.9848 11.9848 12.7789 12.7789 k = 0.0375-0.1129 0.6502 ( 3984 PWs) bands (ev): -0.3890 -0.3890 -0.0271 -0.0271 1.8058 1.8058 3.7134 3.7134 4.6201 4.6201 5.8447 5.8447 7.0000 7.0000 7.1667 7.1667 7.5174 7.5174 7.5880 7.5880 8.3549 8.3549 8.3694 8.3694 8.5188 8.5188 8.5233 8.5233 8.7976 8.7976 9.0321 9.0321 9.1652 9.1652 9.5761 9.5761 9.5973 9.5973 10.0715 10.0715 10.3562 10.3562 10.4067 10.4067 10.5528 10.5528 10.8121 10.8121 11.1323 11.1323 11.6656 11.6656 11.7961 11.7961 12.0819 12.0819 12.8377 12.8377 k = 0.0313-0.0941 0.6502 ( 3972 PWs) bands (ev): -0.4036 -0.4036 -0.0414 -0.0414 1.7974 1.7974 3.7213 3.7213 4.6074 4.6074 5.8333 5.8333 7.0202 7.0202 7.1758 7.1758 7.5299 7.5299 7.6684 7.6684 8.3597 8.3597 8.3847 8.3847 8.5000 8.5000 8.5199 8.5199 8.7817 8.7817 9.0362 9.0362 9.1720 9.1720 9.5727 9.5727 9.5995 9.5995 10.0660 10.0660 10.3610 10.3610 10.4037 10.4037 10.5717 10.5717 10.8114 10.8114 11.1355 11.1355 11.6652 11.6652 11.8023 11.8023 12.1754 12.1754 12.7813 12.7813 k = 0.0250-0.0753 0.6502 ( 3976 PWs) bands (ev): -0.4155 -0.4155 -0.0532 -0.0532 1.7905 1.7905 3.7275 3.7275 4.5970 4.5970 5.8238 5.8238 7.0359 7.0359 7.1834 7.1834 7.5413 7.5413 7.7402 7.7402 8.3581 8.3581 8.3951 8.3951 8.4776 8.4776 8.5300 8.5300 8.7652 8.7652 9.0399 9.0399 9.1778 9.1778 9.5685 9.5685 9.6025 9.6025 10.0611 10.0611 10.3655 10.3655 10.4006 10.4006 10.5880 10.5880 10.8106 10.8106 11.1380 11.1380 11.6643 11.6643 11.8073 11.8073 12.2615 12.2615 12.7256 12.7256 k = 0.0188-0.0565 0.6502 ( 3974 PWs) bands (ev): -0.4248 -0.4248 -0.0623 -0.0623 1.7851 1.7851 3.7322 3.7322 4.5890 4.5890 5.8164 5.8164 7.0478 7.0478 7.1894 7.1894 7.5511 7.5511 7.8010 7.8010 8.3565 8.3565 8.3976 8.3976 8.4562 8.4562 8.5470 8.5470 8.7487 8.7487 9.0430 9.0430 9.1824 9.1824 9.5649 9.5649 9.6053 9.6053 10.0573 10.0573 10.3700 10.3700 10.3975 10.3975 10.6015 10.6015 10.8100 10.8100 11.1399 11.1399 11.6633 11.6633 11.8115 11.8115 12.3359 12.3359 12.6798 12.6798 k = 0.0125-0.0376 0.6502 ( 3972 PWs) bands (ev): -0.4315 -0.4315 -0.0689 -0.0689 1.7812 1.7812 3.7355 3.7355 4.5833 4.5833 5.8111 5.8111 7.0559 7.0559 7.1938 7.1938 7.5586 7.5586 7.8480 7.8480 8.3551 8.3551 8.3965 8.3965 8.4378 8.4378 8.5652 8.5652 8.7335 8.7335 9.0454 9.0454 9.1858 9.1858 9.5621 9.5621 9.6075 9.6075 10.0544 10.0544 10.3740 10.3740 10.3944 10.3944 10.6115 10.6115 10.8094 10.8094 11.1413 11.1413 11.6625 11.6625 11.8145 11.8145 12.3940 12.3940 12.6458 12.6458 k = 0.0063-0.0188 0.6502 ( 3972 PWs) bands (ev): -0.4355 -0.4355 -0.0728 -0.0728 1.7789 1.7789 3.7374 3.7374 4.5799 4.5799 5.8079 5.8079 7.0607 7.0607 7.1965 7.1965 7.5633 7.5633 7.8782 7.8782 8.3541 8.3541 8.3949 8.3949 8.4252 8.4252 8.5795 8.5795 8.7220 8.7220 9.0468 9.0468 9.1879 9.1879 9.5604 9.5604 9.6088 9.6088 10.0526 10.0526 10.3773 10.3773 10.3917 10.3917 10.6176 10.6176 10.8091 10.8091 11.1421 11.1421 11.6620 11.6620 11.8164 11.8164 12.4313 12.4313 12.6249 12.6249 k = 0.0000 0.0000 0.6502 ( 3968 PWs) bands (ev): -0.4368 -0.4368 -0.0741 -0.0741 1.7781 1.7781 3.7381 3.7381 4.5787 4.5787 5.8069 5.8069 7.0623 7.0623 7.1974 7.1974 7.5649 7.5649 7.8886 7.8886 8.3538 8.3538 8.3942 8.3942 8.4206 8.4206 8.5850 8.5850 8.7175 8.7175 9.0473 9.0473 9.1886 9.1886 9.5598 9.5598 9.6093 9.6093 10.0521 10.0521 10.3787 10.3787 10.3905 10.3905 10.6197 10.6197 10.8090 10.8090 11.1423 11.1423 11.6619 11.6619 11.8170 11.8170 12.4442 12.4442 12.6179 12.6179 k = 0.0000 0.0000 0.6502 ( 3968 PWs) bands (ev): -0.4368 -0.4368 -0.0741 -0.0741 1.7781 1.7781 3.7381 3.7381 4.5787 4.5787 5.8069 5.8069 7.0623 7.0623 7.1974 7.1974 7.5649 7.5649 7.8886 7.8886 8.3538 8.3538 8.3942 8.3942 8.4206 8.4206 8.5850 8.5850 8.7175 8.7175 9.0473 9.0473 9.1886 9.1886 9.5598 9.5598 9.6093 9.6093 10.0521 10.0521 10.3787 10.3787 10.3905 10.3905 10.6197 10.6197 10.8090 10.8090 11.1423 11.1423 11.6619 11.6619 11.8170 11.8170 12.4442 12.4442 12.6179 12.6179 k = 0.0181 0.0060 0.6502 ( 3979 PWs) bands (ev): -0.4358 -0.4358 -0.0728 -0.0728 1.7723 1.7723 3.7350 3.7350 4.5840 4.5840 5.8119 5.8119 7.0625 7.0625 7.1973 7.1973 7.5650 7.5650 7.8887 7.8887 8.3491 8.3491 8.3918 8.3918 8.4258 8.4258 8.5850 8.5850 8.7177 8.7177 9.0424 9.0424 9.1930 9.1930 9.5551 9.5551 9.6147 9.6147 10.0518 10.0518 10.3775 10.3775 10.3903 10.3903 10.6190 10.6190 10.8094 10.8094 11.1441 11.1441 11.6589 11.6589 11.8208 11.8208 12.4309 12.4309 12.6290 12.6290 k = 0.0362 0.0121 0.6502 ( 3971 PWs) bands (ev): -0.4327 -0.4327 -0.0691 -0.0691 1.7549 1.7549 3.7259 3.7259 4.5998 4.5998 5.8268 5.8268 7.0632 7.0632 7.1969 7.1969 7.5654 7.5654 7.8890 7.8890 8.3366 8.3366 8.3882 8.3882 8.4365 8.4365 8.5850 8.5850 8.7183 8.7183 9.0295 9.0295 9.2047 9.2047 9.5447 9.5447 9.6276 9.6276 10.0511 10.0511 10.3743 10.3743 10.3897 10.3897 10.6168 10.6168 10.8109 10.8109 11.1495 11.1495 11.6509 11.6509 11.8315 11.8315 12.3983 12.3983 12.6551 12.6551 k = 0.0544 0.0181 0.6502 ( 3975 PWs) bands (ev): -0.4276 -0.4276 -0.0628 -0.0628 1.7267 1.7267 3.7102 3.7102 4.6265 4.6265 5.8510 5.8510 7.0643 7.0643 7.1964 7.1964 7.5660 7.5660 7.8895 7.8895 8.3189 8.3189 8.3851 8.3851 8.4482 8.4482 8.5849 8.5849 8.7191 8.7191 9.0116 9.0116 9.2204 9.2204 9.5327 9.5327 9.6436 9.6436 10.0498 10.0498 10.3692 10.3692 10.3883 10.3883 10.6131 10.6131 10.8132 10.8132 11.1584 11.1584 11.6392 11.6392 11.8476 11.8476 12.3563 12.3563 12.6859 12.6859 k = 0.0725 0.0241 0.6502 ( 3977 PWs) bands (ev): -0.4205 -0.4205 -0.0540 -0.0540 1.6886 1.6886 3.6878 3.6878 4.6641 4.6641 5.8837 5.8837 7.0660 7.0660 7.1957 7.1957 7.5668 7.5668 7.8900 7.8900 8.2980 8.2980 8.3823 8.3823 8.4592 8.4592 8.5848 8.5848 8.7199 8.7199 8.9915 8.9915 9.2380 9.2380 9.5207 9.5207 9.6610 9.6610 10.0482 10.0482 10.3627 10.3627 10.3861 10.3861 10.6079 10.6079 10.8165 10.8165 11.1705 11.1705 11.6254 11.6254 11.8675 11.8675 12.3101 12.3101 12.7160 12.7160 k = 0.0906 0.0301 0.6502 ( 3977 PWs) bands (ev): -0.4113 -0.4113 -0.0428 -0.0428 1.6416 1.6416 3.6586 3.6586 4.7123 4.7123 5.9237 5.9237 7.0683 7.0683 7.1947 7.1947 7.5679 7.5679 7.8906 7.8906 8.2749 8.2749 8.3793 8.3793 8.4689 8.4689 8.5846 8.5846 8.7203 8.7203 8.9710 8.9710 9.2559 9.2559 9.5094 9.5094 9.6794 9.6794 10.0464 10.0464 10.3548 10.3548 10.3831 10.3831 10.6013 10.6013 10.8206 10.8206 11.1855 11.1855 11.6103 11.6103 11.8902 11.8902 12.2620 12.2620 12.7425 12.7425 k = 0.1087 0.0362 0.6502 ( 3973 PWs) bands (ev): -0.4002 -0.4002 -0.0291 -0.0291 1.5870 1.5870 3.6228 3.6228 4.7707 4.7707 5.9701 5.9701 7.0714 7.0714 7.1937 7.1937 7.5694 7.5694 7.8912 7.8912 8.2500 8.2500 8.3761 8.3761 8.4768 8.4768 8.5844 8.5844 8.7198 8.7198 8.9513 8.9513 9.2733 9.2733 9.4991 9.4991 9.6984 9.6984 10.0445 10.0445 10.3457 10.3457 10.3793 10.3793 10.5935 10.5935 10.8256 10.8256 11.2029 11.2029 11.5946 11.5946 11.9148 11.9148 12.2132 12.2132 12.7643 12.7643 k = 0.1269 0.0422 0.6502 ( 3969 PWs) bands (ev): -0.3872 -0.3872 -0.0129 -0.0129 1.5260 1.5260 3.5811 3.5811 4.8384 4.8384 6.0215 6.0215 7.0753 7.0753 7.1924 7.1924 7.5712 7.5712 7.8917 7.8917 8.2236 8.2236 8.3724 8.3724 8.4828 8.4828 8.5842 8.5842 8.7180 8.7180 8.9338 8.9338 9.2896 9.2896 9.4901 9.4901 9.7178 9.7178 10.0426 10.0426 10.3357 10.3357 10.3746 10.3746 10.5845 10.5845 10.8314 10.8314 11.2224 11.2224 11.5786 11.5786 11.9408 11.9408 12.1644 12.1644 12.7807 12.7807 k = 0.1450 0.0482 0.6502 ( 3968 PWs) bands (ev): -0.3724 -0.3724 0.0056 0.0056 1.4599 1.4599 3.5342 3.5342 4.9141 4.9141 6.0769 6.0769 7.0803 7.0803 7.1911 7.1911 7.5734 7.5734 7.8920 7.8920 8.1956 8.1956 8.3681 8.3681 8.4866 8.4866 8.5839 8.5839 8.7143 8.7143 8.9192 8.9192 9.3045 9.3045 9.4823 9.4823 9.7374 9.7374 10.0409 10.0409 10.3249 10.3249 10.3690 10.3690 10.5743 10.5743 10.8380 10.8380 11.2436 11.2436 11.5627 11.5627 11.9675 11.9675 12.1163 12.1163 12.7919 12.7919 k = 0.1631 0.0542 0.6502 ( 3968 PWs) bands (ev): -0.3557 -0.3557 0.0265 0.0265 1.3897 1.3897 3.4829 3.4829 4.9967 4.9967 6.1350 6.1350 7.0866 7.0866 7.1896 7.1896 7.5760 7.5760 7.8919 7.8919 8.1662 8.1662 8.3630 8.3630 8.4883 8.4883 8.5836 8.5836 8.7086 8.7086 8.9082 8.9082 9.3177 9.3177 9.4760 9.4760 9.7571 9.7571 10.0394 10.0394 10.3132 10.3132 10.3627 10.3627 10.5631 10.5631 10.8454 10.8454 11.2661 11.2661 11.5470 11.5470 11.9942 11.9942 12.0692 12.0692 12.7983 12.7983 k = 0.1812 0.0603 0.6502 ( 3969 PWs) bands (ev): -0.3374 -0.3374 0.0497 0.0497 1.3165 1.3165 3.4281 3.4281 5.0849 5.0849 6.1949 6.1949 7.0944 7.0944 7.1880 7.1880 7.5790 7.5790 7.8914 7.8914 8.1353 8.1353 8.3568 8.3568 8.4880 8.4880 8.5833 8.5833 8.7010 8.7010 8.9010 8.9010 9.3290 9.3290 9.4713 9.4713 9.7767 9.7767 10.0384 10.0384 10.3008 10.3008 10.3556 10.3556 10.5509 10.5509 10.8537 10.8537 11.2894 11.2894 11.5318 11.5318 12.0147 12.0147 12.0291 12.0291 12.8009 12.8009 k = 0.1994 0.0663 0.6502 ( 3977 PWs) bands (ev): -0.3175 -0.3175 0.0752 0.0752 1.2413 1.2413 3.3707 3.3707 5.1775 5.1775 6.2554 6.2554 7.1039 7.1039 7.1865 7.1865 7.5824 7.5824 7.8904 7.8904 8.1028 8.1028 8.3490 8.3490 8.4861 8.4861 8.5828 8.5828 8.6921 8.6921 8.8975 8.8975 9.3382 9.3382 9.4681 9.4681 9.7962 9.7962 10.0379 10.0379 10.2878 10.2878 10.3479 10.3479 10.5378 10.5378 10.8628 10.8628 11.3129 11.3129 11.5175 11.5175 11.9767 11.9767 12.0478 12.0478 12.8004 12.8004 k = 0.2175 0.0723 0.6502 ( 3982 PWs) bands (ev): -0.2962 -0.2962 0.1027 0.1027 1.1650 1.1650 3.3112 3.3112 5.2732 5.2732 6.3158 6.3158 7.1154 7.1154 7.1850 7.1850 7.5863 7.5863 7.8888 7.8888 8.0688 8.0688 8.3390 8.3390 8.4834 8.4834 8.5824 8.5824 8.6822 8.6822 8.8971 8.8971 9.3454 9.3454 9.4664 9.4664 9.8156 9.8156 10.0379 10.0379 10.2742 10.2742 10.3394 10.3394 10.5240 10.5240 10.8727 10.8727 11.3360 11.3360 11.5046 11.5046 11.9338 11.9338 12.0710 12.0710 12.7979 12.7979 k = 0.2356 0.0784 0.6502 ( 3979 PWs) bands (ev): -0.2736 -0.2736 0.1322 0.1322 1.0884 1.0884 3.2503 3.2503 5.3710 5.3710 6.3752 6.3752 7.1291 7.1291 7.1836 7.1836 7.5907 7.5907 7.8864 7.8864 8.0331 8.0331 8.3262 8.3262 8.4808 8.4808 8.5820 8.5820 8.6721 8.6721 8.8993 8.8993 9.3505 9.3505 9.4664 9.4664 9.8346 9.8346 10.0385 10.0385 10.2601 10.2601 10.3304 10.3304 10.5096 10.5096 10.8835 10.8835 11.3578 11.3578 11.4944 11.4944 11.8925 11.8925 12.0917 12.0917 12.7941 12.7941 k = 0.2537 0.0844 0.6502 ( 3973 PWs) bands (ev): -0.2501 -0.2501 0.1636 0.1636 1.0125 1.0125 3.1887 3.1887 5.4696 5.4696 6.4329 6.4329 7.1450 7.1450 7.1826 7.1826 7.5956 7.5956 7.8832 7.8832 7.9957 7.9957 8.3105 8.3105 8.4791 8.4791 8.5817 8.5817 8.6619 8.6619 8.9035 8.9035 9.3534 9.3534 9.4679 9.4679 9.8531 9.8531 10.0397 10.0397 10.2457 10.2457 10.3209 10.3209 10.4947 10.4947 10.8950 10.8950 11.3760 11.3760 11.4890 11.4890 11.8532 11.8532 12.1086 12.1086 12.7895 12.7895 k = 0.2719 0.0904 0.6502 ( 3972 PWs) bands (ev): -0.2259 -0.2259 0.1963 0.1963 0.9382 0.9382 3.1268 3.1268 5.5681 5.5681 6.4881 6.4881 7.1621 7.1621 7.1830 7.1830 7.6009 7.6009 7.8790 7.8790 7.9568 7.9568 8.2920 8.2920 8.4788 8.4788 8.5814 8.5814 8.6517 8.6517 8.9092 8.9092 9.3541 9.3541 9.4710 9.4710 9.8711 9.8711 10.0412 10.0412 10.2311 10.2311 10.3110 10.3110 10.4794 10.4794 10.9073 10.9073 11.3878 11.3878 11.4914 11.4914 11.8159 11.8159 12.1210 12.1210 12.7848 12.7848 k = 0.2900 0.0964 0.6502 ( 3969 PWs) bands (ev): -0.2015 -0.2015 0.2302 0.2302 0.8668 0.8668 3.0651 3.0651 5.6651 5.6651 6.5407 6.5407 7.1734 7.1734 7.1918 7.1918 7.6067 7.6067 7.8736 7.8736 7.9166 7.9166 8.2710 8.2710 8.4799 8.4799 8.5811 8.5811 8.6417 8.6417 8.9160 8.9160 9.3529 9.3529 9.4756 9.4756 9.8884 9.8884 10.0428 10.0428 10.2164 10.2164 10.3007 10.3007 10.4638 10.4638 10.9201 10.9201 11.3912 11.3912 11.5036 11.5036 11.7810 11.7810 12.1282 12.1282 12.7803 12.7803 k = 0.3081 0.1025 0.6502 ( 3968 PWs) bands (ev): -0.1775 -0.1775 0.2642 0.2642 0.7998 0.7998 3.0038 3.0038 5.7596 5.7596 6.5902 6.5902 7.1750 7.1750 7.2126 7.2126 7.6129 7.6129 7.8641 7.8641 7.8785 7.8785 8.2484 8.2484 8.4818 8.4818 8.5809 8.5809 8.6323 8.6323 8.9236 8.9236 9.3495 9.3495 9.4816 9.4816 9.9049 9.9049 10.0442 10.0442 10.2023 10.2023 10.2903 10.2903 10.4481 10.4481 10.9335 10.9335 11.3881 11.3881 11.5240 11.5240 11.7484 11.7484 12.1298 12.1298 12.7764 12.7764 k = 0.3262 0.1085 0.6502 ( 3968 PWs) bands (ev): -0.1548 -0.1548 0.2973 0.2973 0.7396 0.7396 2.9435 2.9435 5.8502 5.8502 6.6367 6.6367 7.1748 7.1748 7.2368 7.2368 7.6193 7.6193 7.8303 7.8303 7.8633 7.8633 8.2249 8.2249 8.4835 8.4835 8.5809 8.5809 8.6241 8.6241 8.9319 8.9319 9.3443 9.3443 9.4890 9.4890 9.9204 9.9204 10.0450 10.0450 10.1890 10.1890 10.2798 10.2798 10.4323 10.4323 10.9474 10.9474 11.3817 11.3817 11.5494 11.5494 11.7183 11.7183 12.1258 12.1258 12.7732 12.7732 k = 0.3444 0.1145 0.6502 ( 3964 PWs) bands (ev): -0.1346 -0.1346 0.3271 0.3271 0.6897 0.6897 2.8844 2.8844 5.9356 5.9356 6.6805 6.6805 7.1743 7.1743 7.2615 7.2615 7.6261 7.6261 7.7900 7.7900 7.8546 7.8546 8.2012 8.2012 8.4835 8.4835 8.5810 8.5810 8.6183 8.6183 8.9406 8.9406 9.3374 9.3374 9.4977 9.4977 9.9348 9.9348 10.0443 10.0443 10.1774 10.1774 10.2694 10.2694 10.4165 10.4165 10.9615 10.9615 11.3743 11.3743 11.5777 11.5777 11.6909 11.6909 12.1166 12.1166 12.7710 12.7710 k = 0.3625 0.1206 0.6502 ( 3965 PWs) bands (ev): -0.1187 -0.1187 0.3504 0.3504 0.6551 0.6551 2.8268 2.8268 6.0145 6.0145 6.7217 6.7217 7.1740 7.1740 7.2847 7.2847 7.6329 7.6329 7.7522 7.7522 7.8454 7.8454 8.1778 8.1778 8.4800 8.4800 8.5811 8.5811 8.6165 8.6165 8.9493 8.9493 9.3290 9.3290 9.5076 9.5076 9.9478 9.9478 10.0413 10.0413 10.1685 10.1685 10.2595 10.2595 10.4009 10.4009 10.9757 10.9757 11.3668 11.3668 11.6076 11.6076 11.6663 11.6663 12.1032 12.1032 12.7699 12.7699 k = 0.3806 0.1266 0.6502 ( 3966 PWs) bands (ev): -0.1091 -0.1091 0.3640 0.3640 0.6412 0.6412 2.7710 2.7710 6.0855 6.0855 6.7600 6.7600 7.1739 7.1739 7.3040 7.3040 7.6395 7.6395 7.7203 7.7203 7.8353 7.8353 8.1553 8.1553 8.4714 8.4714 8.5813 8.5813 8.6199 8.6199 8.9581 8.9581 9.3195 9.3195 9.5185 9.5185 9.9593 9.9593 10.0353 10.0353 10.1631 10.1631 10.2502 10.2502 10.3856 10.3856 10.9899 10.9899 11.3601 11.3601 11.6367 11.6367 11.6459 11.6459 12.0871 12.0871 12.7700 12.7700 k = 0.5000 0.1663-0.1266 ( 3936 PWs) bands (ev): -0.8326 -0.8326 -0.6089 -0.6089 3.1684 3.1684 3.2527 3.2527 5.6545 5.6545 6.8152 6.8152 6.9410 6.9410 7.4357 7.4357 7.5578 7.5578 7.8636 7.8636 7.8966 7.8966 8.3263 8.3263 8.4219 8.4219 8.4717 8.4717 8.7422 8.7422 9.0406 9.0406 9.2873 9.2873 9.3411 9.3411 9.5517 9.5517 9.8979 9.8979 10.0959 10.0959 10.6609 10.6609 10.7357 10.7357 10.7583 10.7583 10.8215 10.8215 11.2122 11.2122 11.4870 11.4870 12.1618 12.1618 12.9292 12.9292 k = 0.5061 0.1479-0.1266 ( 3938 PWs) bands (ev): -0.8313 -0.8313 -0.6076 -0.6076 3.1684 3.1684 3.2514 3.2514 5.6552 5.6552 6.8139 6.8139 6.9419 6.9419 7.4378 7.4378 7.5431 7.5431 7.8595 7.8595 7.9112 7.9112 8.3270 8.3270 8.4226 8.4226 8.4691 8.4691 8.7418 8.7418 9.0420 9.0420 9.2827 9.2827 9.3399 9.3399 9.5546 9.5546 9.8991 9.8991 10.0955 10.0955 10.6607 10.6607 10.7350 10.7350 10.7582 10.7582 10.8213 10.8213 11.2121 11.2121 11.4880 11.4880 12.1639 12.1639 12.9130 12.9130 k = 0.5123 0.1294-0.1266 ( 3936 PWs) bands (ev): -0.8273 -0.8273 -0.6036 -0.6036 3.1685 3.1685 3.2476 3.2476 5.6573 5.6573 6.8102 6.8102 6.9447 6.9447 7.4432 7.4432 7.5048 7.5048 7.8544 7.8544 7.9431 7.9431 8.3291 8.3291 8.4248 8.4248 8.4615 8.4615 8.7406 8.7406 9.0462 9.0462 9.2697 9.2697 9.3364 9.3364 9.5627 9.5627 9.9028 9.9028 10.0944 10.0944 10.6598 10.6598 10.7330 10.7330 10.7578 10.7578 10.8209 10.8209 11.2116 11.2116 11.4910 11.4910 12.1701 12.1701 12.8638 12.8638 k = 0.5184 0.1110-0.1266 ( 3944 PWs) bands (ev): -0.8206 -0.8206 -0.5971 -0.5971 3.1687 3.1687 3.2410 3.2410 5.6607 5.6607 6.8042 6.8042 6.9493 6.9493 7.4342 7.4342 7.4692 7.4692 7.8504 7.8504 7.9815 7.9815 8.3322 8.3322 8.4276 8.4276 8.4499 8.4499 8.7387 8.7387 9.0528 9.0528 9.2498 9.2498 9.3306 9.3306 9.5746 9.5746 9.9086 9.9086 10.0926 10.0926 10.6584 10.6584 10.7296 10.7296 10.7573 10.7573 10.8201 10.8201 11.2108 11.2108 11.4957 11.4957 12.1800 12.1800 12.7885 12.7885 k = 0.5245 0.0925-0.1266 ( 3948 PWs) bands (ev): -0.8112 -0.8112 -0.5879 -0.5879 3.1689 3.1689 3.2318 3.2318 5.6655 5.6655 6.7964 6.7964 6.9555 6.9555 7.3757 7.3757 7.4778 7.4778 7.8466 7.8466 8.0208 8.0208 8.3361 8.3361 8.4251 8.4251 8.4417 8.4417 8.7363 8.7363 9.0614 9.0614 9.2249 9.2249 9.3222 9.3222 9.5888 9.5888 9.9163 9.9163 10.0901 10.0901 10.6564 10.6564 10.7247 10.7247 10.7565 10.7565 10.8191 10.8191 11.2097 11.2097 11.5022 11.5022 12.1935 12.1935 12.6966 12.6966 k = 0.5307 0.0741-0.1266 ( 3952 PWs) bands (ev): -0.7992 -0.7992 -0.5761 -0.5761 3.1691 3.1691 3.2197 3.2197 5.6714 5.6714 6.7871 6.7871 6.9630 6.9630 7.3062 7.3062 7.4961 7.4961 7.8424 7.8424 8.0579 8.0579 8.3393 8.3393 8.4098 8.4098 8.4461 8.4461 8.7336 8.7336 9.0713 9.0713 9.1965 9.1965 9.3116 9.3116 9.6039 9.6039 9.9255 9.9255 10.0870 10.0870 10.6538 10.6538 10.7185 10.7185 10.7556 10.7556 10.8178 10.8178 11.2081 11.2081 11.5101 11.5101 12.2100 12.2100 12.5943 12.5943 k = 0.5368 0.0557-0.1266 ( 3950 PWs) bands (ev): -0.7845 -0.7845 -0.5617 -0.5617 3.1694 3.1694 3.2047 3.2047 5.6784 5.6784 6.7770 6.7770 6.9710 6.9710 7.2347 7.2347 7.5182 7.5182 7.8372 7.8372 8.0910 8.0910 8.3377 8.3377 8.3943 8.3943 8.4549 8.4549 8.7309 8.7309 9.0816 9.0816 9.1665 9.1665 9.2987 9.2987 9.6193 9.6193 9.9358 9.9358 10.0833 10.0833 10.6505 10.6505 10.7110 10.7110 10.7545 10.7545 10.8164 10.8164 11.2059 11.2059 11.5192 11.5192 12.2288 12.2288 12.4861 12.4861 k = 0.5429 0.0372-0.1266 ( 3950 PWs) bands (ev): -0.7672 -0.7672 -0.5448 -0.5448 3.1696 3.1696 3.1864 3.1864 5.6863 5.6863 6.7663 6.7663 6.9769 6.9769 7.1660 7.1660 7.5428 7.5428 7.8308 7.8308 8.1193 8.1193 8.3241 8.3241 8.3888 8.3888 8.4657 8.4657 8.7285 8.7285 9.0897 9.0897 9.1378 9.1378 9.2836 9.2836 9.6341 9.6341 9.9469 9.9469 10.0792 10.0792 10.6465 10.6465 10.7022 10.7022 10.7532 10.7532 10.8148 10.8148 11.2032 11.2032 11.5292 11.5292 12.2485 12.2485 12.3754 12.3754 k = 0.5491 0.0188-0.1266 ( 3956 PWs) bands (ev): -0.7472 -0.7472 -0.5252 -0.5252 3.1646 3.1646 3.1700 3.1700 5.6949 5.6949 6.7555 6.7555 6.9731 6.9731 7.1094 7.1094 7.5693 7.5693 7.8228 7.8228 8.1426 8.1426 8.2987 8.2987 8.3937 8.3937 8.4776 8.4776 8.7269 8.7269 9.0833 9.0833 9.1233 9.1233 9.2665 9.2665 9.6479 9.6479 9.9583 9.9583 10.0747 10.0747 10.6417 10.6417 10.6925 10.6925 10.7516 10.7516 10.8129 10.8129 11.1997 11.1997 11.5399 11.5399 12.2520 12.2520 12.2801 12.2801 k = 0.5552 0.0004-0.1266 ( 3960 PWs) bands (ev): -0.7245 -0.7245 -0.5032 -0.5032 3.1395 3.1395 3.1700 3.1700 5.7038 5.7038 6.7450 6.7450 6.9441 6.9441 7.0817 7.0817 7.5969 7.5969 7.8129 7.8129 8.1608 8.1608 8.2675 8.2675 8.4038 8.4038 8.4898 8.4898 8.7267 8.7267 9.0570 9.0570 9.1288 9.1288 9.2474 9.2474 9.6603 9.6603 9.9698 9.9698 10.0699 10.0699 10.6354 10.6354 10.6822 10.6822 10.7499 10.7499 10.8110 10.8110 11.1954 11.1954 11.5511 11.5511 12.1484 12.1484 12.2916 12.2916 k = 0.5613-0.0181-0.1266 ( 3962 PWs) bands (ev): -0.6993 -0.6993 -0.4786 -0.4786 3.1105 3.1105 3.1701 3.1701 5.7129 5.7129 6.7352 6.7352 6.8911 6.8911 7.0830 7.0830 7.6250 7.6250 7.8006 7.8006 8.1741 8.1741 8.2336 8.2336 8.4167 8.4167 8.5013 8.5013 8.7284 8.7284 9.0263 9.0263 9.1391 9.1391 9.2266 9.2266 9.6710 9.6710 9.9811 9.9811 10.0649 10.0649 10.6274 10.6274 10.6720 10.6720 10.7480 10.7480 10.8089 10.8089 11.1901 11.1901 11.5626 11.5626 12.0389 12.0389 12.3082 12.3082 k = 0.5675-0.0365-0.1266 ( 3968 PWs) bands (ev): -0.6714 -0.6714 -0.4515 -0.4515 3.0774 3.0774 3.1700 3.1700 5.7216 5.7216 6.7260 6.7260 6.8309 6.8309 7.0977 7.0977 7.6525 7.6525 7.7857 7.7857 8.1806 8.1806 8.2016 8.2016 8.4312 8.4312 8.5111 8.5111 8.7328 8.7328 8.9959 8.9959 9.1498 9.1498 9.2042 9.2042 9.6796 9.6796 9.9919 9.9919 10.0600 10.0600 10.6167 10.6167 10.6627 10.6627 10.7458 10.7458 10.8065 10.8065 11.1837 11.1837 11.5743 11.5743 11.9315 11.9315 12.3207 12.3207 k = 0.5736-0.0550-0.1266 ( 3964 PWs) bands (ev): -0.6409 -0.6409 -0.4220 -0.4220 3.0402 3.0402 3.1697 3.1697 5.7295 5.7295 6.7173 6.7173 6.7724 6.7724 7.1186 7.1186 7.6782 7.6782 7.7677 7.7677 8.1587 8.1587 8.1947 8.1947 8.4470 8.4470 8.5185 8.5185 8.7401 8.7401 8.9675 8.9675 9.1594 9.1594 9.1812 9.1812 9.6861 9.6861 10.0018 10.0018 10.0556 10.0556 10.6031 10.6031 10.6548 10.6548 10.7436 10.7436 10.8041 10.8041 11.1761 11.1761 11.5859 11.5859 11.8273 11.8273 12.3266 12.3266 k = 0.5797-0.0734-0.1266 ( 3970 PWs) bands (ev): -0.6078 -0.6078 -0.3901 -0.3901 2.9985 2.9985 3.1692 3.1692 5.7361 5.7361 6.7021 6.7021 6.7260 6.7260 7.1433 7.1433 7.7000 7.7000 7.7468 7.7468 8.1262 8.1262 8.1975 8.1975 8.4636 8.4636 8.5232 8.5232 8.7501 8.7501 8.9417 8.9417 9.1523 9.1523 9.1728 9.1728 9.6900 9.6900 10.0100 10.0100 10.0526 10.0526 10.5866 10.5866 10.6484 10.6484 10.7411 10.7411 10.8015 10.8015 11.1672 11.1672 11.5972 11.5972 11.7271 11.7271 12.3237 12.3237 k = 0.5858-0.0918-0.1266 ( 3966 PWs) bands (ev): -0.5722 -0.5722 -0.3558 -0.3558 2.9522 2.9522 3.1685 3.1685 5.7409 5.7409 6.6615 6.6615 6.7127 6.7127 7.1707 7.1707 7.7093 7.7093 7.7290 7.7290 8.0971 8.0971 8.1991 8.1991 8.4809 8.4809 8.5255 8.5255 8.7623 8.7623 8.9195 8.9195 9.1270 9.1270 9.1806 9.1806 9.6913 9.6913 10.0149 10.0149 10.0524 10.0524 10.5676 10.5676 10.6431 10.6431 10.7384 10.7384 10.7987 10.7987 11.1569 11.1569 11.6041 11.6041 11.6352 11.6352 12.3095 12.3095 k = 0.5920-0.1103-0.1266 ( 3960 PWs) bands (ev): -0.5340 -0.5340 -0.3192 -0.3192 2.9013 2.9013 3.1674 3.1674 5.7433 5.7433 6.6205 6.6205 6.7088 6.7088 7.2006 7.2006 7.6863 7.6863 7.7307 7.7307 8.0750 8.0750 8.1994 8.1994 8.4982 8.4982 8.5260 8.5260 8.7754 8.7754 8.9018 8.9018 9.1001 9.1001 9.1883 9.1883 9.6900 9.6900 10.0154 10.0154 10.0564 10.0564 10.5467 10.5467 10.6386 10.6386 10.7356 10.7356 10.7958 10.7958 11.1452 11.1452 11.5346 11.5346 11.6234 11.6234 12.2824 12.2824 k = 0.5981-0.1287-0.1266 ( 3968 PWs) bands (ev): -0.4933 -0.4933 -0.2803 -0.2803 2.8458 2.8458 3.1660 3.1660 5.7428 5.7428 6.5866 6.5866 6.7077 6.7077 7.2325 7.2325 7.6530 7.6530 7.7269 7.7269 8.0632 8.0632 8.1985 8.1985 8.5138 8.5138 8.5266 8.5266 8.7874 8.7874 8.8902 8.8902 9.0724 9.0724 9.1949 9.1949 9.6859 9.6859 10.0122 10.0122 10.0637 10.0637 10.5241 10.5241 10.6348 10.6348 10.7326 10.7326 10.7926 10.7926 11.1320 11.1320 11.4470 11.4470 11.6338 11.6338 12.2412 12.2412 k = 0.6042-0.1471-0.1266 ( 3970 PWs) bands (ev): -0.4500 -0.4500 -0.2391 -0.2391 2.7855 2.7855 3.1643 3.1643 5.7390 5.7390 6.5612 6.5612 6.7087 6.7087 7.2663 7.2663 7.6152 7.6152 7.7106 7.7106 8.0632 8.0632 8.1969 8.1969 8.5189 8.5189 8.5366 8.5366 8.7956 8.7956 8.8869 8.8869 9.0445 9.0445 9.2004 9.2004 9.6790 9.6790 10.0069 10.0069 10.0728 10.0728 10.5001 10.5001 10.6315 10.6315 10.7293 10.7293 10.7892 10.7892 11.1172 11.1172 11.3631 11.3631 11.6444 11.6444 12.1865 12.1865 k = 0.6104-0.1656-0.1266 ( 3972 PWs) bands (ev): -0.4043 -0.4043 -0.1959 -0.1959 2.7206 2.7206 3.1621 3.1621 5.7317 5.7317 6.5443 6.5443 6.7119 6.7119 7.3018 7.3018 7.5736 7.5736 7.6823 7.6823 8.0740 8.0740 8.1947 8.1947 8.5171 8.5171 8.5520 8.5520 8.7986 8.7986 8.8929 8.8929 9.0170 9.0170 9.2045 9.2045 9.6694 9.6694 10.0003 10.0003 10.0828 10.0828 10.4751 10.4751 10.6287 10.6287 10.7260 10.7260 10.7856 10.7856 11.1009 11.1009 11.2833 11.2833 11.6548 11.6548 12.1198 12.1198 k = 0.6165-0.1840-0.1266 ( 3968 PWs) bands (ev): -0.3561 -0.3561 -0.1506 -0.1506 2.6513 2.6513 3.1596 3.1596 5.7208 5.7208 6.5360 6.5360 6.7172 6.7172 7.3384 7.3384 7.5296 7.5296 7.6447 7.6447 8.0929 8.0929 8.1921 8.1921 8.5144 8.5144 8.5669 8.5669 8.7977 8.7977 8.9062 8.9062 8.9904 8.9904 9.2074 9.2074 9.6572 9.6572 9.9930 9.9930 10.0932 10.0932 10.4493 10.4493 10.6262 10.6262 10.7225 10.7225 10.7817 10.7817 11.0831 11.0831 11.2079 11.2079 11.6648 11.6648 12.0433 12.0433 k = 0.6226-0.2025-0.1266 ( 3972 PWs) bands (ev): -0.3055 -0.3055 -0.1034 -0.1034 2.5778 2.5778 3.1565 3.1565 5.7067 5.7067 6.5356 6.5356 6.7246 6.7246 7.3746 7.3746 7.4851 7.4851 7.6003 7.6003 8.1172 8.1172 8.1891 8.1891 8.5115 8.5115 8.5799 8.5799 8.7955 8.7955 8.9236 8.9236 8.9658 8.9658 9.2090 9.2090 9.6425 9.6425 9.9849 9.9849 10.1038 10.1038 10.4230 10.4230 10.6240 10.6240 10.7187 10.7187 10.7775 10.7775 11.0636 11.0636 11.1368 11.1368 11.6740 11.6740 11.9593 11.9593 k = 0.6288-0.2209-0.1266 ( 3968 PWs) bands (ev): -0.2524 -0.2524 -0.0543 -0.0543 2.5003 2.5003 3.1529 3.1529 5.6894 5.6894 6.5424 6.5424 6.7340 6.7340 7.3979 7.3979 7.4533 7.4533 7.5514 7.5514 8.1445 8.1445 8.1859 8.1859 8.5086 8.5086 8.5900 8.5900 8.7937 8.7937 8.9369 8.9369 8.9500 8.9500 9.2092 9.2092 9.6257 9.6257 9.9761 9.9761 10.1145 10.1145 10.3967 10.3967 10.6221 10.6221 10.7147 10.7147 10.7730 10.7730 11.0415 11.0415 11.0715 11.0715 11.6824 11.6824 11.8701 11.8701 k = 0.6349-0.2393-0.1266 ( 3966 PWs) bands (ev): -0.1970 -0.1970 -0.0034 -0.0034 2.4192 2.4192 3.1488 3.1488 5.6693 5.6693 6.5557 6.5557 6.7454 6.7454 7.3704 7.3704 7.4730 7.4730 7.4994 7.4994 8.1712 8.1712 8.1845 8.1845 8.5059 8.5059 8.5964 8.5964 8.7934 8.7934 8.9218 8.9218 8.9671 8.9671 9.2079 9.2079 9.6068 9.6068 9.9663 9.9663 10.1251 10.1251 10.3707 10.3707 10.6203 10.6203 10.7102 10.7102 10.7678 10.7678 11.0014 11.0014 11.0275 11.0275 11.6884 11.6884 11.7787 11.7787 k = 0.6410-0.2578-0.1266 ( 3962 PWs) bands (ev): -0.1393 -0.1393 0.0490 0.0490 2.3349 2.3349 3.1442 3.1442 5.6465 5.6465 6.5745 6.5745 6.7587 6.7587 7.3246 7.3246 7.4448 7.4448 7.5130 7.5130 8.1743 8.1743 8.2066 8.2066 8.5033 8.5033 8.5981 8.5981 8.7950 8.7950 8.9074 8.9074 8.9884 8.9884 9.2053 9.2053 9.5864 9.5864 9.9553 9.9553 10.1356 10.1356 10.3453 10.3453 10.6186 10.6186 10.7049 10.7049 10.7618 10.7618 10.9456 10.9456 11.0033 11.0033 11.6677 11.6677 11.7109 11.7109 k = 0.6472-0.2762-0.1266 ( 3964 PWs) bands (ev): -0.0792 -0.0792 0.1027 0.1027 2.2478 2.2478 3.1390 3.1390 5.6211 5.6211 6.5981 6.5981 6.7738 6.7738 7.2776 7.2776 7.3891 7.3891 7.5560 7.5560 8.1686 8.1686 8.2364 8.2364 8.5009 8.5009 8.5945 8.5945 8.7988 8.7988 8.8980 8.8980 9.0096 9.0096 9.2013 9.2013 9.5646 9.5646 9.9431 9.9431 10.1459 10.1459 10.3211 10.3211 10.6167 10.6167 10.6981 10.6981 10.7542 10.7542 10.8941 10.8941 10.9804 10.9804 11.5789 11.5789 11.7092 11.7092 k = 0.6533-0.2946-0.1266 ( 3968 PWs) bands (ev): -0.0169 -0.0169 0.1577 0.1577 2.1584 2.1584 3.1332 3.1332 5.5933 5.5933 6.6256 6.6256 6.7904 6.7904 7.2322 7.2322 7.3324 7.3324 7.6005 7.6005 8.1611 8.1611 8.2659 8.2659 8.4985 8.4985 8.5857 8.5857 8.8049 8.8049 8.8938 8.8938 9.0302 9.0302 9.1960 9.1960 9.5421 9.5421 9.9291 9.9291 10.1558 10.1558 10.2985 10.2985 10.6145 10.6145 10.6880 10.6880 10.7446 10.7446 10.8505 10.8505 10.9577 10.9577 11.4833 11.4833 11.7135 11.7135 k = 0.6594-0.3131-0.1266 ( 3966 PWs) bands (ev): 0.0476 0.0476 0.2135 0.2135 2.0672 2.0672 3.1269 3.1269 5.5628 5.5628 6.6565 6.6565 6.8083 6.8083 7.1895 7.1895 7.2754 7.2754 7.6458 7.6458 8.1520 8.1520 8.2939 8.2939 8.4962 8.4962 8.5729 8.5729 8.8133 8.8133 8.8947 8.8947 9.0495 9.0495 9.1893 9.1893 9.5194 9.5194 9.9135 9.9135 10.1652 10.1652 10.2780 10.2780 10.6117 10.6117 10.6713 10.6713 10.7332 10.7332 10.8181 10.8181 10.9352 10.9352 11.3881 11.3881 11.7174 11.7174 k = 0.6656-0.3315-0.1266 ( 3960 PWs) bands (ev): 0.1143 0.1143 0.2699 0.2699 1.9748 1.9748 3.1199 3.1199 5.5296 5.5296 6.6900 6.6900 6.8271 6.8271 7.1504 7.1504 7.2186 7.2186 7.6911 7.6911 8.1411 8.1411 8.3194 8.3194 8.4939 8.4939 8.5576 8.5576 8.8242 8.8242 8.8999 8.8999 9.0671 9.0671 9.1815 9.1815 9.4970 9.4970 9.8958 9.8958 10.1739 10.1739 10.2600 10.2600 10.6073 10.6073 10.6455 10.6455 10.7229 10.7229 10.7973 10.7973 10.9132 10.9132 11.2948 11.2948 11.7204 11.7204 k = 0.6717-0.3500-0.1266 ( 3966 PWs) bands (ev): 0.1831 0.1831 0.3263 0.3263 1.8820 1.8820 3.1123 3.1123 5.4936 5.4936 6.7257 6.7257 6.8461 6.8461 7.1157 7.1157 7.1627 7.1627 7.7360 7.7360 8.1286 8.1286 8.3408 8.3408 8.4913 8.4913 8.5424 8.5424 8.8374 8.8374 8.9085 8.9085 9.0821 9.0821 9.1725 9.1725 9.4759 9.4759 9.8762 9.8762 10.1814 10.1814 10.2449 10.2449 10.5953 10.5953 10.6179 10.6179 10.7152 10.7152 10.7845 10.7845 10.8921 10.8921 11.2046 11.2046 11.7222 11.7222 k = 0.6778-0.3684-0.1266 ( 3960 PWs) bands (ev): 0.2539 0.2539 0.3822 0.3822 1.7895 1.7895 3.1042 3.1042 5.4549 5.4549 6.7630 6.7630 6.8640 6.8640 7.0858 7.0858 7.1093 7.1093 7.7794 7.7794 8.1148 8.1148 8.3559 8.3559 8.4887 8.4887 8.5301 8.5301 8.8529 8.8529 8.9196 8.9196 9.0938 9.0938 9.1626 9.1626 9.4569 9.4569 9.8550 9.8550 10.1871 10.1871 10.2333 10.2333 10.5627 10.5627 10.6058 10.6058 10.7097 10.7097 10.7762 10.7762 10.8723 10.8723 11.1188 11.1188 11.7230 11.7230 k = 0.6840-0.3868-0.1266 ( 3964 PWs) bands (ev): 0.3268 0.3268 0.4366 0.4366 1.6983 1.6983 3.0954 3.0954 5.4134 5.4134 6.8014 6.8014 6.8779 6.8779 7.0577 7.0577 7.0646 7.0646 7.8197 7.8197 8.1008 8.1008 8.3619 8.3619 8.4872 8.4872 8.5229 8.5229 8.8704 8.8704 8.9328 8.9328 9.1011 9.1011 9.1523 9.1523 9.4409 9.4409 9.8321 9.8321 10.1897 10.1897 10.2258 10.2258 10.5227 10.5227 10.5985 10.5985 10.7055 10.7055 10.7702 10.7702 10.8539 10.8539 11.0382 11.0382 11.7224 11.7224 k = 0.6901-0.4053-0.1266 ( 3966 PWs) bands (ev): 0.4015 0.4015 0.4885 0.4885 1.6100 1.6100 3.0861 3.0861 5.3693 5.3693 6.8398 6.8398 6.8812 6.8812 7.0226 7.0226 7.0444 7.0444 7.8542 7.8542 8.0889 8.0889 8.3574 8.3574 8.4881 8.4881 8.5212 8.5212 8.8898 8.8898 8.9474 8.9474 9.1034 9.1034 9.1420 9.1420 9.4287 9.4287 9.8081 9.8081 10.1884 10.1884 10.2226 10.2226 10.4823 10.4823 10.5910 10.5910 10.7020 10.7020 10.7654 10.7654 10.8370 10.8370 10.9644 10.9644 11.7208 11.7208 k = 0.6962-0.4237-0.1266 ( 3968 PWs) bands (ev): 0.4781 0.4781 0.5359 0.5359 1.5262 1.5262 3.0762 3.0762 5.3230 5.3230 6.8621 6.8621 6.8791 6.8791 7.0061 7.0061 7.0339 7.0339 7.8779 7.8779 8.0836 8.0836 8.3442 8.3442 8.4907 8.4907 8.5241 8.5241 8.9109 8.9109 8.9628 8.9628 9.1005 9.1005 9.1319 9.1319 9.4207 9.4207 9.7834 9.7834 10.1842 10.1842 10.2218 10.2218 10.4435 10.4435 10.5825 10.5825 10.6992 10.6992 10.7614 10.7614 10.8216 10.8216 10.8984 10.8984 11.7181 11.7181 k = 0.7024-0.4421-0.1266 ( 3964 PWs) bands (ev): 0.5564 0.5564 0.5765 0.5765 1.4498 1.4498 3.0657 3.0657 5.2749 5.2749 6.8263 6.8263 6.9122 6.9122 7.0073 7.0073 7.0344 7.0344 7.8853 7.8853 8.0900 8.0900 8.3258 8.3258 8.4935 8.4935 8.5302 8.5302 8.9331 8.9331 8.9784 8.9784 9.0942 9.0942 9.1217 9.1217 9.4169 9.4169 9.7584 9.7584 10.1786 10.1786 10.2204 10.2204 10.4080 10.4080 10.5732 10.5732 10.6967 10.6967 10.7575 10.7575 10.8066 10.8066 10.8426 10.8426 11.7145 11.7145 k = 0.7085-0.4606-0.1266 ( 3970 PWs) bands (ev): 0.6060 0.6060 0.6369 0.6369 1.3843 1.3843 3.0546 3.0546 5.2254 5.2254 6.7804 6.7804 6.9379 6.9379 7.0176 7.0176 7.0481 7.0481 7.8745 7.8745 8.1095 8.1095 8.3051 8.3051 8.4958 8.4958 8.5372 8.5372 8.9554 8.9554 8.9927 8.9927 9.0869 9.0869 9.1116 9.1116 9.4163 9.4163 9.7335 9.7335 10.1725 10.1725 10.2160 10.2160 10.3781 10.3781 10.5630 10.5630 10.6945 10.6945 10.7522 10.7522 10.7848 10.7848 10.8063 10.8063 11.7100 11.7100 k = 0.7146-0.4790-0.1266 ( 3966 PWs) bands (ev): 0.6206 0.6206 0.7185 0.7185 1.3343 1.3343 3.0430 3.0430 5.1752 5.1752 6.7315 6.7315 6.9521 6.9521 7.0354 7.0354 7.0726 7.0726 7.8496 7.8496 8.1379 8.1379 8.2841 8.2841 8.4977 8.4977 8.5435 8.5435 8.9748 8.9748 9.0045 9.0045 9.0810 9.0810 9.1048 9.1048 9.4179 9.4179 9.7090 9.7090 10.1656 10.1656 10.2072 10.2072 10.3559 10.3559 10.5525 10.5525 10.6922 10.6922 10.7372 10.7372 10.7624 10.7624 10.7916 10.7916 11.7050 11.7050 k = 0.7208-0.4975-0.1266 ( 3966 PWs) bands (ev): 0.6155 0.6155 0.8016 0.8016 1.3043 1.3043 3.0309 3.0309 5.1249 5.1249 6.6822 6.6822 6.9584 6.9584 7.0558 7.0558 7.1056 7.1056 7.8152 7.8152 8.1700 8.1700 8.2642 8.2642 8.4994 8.4994 8.5480 8.5480 8.9845 8.9845 9.0141 9.0141 9.0773 9.0773 9.1073 9.1073 9.4203 9.4203 9.6852 9.6852 10.1571 10.1571 10.1953 10.1953 10.3426 10.3426 10.5418 10.5418 10.6889 10.6889 10.7135 10.7135 10.7557 10.7557 10.7819 10.7819 11.6995 11.6995 k = 0.2792-0.8396-0.0000 ( 3966 PWs) bands (ev): 0.6155 0.6155 0.8016 0.8016 1.3043 1.3043 3.0309 3.0309 5.1249 5.1249 6.6822 6.6822 6.9584 6.9584 7.0558 7.0558 7.1056 7.1056 7.8152 7.8152 8.1700 8.1700 8.2642 8.2642 8.4994 8.4994 8.5480 8.5480 8.9845 8.9845 9.0141 9.0141 9.0773 9.0773 9.1073 9.1073 9.4203 9.4203 9.6852 9.6852 10.1571 10.1571 10.1953 10.1953 10.3426 10.3426 10.5418 10.5418 10.6889 10.6889 10.7135 10.7135 10.7557 10.7557 10.7819 10.7819 11.6995 11.6995 k = 0.2730-0.8210-0.0000 ( 3962 PWs) bands (ev): 0.5883 0.5883 0.8872 0.8872 1.2960 1.2960 3.0181 3.0181 5.0747 5.0747 6.6329 6.6329 6.9615 6.9615 7.0747 7.0747 7.1446 7.1446 7.7738 7.7738 8.2023 8.2023 8.2467 8.2467 8.5011 8.5011 8.5501 8.5501 8.9813 8.9813 9.0168 9.0168 9.0834 9.0834 9.1205 9.1205 9.4221 9.4221 9.6622 9.6622 10.1466 10.1466 10.1832 10.1832 10.3369 10.3369 10.5311 10.5311 10.6811 10.6811 10.6993 10.6993 10.7523 10.7523 10.7741 10.7741 11.6935 11.6935 k = 0.2668-0.8023-0.0000 ( 3970 PWs) bands (ev): 0.5411 0.5411 0.9741 0.9741 1.3077 1.3077 3.0048 3.0048 5.0258 5.0258 6.5849 6.5849 6.9633 6.9633 7.0906 7.0906 7.1864 7.1864 7.7280 7.7280 8.2210 8.2210 8.2438 8.2438 8.5027 8.5027 8.5497 8.5497 8.9706 8.9706 9.0072 9.0072 9.1035 9.1035 9.1405 9.1405 9.4222 9.4222 9.6404 9.6404 10.1353 10.1353 10.1735 10.1735 10.3368 10.3368 10.5207 10.5207 10.6708 10.6708 10.6953 10.6953 10.7492 10.7492 10.7681 10.7681 11.6874 11.6874 k = 0.2606-0.7837-0.0000 ( 3976 PWs) bands (ev): 0.4785 0.4785 1.0622 1.0622 1.3346 1.3346 2.9910 2.9910 4.9789 4.9789 6.5386 6.5386 6.9641 6.9641 7.1033 7.1033 7.2291 7.2291 7.6793 7.6793 8.2117 8.2117 8.2690 8.2690 8.5042 8.5042 8.5467 8.5467 8.9568 8.9568 8.9913 8.9913 9.1307 9.1307 9.1640 9.1640 9.4201 9.4201 9.6203 9.6203 10.1266 10.1266 10.1660 10.1660 10.3409 10.3409 10.5107 10.5107 10.6650 10.6650 10.6945 10.6945 10.7455 10.7455 10.7643 10.7643 11.6811 11.6811 k = 0.2544-0.7650-0.0000 ( 3980 PWs) bands (ev): 0.4054 0.4054 1.1512 1.1512 1.3715 1.3715 2.9768 2.9768 4.9350 4.9350 6.4944 6.4944 6.9638 6.9638 7.1124 7.1124 7.2708 7.2708 7.6296 7.6296 8.2016 8.2016 8.2945 8.2945 8.5058 8.5058 8.5414 8.5414 8.9416 8.9416 8.9733 8.9733 9.1604 9.1604 9.1894 9.1894 9.4159 9.4159 9.6020 9.6020 10.1228 10.1228 10.1601 10.1601 10.3483 10.3483 10.5012 10.5012 10.6646 10.6646 10.6952 10.6952 10.7413 10.7413 10.7628 10.7628 11.6749 11.6749 k = 0.2482-0.7463-0.0000 ( 3984 PWs) bands (ev): 0.3255 0.3255 1.2412 1.2412 1.4143 1.4143 2.9620 2.9620 4.8946 4.8946 6.4526 6.4526 6.9616 6.9616 7.1177 7.1177 7.3088 7.3088 7.5819 7.5819 8.1940 8.1940 8.3161 8.3161 8.5073 8.5073 8.5343 8.5343 8.9258 8.9258 8.9547 8.9547 9.1898 9.1898 9.2162 9.2162 9.4105 9.4105 9.5859 9.5859 10.1242 10.1242 10.1560 10.1560 10.3588 10.3588 10.4919 10.4919 10.6688 10.6688 10.6978 10.6978 10.7372 10.7372 10.7634 10.7634 11.6688 11.6688 k = 0.2420-0.7277-0.0000 ( 3982 PWs) bands (ev): 0.2416 0.2416 1.3318 1.3318 1.4601 1.4601 2.9469 2.9469 4.8585 4.8585 6.4134 6.4134 6.9569 6.9569 7.1190 7.1190 7.3372 7.3372 7.5428 7.5428 8.1890 8.1890 8.3330 8.3330 8.5089 8.5089 8.5260 8.5260 8.9100 8.9100 8.9364 8.9364 9.2164 9.2164 9.2438 9.2438 9.4066 9.4066 9.5725 9.5725 10.1276 10.1276 10.1567 10.1567 10.3721 10.3721 10.4827 10.4827 10.6750 10.6750 10.7034 10.7034 10.7340 10.7340 10.7664 10.7664 11.6629 11.6629 k = 0.2358-0.7090-0.0000 ( 3982 PWs) bands (ev): 0.1555 0.1555 1.4229 1.4229 1.5066 1.5066 2.9315 2.9315 4.8274 4.8274 6.3769 6.3769 6.9491 6.9491 7.1164 7.1164 7.3435 7.3435 7.5251 7.5251 8.1862 8.1862 8.3446 8.3446 8.5097 8.5097 8.5177 8.5177 8.8943 8.8943 8.9187 8.9187 9.2375 9.2375 9.2707 9.2707 9.4082 9.4082 9.5621 9.5621 10.1274 10.1274 10.1665 10.1665 10.3882 10.3882 10.4734 10.4734 10.6804 10.6804 10.7127 10.7127 10.7330 10.7330 10.7729 10.7729 11.6573 11.6573 k = 0.2296-0.6904-0.0000 ( 3980 PWs) bands (ev): 0.0683 0.0683 1.5143 1.5143 1.5523 1.5523 2.9156 2.9156 4.8020 4.8020 6.3436 6.3436 6.9373 6.9373 7.1102 7.1102 7.3201 7.3201 7.5371 7.5371 8.1848 8.1848 8.3510 8.3510 8.5050 8.5050 8.5152 8.5152 8.8790 8.8790 8.9020 8.9020 9.2507 9.2507 9.2942 9.2942 9.4206 9.4206 9.5554 9.5554 10.1233 10.1233 10.1839 10.1839 10.4068 10.4068 10.4639 10.4639 10.6843 10.6843 10.7213 10.7213 10.7369 10.7369 10.7861 10.7861 11.6520 11.6520 k = 0.2234-0.6717-0.0000 ( 3986 PWs) bands (ev): -0.0191 -0.0191 1.5956 1.5956 1.6062 1.6062 2.8994 2.8994 4.7829 4.7829 6.3134 6.3134 6.9207 6.9207 7.1006 7.1006 7.2784 7.2784 7.5680 7.5680 8.1838 8.1838 8.3522 8.3522 8.4968 8.4968 8.5170 8.5170 8.8640 8.8640 8.8864 8.8864 9.2550 9.2550 9.3130 9.3130 9.4461 9.4461 9.5531 9.5531 10.1175 10.1175 10.2052 10.2052 10.4266 10.4266 10.4551 10.4551 10.6873 10.6873 10.7255 10.7255 10.7452 10.7452 10.8097 10.8097 11.6470 11.6470 k = 0.2172-0.6531-0.0000 ( 3986 PWs) bands (ev): -0.1061 -0.1061 1.6366 1.6366 1.6973 1.6973 2.8830 2.8830 4.7707 4.7707 6.2868 6.2868 6.8985 6.8985 7.0881 7.0881 7.2305 7.2305 7.6068 7.6068 8.1822 8.1822 8.3489 8.3489 8.4896 8.4896 8.5193 8.5193 8.8494 8.8494 8.8719 8.8719 9.2520 9.2520 9.3278 9.3278 9.4821 9.4821 9.5561 9.5561 10.1111 10.1111 10.2281 10.2281 10.4348 10.4348 10.4590 10.4590 10.6901 10.6901 10.7293 10.7293 10.7533 10.7533 10.8445 10.8445 11.6424 11.6424 k = 0.2110-0.6344-0.0000 ( 3986 PWs) bands (ev): -0.1924 -0.1924 1.6737 1.6737 1.7882 1.7882 2.8663 2.8663 4.7659 4.7659 6.2638 6.2638 6.8700 6.8700 7.0730 7.0730 7.1818 7.1818 7.6485 7.6485 8.1789 8.1789 8.3417 8.3417 8.4843 8.4843 8.5217 8.5217 8.8352 8.8352 8.8585 8.8585 9.2453 9.2453 9.3391 9.3391 9.5224 9.5224 9.5671 9.5671 10.1043 10.1043 10.2510 10.2510 10.4249 10.4249 10.4813 10.4813 10.6932 10.6932 10.7345 10.7345 10.7609 10.7609 10.8890 10.8890 11.6382 11.6382 k = 0.2048-0.6157-0.0000 ( 3986 PWs) bands (ev): -0.2774 -0.2774 1.7064 1.7064 1.8784 1.8784 2.8493 2.8493 4.7688 4.7688 6.2448 6.2448 6.8348 6.8348 7.0558 7.0558 7.1351 7.1351 7.6912 7.6912 8.1728 8.1728 8.3314 8.3314 8.4815 8.4815 8.5237 8.5237 8.8215 8.8215 8.8460 8.8460 9.2373 9.2373 9.3472 9.3472 9.5550 9.5550 9.5954 9.5954 10.0974 10.0974 10.2730 10.2730 10.4117 10.4117 10.5063 10.5063 10.6968 10.6968 10.7415 10.7415 10.7689 10.7689 10.9418 10.9418 11.6343 11.6343 k = 0.1986-0.5971-0.0000 ( 3984 PWs) bands (ev): -0.3611 -0.3611 1.7345 1.7345 1.9677 1.9677 2.8322 2.8322 4.7798 4.7798 6.2299 6.2299 6.7931 6.7931 7.0368 7.0368 7.0915 7.0915 7.7336 7.7336 8.1635 8.1635 8.3189 8.3189 8.4813 8.4813 8.5255 8.5255 8.8082 8.8082 8.8342 8.8342 9.2298 9.2298 9.3527 9.3527 9.5757 9.5757 9.6432 9.6432 10.0903 10.0903 10.2938 10.2938 10.3971 10.3971 10.5312 10.5312 10.7008 10.7008 10.7506 10.7506 10.7782 10.7782 11.0020 11.0020 11.6309 11.6309 k = 0.1924-0.5784-0.0000 ( 3988 PWs) bands (ev): -0.4431 -0.4431 1.7576 1.7576 2.0557 2.0557 2.8150 2.8150 4.7989 4.7989 6.2193 6.2193 6.7455 6.7455 7.0158 7.0158 7.0517 7.0517 7.7752 7.7752 8.1508 8.1508 8.3046 8.3046 8.4834 8.4834 8.5270 8.5270 8.7954 8.7954 8.8228 8.8228 9.2236 9.2236 9.3564 9.3564 9.5946 9.5946 9.6986 9.6986 10.0833 10.0833 10.3132 10.3132 10.3816 10.3816 10.5546 10.5546 10.7051 10.7051 10.7620 10.7620 10.7891 10.7891 11.0689 11.0689 11.6280 11.6280 k = 0.1862-0.5598-0.0000 ( 3986 PWs) bands (ev): -0.5234 -0.5234 1.7756 1.7756 2.1421 2.1421 2.7978 2.7978 4.8261 4.8261 6.2132 6.2132 6.6934 6.6934 6.9916 6.9916 7.0169 7.0169 7.8156 7.8156 8.1348 8.1348 8.2894 8.2894 8.4870 8.4870 8.5281 8.5281 8.7833 8.7833 8.8116 8.8116 9.2194 9.2194 9.3589 9.3589 9.6141 9.6141 9.7577 9.7577 10.0764 10.0764 10.3312 10.3312 10.3658 10.3658 10.5757 10.5757 10.7097 10.7097 10.7758 10.7758 10.8019 10.8019 11.1416 11.1416 11.6254 11.6254 k = 0.1800-0.5411-0.0000 ( 3986 PWs) bands (ev): -0.6017 -0.6017 1.7886 1.7886 2.2266 2.2266 2.7806 2.7806 4.8613 4.8613 6.2119 6.2119 6.6378 6.6378 6.9616 6.9616 6.9895 6.9895 7.8545 7.8545 8.1160 8.1160 8.2737 8.2737 8.4912 8.4912 8.5290 8.5290 8.7720 8.7720 8.8005 8.8005 9.2174 9.2174 9.3611 9.3611 9.6343 9.6343 9.8189 9.8189 10.0696 10.0696 10.3448 10.3448 10.3527 10.3527 10.5941 10.5941 10.7143 10.7143 10.7918 10.7918 10.8166 10.8166 11.2191 11.2191 11.6234 11.6234 k = 0.1738-0.5224-0.0000 ( 3986 PWs) bands (ev): -0.6781 -0.6781 1.7966 1.7966 2.3087 2.3087 2.7636 2.7636 4.9041 4.9041 6.2154 6.2154 6.5802 6.5802 6.9278 6.9278 6.9673 6.9673 7.8915 7.8915 8.0947 8.0947 8.2578 8.2578 8.4953 8.4953 8.5297 8.5297 8.7618 8.7618 8.7894 8.7894 9.2177 9.2177 9.3633 9.3633 9.6549 9.6549 9.8814 9.8814 10.0635 10.0635 10.3321 10.3321 10.3648 10.3648 10.6097 10.6097 10.7187 10.7187 10.8097 10.8097 10.8336 10.8336 11.3006 11.3006 11.6220 11.6220 k = 0.1675-0.5038-0.0000 ( 3992 PWs) bands (ev): -0.7523 -0.7523 1.8000 1.8000 2.3880 2.3880 2.7469 2.7469 4.9542 4.9542 6.2240 6.2240 6.5213 6.5213 6.8930 6.8930 6.9475 6.9475 7.9263 7.9263 8.0714 8.0714 8.2421 8.2421 8.4982 8.4982 8.5303 8.5303 8.7527 8.7527 8.7782 8.7782 9.2202 9.2202 9.3660 9.3660 9.6755 9.6755 9.9432 9.9432 10.0595 10.0595 10.3161 10.3161 10.3793 10.3793 10.6228 10.6228 10.7230 10.7230 10.8285 10.8285 10.8533 10.8533 11.3847 11.3847 11.6212 11.6212 k = 0.1613-0.4851-0.0000 ( 3984 PWs) bands (ev): -0.8243 -0.8243 1.7990 1.7990 2.4639 2.4639 2.7309 2.7309 5.0109 5.0109 6.2377 6.2377 6.4621 6.4621 6.8580 6.8580 6.9293 6.9293 7.9587 7.9587 8.0465 8.0465 8.2268 8.2268 8.4995 8.4995 8.5308 8.5308 8.7448 8.7448 8.7672 8.7672 9.2251 9.2251 9.3692 9.3692 9.6959 9.6959 9.9960 9.9960 10.0656 10.0656 10.3004 10.3004 10.3932 10.3932 10.6341 10.6341 10.7273 10.7273 10.8474 10.8474 10.8759 10.8759 11.4701 11.4701 11.6219 11.6219 k = 0.1551-0.4665-0.0000 ( 3984 PWs) bands (ev): -0.8940 -0.8940 1.7942 1.7942 2.5352 2.5352 2.7166 2.7166 5.0736 5.0736 6.2564 6.2564 6.4034 6.4034 6.8235 6.8235 6.9126 6.9126 7.9883 7.9883 8.0205 8.0205 8.2121 8.2121 8.4987 8.4987 8.5313 8.5313 8.7380 8.7380 8.7566 8.7566 9.2320 9.2320 9.3732 9.3732 9.7159 9.7159 10.0166 10.0166 10.1043 10.1043 10.2852 10.2852 10.4063 10.4063 10.6439 10.6439 10.7314 10.7314 10.8659 10.8659 10.9008 10.9008 11.5523 11.5523 11.6276 11.6276 k = 0.1489-0.4478-0.0000 ( 3982 PWs) bands (ev): -0.9613 -0.9613 1.7859 1.7859 2.5980 2.5980 2.7077 2.7077 5.1415 5.1415 6.2792 6.2792 6.3464 6.3464 6.7896 6.7896 6.8975 6.8975 7.9930 7.9930 8.0155 8.0155 8.1980 8.1980 8.4957 8.4957 8.5318 8.5318 8.7317 8.7317 8.7469 8.7469 9.2410 9.2410 9.3779 9.3779 9.7354 9.7354 10.0153 10.0153 10.1650 10.1650 10.2706 10.2706 10.4189 10.4189 10.6529 10.6529 10.7354 10.7354 10.8842 10.8842 10.9273 10.9273 11.6014 11.6014 11.6672 11.6672 k = 0.1427-0.4292-0.0000 ( 3990 PWs) bands (ev): -1.0263 -1.0263 1.7746 1.7746 2.6371 2.6371 2.7191 2.7191 5.2137 5.2137 6.2805 6.2805 6.3172 6.3172 6.7567 6.7567 6.8843 6.8843 7.9652 7.9652 8.0388 8.0388 8.1846 8.1846 8.4905 8.4905 8.5323 8.5323 8.7248 8.7248 8.7393 8.7393 9.2517 9.2517 9.3833 9.3833 9.7541 9.7541 10.0089 10.0089 10.2296 10.2296 10.2572 10.2572 10.4315 10.4315 10.6615 10.6615 10.7393 10.7393 10.9024 10.9024 10.9548 10.9548 11.6100 11.6100 11.7473 11.7473 k = 0.1365-0.4105-0.0000 ( 3984 PWs) bands (ev): -1.0887 -1.0887 1.7608 1.7608 2.6402 2.6402 2.7631 2.7631 5.2893 5.2893 6.2286 6.2286 6.3476 6.3476 6.7255 6.7255 6.8731 6.8731 7.9368 7.9368 8.0588 8.0588 8.1722 8.1722 8.4833 8.4833 8.5328 8.5328 8.7168 8.7168 8.7344 8.7344 9.2641 9.2641 9.3896 9.3896 9.7722 9.7722 10.0010 10.0010 10.2434 10.2434 10.2949 10.2949 10.4452 10.4452 10.6701 10.6701 10.7433 10.7433 10.9209 10.9209 10.9827 10.9827 11.6125 11.6125 11.8327 11.8327 k = 0.1303-0.3918-0.0000 ( 3976 PWs) bands (ev): -1.1487 -1.1487 1.7449 1.7449 2.6297 2.6297 2.8171 2.8171 5.3673 5.3673 6.1749 6.1749 6.3862 6.3862 6.6965 6.6965 6.8641 6.8641 7.9081 7.9081 8.0747 8.0747 8.1611 8.1611 8.4744 8.4744 8.5334 8.5334 8.7082 8.7082 8.7314 8.7314 9.2780 9.2780 9.3964 9.3964 9.7894 9.7894 9.9924 9.9924 10.2313 10.2313 10.3541 10.3541 10.4630 10.4630 10.6793 10.6793 10.7476 10.7476 10.9396 10.9396 11.0107 11.0107 11.6142 11.6142 11.9172 11.9172 k = 0.1241-0.3732-0.0000 ( 3976 PWs) bands (ev): -1.2061 -1.2061 1.7273 1.7273 2.6160 2.6160 2.8706 2.8706 5.4463 5.4463 6.1227 6.1227 6.4294 6.4294 6.6705 6.6705 6.8577 6.8577 7.8793 7.8793 8.0856 8.0856 8.1518 8.1518 8.4642 8.4642 8.5340 8.5340 8.6999 8.6999 8.7293 8.7293 9.2931 9.2931 9.4039 9.4039 9.8056 9.8056 9.9835 9.9835 10.2199 10.2199 10.4002 10.4002 10.4918 10.4918 10.6896 10.6896 10.7521 10.7521 10.9587 10.9587 11.0384 11.0384 11.6157 11.6157 11.9990 11.9990 k = 0.1179-0.3545-0.0000 ( 3980 PWs) bands (ev): -1.2609 -1.2609 1.7085 1.7085 2.6016 2.6016 2.9213 2.9213 5.5250 5.5250 6.0726 6.0726 6.4763 6.4763 6.6484 6.6484 6.8540 6.8540 7.8508 7.8508 8.0906 8.0906 8.1453 8.1453 8.4528 8.4528 8.5346 8.5346 8.6923 8.6923 8.7277 8.7277 9.3092 9.3092 9.4118 9.4118 9.8208 9.8208 9.9745 9.9745 10.2092 10.2092 10.4271 10.4271 10.5359 10.5359 10.7024 10.7024 10.7575 10.7575 10.9783 10.9783 11.0656 11.0656 11.6174 11.6174 12.0768 12.0768 k = 0.1117-0.3359-0.0000 ( 3972 PWs) bands (ev): -1.3131 -1.3131 1.6889 1.6889 2.5871 2.5871 2.9685 2.9685 5.6015 5.6015 6.0251 6.0251 6.5256 6.5256 6.6316 6.6316 6.8538 6.8538 7.8227 7.8227 8.0891 8.0891 8.1421 8.1421 8.4407 8.4407 8.5351 8.5351 8.6858 8.6858 8.7263 8.7263 9.3264 9.3264 9.4202 9.4202 9.8347 9.8347 9.9658 9.9658 10.1993 10.1993 10.4416 10.4416 10.5846 10.5846 10.7192 10.7192 10.7657 10.7657 10.9987 10.9987 11.0921 11.0921 11.6193 11.6193 12.1496 12.1496 k = 0.1055-0.3172-0.0000 ( 3974 PWs) bands (ev): -1.3626 -1.3626 1.6688 1.6688 2.5728 2.5728 3.0119 3.0119 5.6734 5.6734 5.9808 5.9808 6.5748 6.5748 6.6225 6.6225 6.8576 6.8576 7.7956 7.7956 8.0825 8.0825 8.1408 8.1408 8.4280 8.4280 8.5354 8.5354 8.6805 8.6805 8.7249 8.7249 9.3443 9.3443 9.4289 9.4289 9.8471 9.8471 9.9575 9.9575 10.1899 10.1899 10.4507 10.4507 10.6255 10.6255 10.7384 10.7384 10.7835 10.7835 11.0199 11.0199 11.1178 11.1178 11.6215 11.6215 12.2162 12.2162 k = 0.0993-0.2985-0.0000 ( 3974 PWs) bands (ev): -1.4094 -1.4094 1.6484 1.6484 2.5589 2.5589 3.0516 3.0516 5.7373 5.7373 5.9414 5.9414 6.6090 6.6090 6.6355 6.6355 6.8669 6.8669 7.7699 7.7699 8.0725 8.0725 8.1396 8.1396 8.4149 8.4149 8.5353 8.5353 8.6765 8.6765 8.7234 8.7234 9.3628 9.3628 9.4379 9.4379 9.8576 9.8576 9.9500 9.9500 10.1810 10.1810 10.4572 10.4572 10.6531 10.6531 10.7513 10.7513 10.8220 10.8220 11.0422 11.0422 11.1427 11.1427 11.6239 11.6239 12.2756 12.2756 k = 0.0931-0.2799-0.0000 ( 3974 PWs) bands (ev): -1.4535 -1.4535 1.6282 1.6282 2.5455 2.5455 3.0877 3.0877 5.7855 5.7855 5.9123 5.9123 6.6206 6.6206 6.6774 6.6774 6.8832 6.8832 7.7462 7.7462 8.0603 8.0603 8.1373 8.1373 8.4015 8.4015 8.5349 8.5349 8.6739 8.6739 8.7219 8.7219 9.3818 9.3818 9.4472 9.4472 9.8659 9.8659 9.9437 9.9437 10.1727 10.1727 10.4622 10.4622 10.6707 10.6707 10.7582 10.7582 10.8765 10.8765 11.0656 11.0656 11.1667 11.1667 11.6266 11.6266 12.3268 12.3268 k = 0.0869-0.2612-0.0000 ( 3974 PWs) bands (ev): -1.4948 -1.4948 1.6083 1.6083 2.5327 2.5327 3.1202 3.1202 5.8015 5.8015 5.9083 5.9083 6.6395 6.6395 6.7168 6.7168 6.9081 6.9081 7.7254 7.7254 8.0463 8.0463 8.1337 8.1337 8.3880 8.3880 8.5342 8.5342 8.6725 8.6725 8.7201 8.7201 9.4010 9.4010 9.4568 9.4568 9.8714 9.8714 9.9391 9.9391 10.1649 10.1649 10.4661 10.4661 10.6827 10.6827 10.7630 10.7630 10.9377 10.9377 11.0905 11.0905 11.1900 11.1900 11.6295 11.6295 12.3694 12.3694 k = 0.0807-0.2426-0.0000 ( 3972 PWs) bands (ev): -1.5334 -1.5334 1.5889 1.5889 2.5206 2.5206 3.1493 3.1493 5.7848 5.7848 5.9287 5.9287 6.6699 6.6699 6.7490 6.7490 6.9414 6.9414 7.7084 7.7084 8.0306 8.0306 8.1289 8.1289 8.3742 8.3742 8.5330 8.5330 8.6722 8.6722 8.7184 8.7184 9.4201 9.4201 9.4667 9.4667 9.8735 9.8735 9.9366 9.9366 10.1576 10.1576 10.4692 10.4692 10.6917 10.6917 10.7669 10.7669 11.0008 11.0008 11.1169 11.1169 11.2129 11.2129 11.6327 11.6327 12.4030 12.4030 k = 0.0745-0.2239-0.0000 ( 3970 PWs) bands (ev): -1.5692 -1.5692 1.5703 1.5703 2.5091 2.5091 3.1752 3.1752 5.7573 5.7573 5.9514 5.9514 6.7113 6.7113 6.7750 6.7750 6.9800 6.9800 7.6968 7.6968 8.0129 8.0129 8.1231 8.1231 8.3603 8.3603 8.5316 8.5316 8.6728 8.6728 8.7166 8.7166 9.4389 9.4389 9.4770 9.4770 9.8723 9.8723 9.9362 9.9362 10.1509 10.1509 10.4715 10.4715 10.6991 10.6991 10.7704 10.7704 11.0632 11.0632 11.1450 11.1450 11.2362 11.2362 11.6359 11.6359 12.4276 12.4276 k = 0.0683-0.2052-0.0000 ( 3974 PWs) bands (ev): -1.6022 -1.6022 1.5526 1.5526 2.4984 2.4984 3.1981 3.1981 5.7285 5.7285 5.9682 5.9682 6.7606 6.7606 6.7991 6.7991 7.0192 7.0192 7.6920 7.6920 7.9930 7.9930 8.1167 8.1167 8.3462 8.3462 8.5299 8.5299 8.6740 8.6740 8.7148 8.7148 9.4569 9.4569 9.4879 9.4879 9.8684 9.8684 9.9371 9.9371 10.1448 10.1448 10.4734 10.4734 10.7052 10.7052 10.7734 10.7734 11.1218 11.1218 11.1749 11.1749 11.2616 11.2616 11.6393 11.6393 12.4438 12.4438 k = 0.0621-0.1866-0.0000 ( 3966 PWs) bands (ev): -1.6324 -1.6324 1.5360 1.5360 2.4885 2.4885 3.2182 3.2182 5.7007 5.7007 5.9784 5.9784 6.8017 6.8017 6.8375 6.8375 7.0543 7.0543 7.6956 7.6956 7.9706 7.9706 8.1101 8.1101 8.3318 8.3318 8.5281 8.5281 8.6757 8.6757 8.7132 8.7132 9.4736 9.4736 9.4997 9.4997 9.8627 9.8627 9.9385 9.9385 10.1393 10.1393 10.4748 10.4748 10.7106 10.7106 10.7763 10.7763 11.1729 11.1729 11.2068 11.2068 11.2921 11.2921 11.6427 11.6427 12.4524 12.4524 k = 0.0558-0.1679-0.0000 ( 3960 PWs) bands (ev): -1.6597 -1.6597 1.5206 1.5206 2.4794 2.4794 3.2357 3.2357 5.6750 5.6750 5.9832 5.9832 6.8244 6.8244 6.8994 6.8994 7.0819 7.0819 7.7087 7.7087 7.9454 7.9454 8.1036 8.1036 8.3169 8.3169 8.5263 8.5263 8.6776 8.6776 8.7117 8.7117 9.4886 9.4886 9.5126 9.5126 9.8558 9.8558 9.9396 9.9396 10.1346 10.1346 10.4759 10.4759 10.7153 10.7153 10.7789 10.7789 11.2121 11.2121 11.2410 11.2410 11.3313 11.3313 11.6461 11.6461 12.4543 12.4543 k = 0.0496-0.1493-0.0000 ( 3958 PWs) bands (ev): -1.6842 -1.6842 1.5066 1.5066 2.4712 2.4712 3.2508 3.2508 5.6516 5.6516 5.9842 5.9842 6.8431 6.8431 6.9687 6.9687 7.1002 7.1002 7.7314 7.7314 7.9174 7.9174 8.0975 8.0975 8.3016 8.3016 8.5245 8.5245 8.6795 8.6795 8.7105 8.7105 9.5016 9.5016 9.5264 9.5264 9.8482 9.8482 9.9402 9.9402 10.1307 10.1307 10.4766 10.4766 10.7193 10.7193 10.7812 10.7812 11.2392 11.2392 11.2772 11.2772 11.3787 11.3787 11.6494 11.6494 12.4508 12.4508 k = 0.0434-0.1306-0.0000 ( 3952 PWs) bands (ev): -1.7059 -1.7059 1.4940 1.4940 2.4639 2.4639 3.2636 3.2636 5.6307 5.6307 5.9826 5.9826 6.8615 6.8615 7.0404 7.0404 7.1089 7.1089 7.7623 7.7623 7.8865 7.8865 8.0919 8.0919 8.2855 8.2855 8.5230 8.5230 8.6813 8.6813 8.7095 8.7095 9.5133 9.5133 9.5403 9.5403 9.8401 9.8401 9.9400 9.9400 10.1276 10.1276 10.4771 10.4771 10.7227 10.7227 10.7832 10.7832 11.2582 11.2582 11.3152 11.3152 11.4300 11.4300 11.6526 11.6526 12.4428 12.4428 k = 0.0372-0.1120-0.0000 ( 3950 PWs) bands (ev): -1.7247 -1.7247 1.4829 1.4829 2.4575 2.4575 3.2744 3.2744 5.6125 5.6125 5.9797 5.9797 6.8802 6.8802 7.1074 7.1074 7.1143 7.1143 7.7982 7.7982 7.8540 7.8540 8.0870 8.0870 8.2686 8.2686 8.5214 8.5214 8.6828 8.6828 8.7088 8.7088 9.5239 9.5239 9.5534 9.5534 9.8319 9.8319 9.9393 9.9393 10.1251 10.1251 10.4774 10.4774 10.7257 10.7257 10.7851 10.7851 11.2721 11.2721 11.3545 11.3545 11.4812 11.4812 11.6556 11.6556 12.4317 12.4317 k = 0.0310-0.0933-0.0000 ( 3956 PWs) bands (ev): -1.7406 -1.7406 1.4734 1.4734 2.4521 2.4521 3.2833 3.2833 5.5970 5.5970 5.9760 5.9760 6.8993 6.8993 7.1023 7.1023 7.1835 7.1835 7.8095 7.8095 7.8469 7.8469 8.0827 8.0827 8.2508 8.2508 8.5200 8.5200 8.6841 8.6841 8.7082 8.7082 9.5336 9.5336 9.5653 9.5653 9.8237 9.8237 9.9381 9.9381 10.1232 10.1232 10.4776 10.4776 10.7280 10.7280 10.7866 10.7866 11.2827 11.2827 11.3944 11.3944 11.5294 11.5294 11.6582 11.6582 12.4186 12.4186 k = 0.0248-0.0746-0.0000 ( 3944 PWs) bands (ev): -1.7536 -1.7536 1.4655 1.4655 2.4476 2.4476 3.2904 3.2904 5.5843 5.5843 5.9724 5.9724 6.9188 6.9188 7.0910 7.0910 7.2516 7.2516 7.7736 7.7736 7.8851 7.8851 8.0792 8.0792 8.2323 8.2323 8.5189 8.5189 8.6851 8.6851 8.7080 8.7080 9.5425 9.5425 9.5754 9.5754 9.8160 9.8160 9.9368 9.9368 10.1220 10.1220 10.4777 10.4777 10.7300 10.7300 10.7879 10.7879 11.2907 11.2907 11.4336 11.4336 11.5726 11.5726 11.6607 11.6607 12.4046 12.4046 k = 0.0186-0.0560-0.0000 ( 3938 PWs) bands (ev): -1.7637 -1.7637 1.4594 1.4594 2.4441 2.4441 3.2958 3.2958 5.5744 5.5744 5.9692 5.9692 6.9384 6.9384 7.0763 7.0763 7.3152 7.3152 7.7338 7.7338 7.9237 7.9237 8.0764 8.0764 8.2136 8.2136 8.5180 8.5180 8.6858 8.6858 8.7080 8.7080 9.5502 9.5502 9.5834 9.5834 9.8093 9.8093 9.9354 9.9354 10.1211 10.1211 10.4777 10.4777 10.7315 10.7315 10.7889 10.7889 11.2967 11.2967 11.4701 11.4701 11.6087 11.6087 11.6629 11.6629 12.3644 12.3644 k = 0.0124-0.0373-0.0000 ( 3939 PWs) bands (ev): -1.7710 -1.7710 1.4549 1.4549 2.4416 2.4416 3.2996 3.2996 5.5673 5.5673 5.9667 5.9667 6.9573 6.9573 7.0603 7.0603 7.3713 7.3713 7.6948 7.6948 7.9570 7.9570 8.0743 8.0743 8.1961 8.1961 8.5174 8.5174 8.6863 8.6863 8.7080 8.7080 9.5562 9.5562 9.5891 9.5891 9.8039 9.8039 9.9343 9.9343 10.1206 10.1206 10.4777 10.4777 10.7325 10.7325 10.7896 10.7896 11.3008 11.3008 11.5007 11.5007 11.6356 11.6356 11.6652 11.6652 12.3076 12.3076 k = 0.0062-0.0187-0.0000 ( 3937 PWs) bands (ev): -1.7753 -1.7753 1.4523 1.4523 2.4401 2.4401 3.3018 3.3018 5.5630 5.5630 5.9652 5.9652 6.9733 6.9733 7.0458 7.0458 7.4138 7.4138 7.6626 7.6626 7.9807 7.9807 8.0729 8.0729 8.1826 8.1826 8.5170 8.5170 8.6866 8.6866 8.7080 8.7080 9.5600 9.5600 9.5925 9.5925 9.8005 9.8005 9.9335 9.9335 10.1203 10.1203 10.4776 10.4776 10.7332 10.7332 10.7900 10.7900 11.3032 11.3032 11.5215 11.5215 11.6509 11.6509 11.6682 11.6682 12.2706 12.2706 k = 0.0000 0.0000 0.0000 ( 3933 PWs) bands (ev): -1.7767 -1.7767 1.4514 1.4514 2.4396 2.4396 3.3026 3.3026 5.5616 5.5616 5.9646 5.9646 6.9805 6.9805 7.0390 7.0390 7.4308 7.4308 7.6491 7.6491 7.9896 7.9896 8.0724 8.0724 8.1773 8.1773 8.5169 8.5169 8.6866 8.6866 8.7081 8.7081 9.5614 9.5614 9.5936 9.5936 9.7993 9.7993 9.9333 9.9333 10.1203 10.1203 10.4776 10.4776 10.7334 10.7334 10.7901 10.7901 11.3040 11.3040 11.5289 11.5289 11.6552 11.6552 11.6702 11.6702 12.2577 12.2577 k = 0.0000 0.0000 0.0000 ( 3933 PWs) bands (ev): -1.7767 -1.7767 1.4514 1.4514 2.4396 2.4396 3.3026 3.3026 5.5616 5.5616 5.9646 5.9646 6.9805 6.9805 7.0390 7.0390 7.4308 7.4308 7.6491 7.6491 7.9896 7.9896 8.0724 8.0724 8.1773 8.1773 8.5169 8.5169 8.6866 8.6866 8.7081 8.7081 9.5614 9.5614 9.5936 9.5936 9.7993 9.7993 9.9333 9.9333 10.1203 10.1203 10.4776 10.4776 10.7334 10.7334 10.7901 10.7901 11.3040 11.3040 11.5289 11.5289 11.6552 11.6552 11.6702 11.6702 12.2577 12.2577 k = 0.0116-0.0155-0.0015 ( 3937 PWs) bands (ev): -1.7753 -1.7753 1.4512 1.4512 2.4407 2.4407 3.3019 3.3019 5.5631 5.5631 5.9652 5.9652 6.9740 6.9740 7.0450 7.0450 7.4157 7.4157 7.6612 7.6612 7.9819 7.9819 8.0730 8.0730 8.1820 8.1820 8.5170 8.5170 8.6866 8.6866 8.7081 8.7081 9.5596 9.5596 9.5931 9.5931 9.8003 9.8003 9.9334 9.9334 10.1204 10.1204 10.4777 10.4777 10.7332 10.7332 10.7900 10.7900 11.3033 11.3033 11.5196 11.5196 11.6518 11.6518 11.6708 11.6708 12.2686 12.2686 k = 0.0233-0.0311-0.0029 ( 3937 PWs) bands (ev): -1.7711 -1.7711 1.4505 1.4505 2.4443 2.4443 3.2999 3.2999 5.5676 5.5676 5.9668 5.9668 6.9594 6.9594 7.0582 7.0582 7.3774 7.3774 7.6904 7.6904 7.9613 7.9613 8.0746 8.0746 8.1943 8.1943 8.5174 8.5174 8.6865 8.6865 8.7082 8.7082 9.5544 9.5544 9.5912 9.5912 9.8032 9.8032 9.9338 9.9338 10.1208 10.1208 10.4779 10.4779 10.7328 10.7328 10.7897 10.7897 11.3010 11.3010 11.4943 11.4943 11.6426 11.6426 11.6709 11.6709 12.2992 12.2992 k = 0.0349-0.0466-0.0044 ( 3943 PWs) bands (ev): -1.7640 -1.7640 1.4494 1.4494 2.4501 2.4501 3.2965 3.2965 5.5751 5.5751 5.9694 5.9694 6.9421 6.9421 7.0725 7.0725 7.3263 7.3263 7.7266 7.7266 7.9324 7.9324 8.0769 8.0769 8.2106 8.2106 8.5180 8.5180 8.6862 8.6862 8.7083 8.7083 9.5464 9.5464 9.5877 9.5877 9.8077 9.8077 9.9345 9.9345 10.1214 10.1214 10.4783 10.4783 10.7321 10.7321 10.7891 10.7891 11.2970 11.2970 11.4582 11.4582 11.6272 11.6272 11.6694 11.6694 12.3416 12.3416 k = 0.0465-0.0622-0.0059 ( 3940 PWs) bands (ev): -1.7541 -1.7541 1.4480 1.4480 2.4581 2.4581 3.2916 3.2916 5.5856 5.5856 5.9729 5.9729 6.9242 6.9242 7.0853 7.0853 7.2682 7.2682 7.7637 7.7637 7.8994 7.8994 8.0800 8.0800 8.2282 8.2282 8.5190 8.5190 8.6859 8.6859 8.7088 8.7088 9.5363 9.5363 9.5826 9.5826 9.8135 9.8135 9.9354 9.9354 10.1224 10.1224 10.4788 10.4788 10.7311 10.7311 10.7883 10.7883 11.2911 11.2911 11.4163 11.4163 11.6048 11.6048 11.6669 11.6669 12.3765 12.3765 k = 0.0581-0.0777-0.0074 ( 3948 PWs) bands (ev): -1.7413 -1.7413 1.4463 1.4463 2.4682 2.4682 3.2852 3.2852 5.5990 5.5990 5.9772 5.9772 6.9065 6.9065 7.0936 7.0936 7.2071 7.2071 7.7963 7.7963 7.8682 7.8682 8.0840 8.0840 8.2457 8.2457 8.5201 8.5201 8.6852 8.6852 8.7094 8.7094 9.5244 9.5244 9.5757 9.5757 9.8201 9.8201 9.9364 9.9364 10.1235 10.1235 10.4793 10.4793 10.7298 10.7298 10.7872 10.7872 11.2824 11.2824 11.3724 11.3724 11.5759 11.5759 11.6641 11.6641 12.3969 12.3969 k = 0.0698-0.0933-0.0088 ( 3952 PWs) bands (ev): -1.7258 -1.7258 1.4444 1.4444 2.4803 2.4803 3.2772 3.2772 5.6154 5.6154 5.9820 5.9820 6.8893 6.8893 7.0904 7.0904 7.1503 7.1503 7.8039 7.8039 7.8607 7.8607 8.0889 8.0889 8.2625 8.2625 8.5215 8.5215 8.6844 8.6844 8.7105 8.7105 9.5109 9.5109 9.5673 9.5673 9.8272 9.8272 9.9373 9.9373 10.1250 10.1250 10.4800 10.4800 10.7280 10.7280 10.7859 10.7859 11.2684 11.2684 11.3310 11.3310 11.5417 11.5417 11.6611 11.6611 12.4123 12.4123 k = 0.0814-0.1088-0.0103 ( 3956 PWs) bands (ev): -1.7074 -1.7074 1.4424 1.4424 2.4941 2.4941 3.2674 3.2674 5.6345 5.6345 5.9870 5.9870 6.8726 6.8726 7.0518 7.0518 7.1218 7.1218 7.7788 7.7788 7.8861 7.8861 8.0947 8.0947 8.2783 8.2783 8.5232 8.5232 8.6833 8.6833 8.7120 8.7120 9.4961 9.4961 9.5577 9.5577 9.8344 9.8344 9.9381 9.9381 10.1267 10.1267 10.4807 10.4807 10.7259 10.7259 10.7844 10.7844 11.2428 11.2428 11.2993 11.2993 11.5036 11.5036 11.6580 11.6580 12.4253 12.4253 k = 0.0930-0.1244-0.0118 ( 3957 PWs) bands (ev): -1.6862 -1.6862 1.4404 1.4404 2.5095 2.5095 3.2557 3.2557 5.6564 5.6564 5.9918 5.9918 6.8554 6.8554 6.9897 6.9897 7.1103 7.1103 7.7505 7.7505 7.9168 7.9168 8.1014 8.1014 8.2930 8.2930 8.5250 8.5250 8.6821 8.6821 8.7140 8.7140 9.4801 9.4801 9.5473 9.5473 9.8415 9.8415 9.9387 9.9387 10.1288 10.1288 10.4814 10.4814 10.7233 10.7233 10.7826 10.7826 11.2043 11.2043 11.2793 11.2793 11.4630 11.4630 11.6548 11.6548 12.4359 12.4359 k = 0.1047-0.1399-0.0133 ( 3958 PWs) bands (ev): -1.6623 -1.6623 1.4386 1.4386 2.5262 2.5262 3.2420 3.2420 5.6810 5.6810 5.9958 5.9958 6.8349 6.8349 6.9275 6.9275 7.0960 7.0960 7.7263 7.7263 7.9472 7.9472 8.1090 8.1090 8.3067 8.3067 8.5270 8.5270 8.6808 8.6808 8.7165 8.7165 9.4629 9.4629 9.5362 9.5362 9.8483 9.8483 9.9388 9.9388 10.1312 10.1312 10.4821 10.4821 10.7201 10.7201 10.7806 10.7806 11.1597 11.1597 11.2641 11.2641 11.4210 11.4210 11.6517 11.6517 12.4435 12.4435 k = 0.1163-0.1555-0.0147 ( 3960 PWs) bands (ev): -1.6355 -1.6355 1.4369 1.4369 2.5441 2.5441 3.2261 3.2261 5.7081 5.7081 5.9981 5.9981 6.8024 6.8024 6.8781 6.8781 7.0757 7.0757 7.7078 7.7078 7.9766 7.9766 8.1171 8.1171 8.3196 8.3196 8.5290 8.5290 8.6794 8.6794 8.7194 8.7194 9.4446 9.4446 9.5247 9.5247 9.8547 9.8547 9.9384 9.9384 10.1339 10.1339 10.4827 10.4827 10.7163 10.7163 10.7784 10.7784 11.1132 11.1132 11.2496 11.2496 11.3787 11.3787 11.6487 11.6487 12.4473 12.4473 k = 0.1279-0.1710-0.0162 ( 3960 PWs) bands (ev): -1.6060 -1.6060 1.4355 1.4355 2.5629 2.5629 3.2077 3.2077 5.7376 5.7376 5.9977 5.9977 6.7517 6.7517 6.8494 6.8494 7.0500 7.0500 7.6953 7.6953 8.0048 8.0048 8.1256 8.1256 8.3319 8.3319 8.5311 8.5311 8.6783 8.6783 8.7226 8.7226 9.4254 9.4254 9.5129 9.5129 9.8604 9.8604 9.9376 9.9376 10.1370 10.1370 10.4832 10.4832 10.7118 10.7118 10.7759 10.7759 11.0658 11.0658 11.2347 11.2347 11.3369 11.3369 11.6458 11.6458 12.4463 12.4463 k = 0.1395-0.1866-0.0177 ( 3963 PWs) bands (ev): -1.5737 -1.5737 1.4346 1.4346 2.5824 2.5824 3.1866 3.1866 5.7693 5.7693 5.9932 5.9932 6.6944 6.6944 6.8306 6.8306 7.0213 7.0213 7.6883 7.6883 8.0323 8.0323 8.1341 8.1341 8.3435 8.3435 8.5330 8.5330 8.6774 8.6774 8.7263 8.7263 9.4054 9.4054 9.5007 9.5007 9.8652 9.8652 9.9365 9.9365 10.1405 10.1405 10.4836 10.4836 10.7063 10.7063 10.7730 10.7730 11.0181 11.0181 11.2186 11.2186 11.2964 11.2964 11.6433 11.6433 12.4395 12.4395 k = 0.1512-0.2021-0.0191 ( 3967 PWs) bands (ev): -1.5386 -1.5386 1.4341 1.4341 2.6023 2.6023 3.1627 3.1627 5.8029 5.8029 5.9830 5.9830 6.6403 6.6403 6.8124 6.8124 6.9931 6.9931 7.6857 7.6857 8.0595 8.0595 8.1420 8.1420 8.3546 8.3546 8.5349 8.5349 8.6770 8.6770 8.7302 8.7302 9.3848 9.3848 9.4883 9.4883 9.8686 9.8686 9.9354 9.9354 10.1445 10.1445 10.4837 10.4837 10.6994 10.6994 10.7697 10.7697 10.9704 10.9704 11.2010 11.2010 11.2580 11.2580 11.6411 11.6411 12.4258 12.4258 k = 0.1628-0.2177-0.0206 ( 3966 PWs) bands (ev): -1.5009 -1.5009 1.4341 1.4341 2.6225 2.6225 3.1357 3.1357 5.8379 5.8379 5.9657 5.9657 6.5940 6.5940 6.7898 6.7898 6.9702 6.9702 7.6862 7.6862 8.0865 8.0865 8.1490 8.1490 8.3655 8.3655 8.5365 8.5365 8.6772 8.6772 8.7344 8.7344 9.3637 9.3637 9.4756 9.4756 9.8702 9.8702 9.9349 9.9349 10.1489 10.1489 10.4835 10.4835 10.6906 10.6906 10.7660 10.7660 10.9235 10.9235 11.1813 11.1813 11.2226 11.2226 11.6394 11.6394 12.4043 12.4043 k = 0.1744-0.2332-0.0221 ( 3966 PWs) bands (ev): -1.4604 -1.4604 1.4347 1.4347 2.6426 2.6426 3.1053 3.1053 5.8717 5.8717 5.9420 5.9420 6.5583 6.5583 6.7601 6.7601 6.9559 6.9559 7.6887 7.6887 8.1136 8.1136 8.1548 8.1548 8.3760 8.3760 8.5381 8.5381 8.6781 8.6781 8.7388 8.7388 9.3423 9.3423 9.4626 9.4626 9.8692 9.8692 9.9354 9.9354 10.1538 10.1538 10.4829 10.4829 10.6787 10.6787 10.7616 10.7616 10.8789 10.8789 11.1585 11.1585 11.1912 11.1912 11.6382 11.6382 12.3743 12.3743 k = 0.1860-0.2488-0.0236 ( 3968 PWs) bands (ev): -1.4172 -1.4172 1.4360 1.4360 2.6624 2.6624 3.0714 3.0714 5.8825 5.8825 5.9333 5.9333 6.5345 6.5345 6.7237 6.7237 6.9513 6.9513 7.6924 7.6924 8.1397 8.1397 8.1599 8.1599 8.3863 8.3863 8.5395 8.5395 8.6796 8.6796 8.7434 8.7434 9.3208 9.3208 9.4493 9.4493 9.8653 9.8653 9.9374 9.9374 10.1594 10.1594 10.4817 10.4817 10.6620 10.6620 10.7559 10.7559 10.8389 10.8389 11.1322 11.1322 11.1645 11.1645 11.6377 11.6377 12.3356 12.3356 k = 0.1977-0.2643-0.0250 ( 3970 PWs) bands (ev): -1.3714 -1.3714 1.4379 1.4379 2.6816 2.6816 3.0337 3.0337 5.8457 5.8457 5.9647 5.9647 6.5223 6.5223 6.6831 6.6831 6.9551 6.9551 7.6966 7.6966 8.1543 8.1543 8.1747 8.1747 8.3963 8.3963 8.5410 8.5410 8.6818 8.6818 8.7481 8.7481 9.2994 9.2994 9.4357 9.4357 9.8586 9.8586 9.9408 9.9408 10.1656 10.1656 10.4797 10.4797 10.6381 10.6381 10.7482 10.7482 10.8073 10.8073 11.1038 11.1038 11.1408 11.1408 11.6378 11.6378 12.2883 12.2883 k = 0.2093-0.2799-0.0265 ( 3966 PWs) bands (ev): -1.3229 -1.3229 1.4404 1.4404 2.7001 2.7001 2.9923 2.9923 5.7944 5.7944 6.0044 6.0044 6.5200 6.5200 6.6416 6.6416 6.9658 6.9658 7.7010 7.7010 8.1546 8.1546 8.2013 8.2013 8.4058 8.4058 8.5427 8.5427 8.6846 8.6846 8.7531 8.7531 9.2783 9.2783 9.4218 9.4218 9.8494 9.8494 9.9451 9.9451 10.1725 10.1725 10.4765 10.4765 10.6057 10.6057 10.7384 10.7384 10.7861 10.7861 11.0752 11.0752 11.1184 11.1184 11.6387 11.6387 12.2329 12.2329 k = 0.2209-0.2954-0.0280 ( 3970 PWs) bands (ev): -1.2718 -1.2718 1.4436 1.4436 2.7173 2.7173 2.9470 2.9470 5.7371 5.7371 6.0460 6.0460 6.5231 6.5231 6.6041 6.6041 6.9821 6.9821 7.7051 7.7051 8.1505 8.1505 8.2294 8.2294 8.4148 8.4148 8.5450 8.5450 8.6878 8.6878 8.7582 8.7582 9.2575 9.2575 9.4076 9.4076 9.8380 9.8380 9.9499 9.9499 10.1802 10.1802 10.4709 10.4709 10.5668 10.5668 10.7276 10.7276 10.7734 10.7734 11.0471 11.0471 11.0962 11.0962 11.6404 11.6404 12.1702 12.1702 k = 0.2326-0.3110-0.0295 ( 3975 PWs) bands (ev): -1.2182 -1.2182 1.4474 1.4474 2.7328 2.7328 2.8982 2.8982 5.6765 5.6765 6.0883 6.0883 6.5176 6.5176 6.5846 6.5846 7.0031 7.0031 7.7088 7.7088 8.1433 8.1433 8.2574 8.2574 8.4230 8.4230 8.5482 8.5482 8.6914 8.6914 8.7636 8.7636 9.2372 9.2372 9.3932 9.3932 9.8249 9.8249 9.9549 9.9549 10.1888 10.1888 10.4590 10.4590 10.5278 10.5278 10.7175 10.7175 10.7652 10.7652 11.0198 11.0198 11.0741 11.0741 11.6428 11.6428 12.1011 12.1011 k = 0.2442-0.3265-0.0309 ( 3975 PWs) bands (ev): -1.1619 -1.1619 1.4517 1.4517 2.7450 2.7450 2.8472 2.8472 5.6147 5.6147 6.1309 6.1309 6.4911 6.4911 6.5953 6.5953 7.0284 7.0284 7.7121 7.7121 8.1329 8.1329 8.2845 8.2845 8.4300 8.4300 8.5527 8.5527 8.6950 8.6950 8.7692 8.7692 9.2176 9.2176 9.3788 9.3788 9.8102 9.8102 9.9598 9.9598 10.1983 10.1983 10.4318 10.4318 10.5001 10.5001 10.7085 10.7085 10.7592 10.7592 10.9934 10.9934 11.0518 11.0518 11.6459 11.6459 12.0266 12.0266 k = 0.2558-0.3420-0.0324 ( 3975 PWs) bands (ev): -1.1032 -1.1032 1.4564 1.4564 2.7450 2.7450 2.8029 2.8029 5.5531 5.5531 6.1733 6.1733 6.4573 6.4573 6.6224 6.6224 7.0574 7.0574 7.7150 7.7150 8.1196 8.1196 8.3100 8.3100 8.4353 8.4353 8.5590 8.5590 8.6985 8.6985 8.7752 8.7752 9.1989 9.1989 9.3645 9.3645 9.7943 9.7943 9.9642 9.9642 10.2087 10.2087 10.3883 10.3883 10.4863 10.4863 10.7003 10.7003 10.7540 10.7540 10.9678 10.9678 11.0295 11.0295 11.6497 11.6497 11.9477 11.9477 k = 0.2674-0.3576-0.0339 ( 3980 PWs) bands (ev): -1.0420 -1.0420 1.4614 1.4614 2.7067 2.7067 2.7913 2.7913 5.4926 5.4926 6.2153 6.2153 6.4242 6.4242 6.6577 6.6577 7.0898 7.0898 7.7175 7.7175 8.1035 8.1035 8.3333 8.3333 8.4385 8.4385 8.5676 8.5676 8.7019 8.7019 8.7816 8.7816 9.1810 9.1810 9.3506 9.3506 9.7774 9.7774 9.9680 9.9680 10.2199 10.2199 10.3381 10.3381 10.4780 10.4780 10.6926 10.6926 10.7493 10.7493 10.9430 10.9430 11.0071 11.0071 11.6538 11.6538 11.8655 11.8655 k = 0.2791-0.3731-0.0353 ( 3974 PWs) bands (ev): -0.9783 -0.9783 1.4665 1.4665 2.6458 2.6458 2.7969 2.7969 5.4340 5.4340 6.2567 6.2567 6.3940 6.3940 6.6989 6.6989 7.1254 7.1254 7.7195 7.7195 8.0849 8.0849 8.3538 8.3538 8.4391 8.4391 8.5789 8.5789 8.7048 8.7048 8.7884 8.7884 9.1641 9.1641 9.3373 9.3373 9.7597 9.7597 9.9710 9.9710 10.2314 10.2314 10.2866 10.2866 10.4712 10.4712 10.6849 10.6849 10.7447 10.7447 10.9192 10.9192 10.9847 10.9847 11.6582 11.6582 11.7809 11.7809 k = 0.2907-0.3887-0.0368 ( 3976 PWs) bands (ev): -0.9123 -0.9123 1.4714 1.4714 2.5782 2.5782 2.8043 2.8043 5.3779 5.3779 6.2967 6.2967 6.3683 6.3683 6.7449 6.7449 7.1637 7.1637 7.7213 7.7213 8.0640 8.0640 8.3709 8.3709 8.4365 8.4365 8.5927 8.5927 8.7074 8.7074 8.7955 8.7955 9.1482 9.1482 9.3250 9.3250 9.7415 9.7415 9.9728 9.9728 10.2298 10.2298 10.2489 10.2489 10.4645 10.4645 10.6770 10.6770 10.7401 10.7401 10.8964 10.8964 10.9624 10.9624 11.6613 11.6613 11.6957 11.6957 k = 0.3023-0.4042-0.0383 ( 3978 PWs) bands (ev): -0.8439 -0.8439 1.4758 1.4758 2.5068 2.5068 2.8108 2.8108 5.3245 5.3245 6.3265 6.3265 6.3561 6.3561 6.7950 6.7950 7.2043 7.2043 7.7227 7.7227 8.0412 8.0412 8.3842 8.3842 8.4308 8.4308 8.6090 8.6090 8.7096 8.7096 8.8029 8.8029 9.1334 9.1334 9.3141 9.3141 9.7229 9.7229 9.9728 9.9728 10.1826 10.1826 10.2591 10.2591 10.4574 10.4574 10.6684 10.6684 10.7355 10.7355 10.8749 10.8749 10.9404 10.9404 11.6052 11.6052 11.6685 11.6685 k = 0.3140-0.4198-0.0398 ( 3978 PWs) bands (ev): -0.7733 -0.7733 1.4791 1.4791 2.4329 2.4329 2.8159 2.8159 5.2741 5.2741 6.3185 6.3185 6.3855 6.3855 6.8486 6.8486 7.2468 7.2468 7.7237 7.7237 8.0171 8.0171 8.3928 8.3928 8.4226 8.4226 8.6269 8.6269 8.7117 8.7117 8.8105 8.8105 9.1194 9.1194 9.3048 9.3048 9.7043 9.7043 9.9698 9.9698 10.1362 10.1362 10.2722 10.2722 10.4495 10.4495 10.6590 10.6590 10.7308 10.7308 10.8549 10.8549 10.9186 10.9186 11.5183 11.5183 11.6712 11.6712 k = 0.3256-0.4353-0.0412 ( 3980 PWs) bands (ev): -0.7004 -0.7004 1.4809 1.4809 2.3576 2.3576 2.8193 2.8193 5.2268 5.2268 6.3042 6.3042 6.4249 6.4249 6.9049 6.9049 7.2907 7.2907 7.7245 7.7245 7.9921 7.9921 8.3930 8.3930 8.4158 8.4158 8.6456 8.6456 8.7137 8.7137 8.8181 8.8181 9.1065 9.1065 9.2976 9.2976 9.6860 9.6860 9.9614 9.9614 10.0961 10.0961 10.2853 10.2853 10.4406 10.4406 10.6486 10.6486 10.7262 10.7262 10.8368 10.8368 10.8972 10.8972 11.4315 11.4315 11.6731 11.6731 k = 0.3372-0.4509-0.0427 ( 3982 PWs) bands (ev): -0.6255 -0.6255 1.4801 1.4801 2.2822 2.2822 2.8212 2.8212 5.1828 5.1828 6.2927 6.2927 6.4653 6.4653 6.9636 6.9636 7.3351 7.3351 7.7251 7.7251 7.9670 7.9670 8.3805 8.3805 8.4148 8.4148 8.6639 8.6639 8.7160 8.7160 8.8254 8.8254 9.0944 9.0944 9.2925 9.2925 9.6683 9.6683 9.9440 9.9440 10.0665 10.0665 10.2981 10.2981 10.4304 10.4304 10.6373 10.6373 10.7215 10.7215 10.8204 10.8204 10.8763 10.8763 11.3460 11.3460 11.6732 11.6732 k = 0.3488-0.4664-0.0442 ( 3983 PWs) bands (ev): -0.5484 -0.5484 1.4756 1.4756 2.2080 2.2080 2.8214 2.8214 5.1420 5.1420 6.2844 6.2844 6.5062 6.5062 7.0239 7.0239 7.3792 7.3792 7.7257 7.7257 7.9428 7.9428 8.3603 8.3603 8.4149 8.4149 8.6804 8.6804 8.7193 8.7193 8.8324 8.8324 9.0833 9.0833 9.2894 9.2894 9.6519 9.6519 9.9159 9.9159 10.0495 10.0495 10.3101 10.3101 10.4185 10.4185 10.6253 10.6253 10.7169 10.7169 10.8059 10.8059 10.8561 10.8561 11.2627 11.2627 11.6712 11.6712 k = 0.3605-0.4820-0.0456 ( 3981 PWs) bands (ev): -0.4695 -0.4695 1.4658 1.4658 2.1371 2.1371 2.8201 2.8201 5.1045 5.1045 6.2792 6.2792 6.5475 6.5475 7.0853 7.0853 7.4212 7.4212 7.7266 7.7266 7.9205 7.9205 8.3353 8.3353 8.4134 8.4134 8.6934 8.6934 8.7247 8.7247 8.8389 8.8389 9.0734 9.0734 9.2879 9.2879 9.6370 9.6370 9.8807 9.8807 10.0422 10.0422 10.3207 10.3207 10.4050 10.4050 10.6132 10.6132 10.7125 10.7125 10.7930 10.7930 10.8368 10.8368 11.1825 11.1825 11.6668 11.6668 k = 0.3721-0.4975-0.0471 ( 3980 PWs) bands (ev): -0.3887 -0.3887 1.4488 1.4488 2.0715 2.0715 2.8175 2.8175 5.0702 5.0702 6.2769 6.2769 6.5890 6.5890 7.1471 7.1471 7.4590 7.4590 7.7291 7.7291 7.9012 7.9012 8.3068 8.3068 8.4097 8.4097 8.7016 8.7016 8.7329 8.7329 8.8450 8.8450 9.0649 9.0649 9.2874 9.2874 9.6245 9.6245 9.8428 9.8428 10.0404 10.0404 10.3284 10.3284 10.3903 10.3903 10.6016 10.6016 10.7084 10.7084 10.7811 10.7811 10.8188 10.8188 11.1063 11.1063 11.6598 11.6598 k = 0.3837-0.5131-0.0486 ( 3980 PWs) bands (ev): -0.3063 -0.3063 1.4225 1.4225 2.0137 2.0137 2.8138 2.8138 5.0390 5.0390 6.2770 6.2770 6.6308 6.6308 7.2087 7.2087 7.4894 7.4894 7.7352 7.7352 7.8862 7.8862 8.2752 8.2752 8.4036 8.4036 8.7060 8.7060 8.7422 8.7422 8.8507 8.8507 9.0580 9.0580 9.2869 9.2869 9.6148 9.6148 9.8054 9.8054 10.0418 10.0418 10.3299 10.3299 10.3775 10.3775 10.5909 10.5909 10.7043 10.7043 10.7698 10.7698 10.8023 10.8023 11.0351 11.0351 11.6506 11.6506 k = 0.3953-0.5286-0.0501 ( 3982 PWs) bands (ev): -0.2224 -0.2224 1.3852 1.3852 1.9657 1.9657 2.8092 2.8092 5.0111 5.0111 6.2792 6.2792 6.6726 6.6726 7.2690 7.2690 7.5092 7.5092 7.7475 7.7475 7.8761 7.8761 8.2411 8.2411 8.3951 8.3951 8.7088 8.7088 8.7503 8.7503 8.8561 8.8561 9.0530 9.0530 9.2853 9.2853 9.6083 9.6083 9.7701 9.7701 10.0451 10.0451 10.3195 10.3195 10.3721 10.3721 10.5813 10.5813 10.7004 10.7004 10.7583 10.7583 10.7877 10.7877 10.9701 10.9701 11.6396 11.6396 k = 0.4070-0.5442-0.0515 ( 3984 PWs) bands (ev): -0.1372 -0.1372 1.3362 1.3362 1.9283 1.9283 2.8040 2.8040 4.9863 4.9863 6.2829 6.2829 6.7143 6.7143 7.3262 7.3262 7.5179 7.5179 7.7668 7.7668 7.8717 7.8717 8.2051 8.2051 8.3845 8.3845 8.7107 8.7107 8.7560 8.7560 8.8612 8.8612 9.0500 9.0500 9.2817 9.2817 9.6051 9.6051 9.7387 9.7387 10.0497 10.0497 10.2982 10.2982 10.3735 10.3735 10.5723 10.5723 10.6964 10.6964 10.7467 10.7467 10.7752 10.7752 10.9125 10.9125 11.6274 11.6274 k = 0.4186-0.5597-0.0530 ( 3985 PWs) bands (ev): -0.0512 -0.0512 1.2764 1.2764 1.9011 1.9011 2.7985 2.7985 4.9645 4.9645 6.2876 6.2876 6.7554 6.7554 7.3760 7.3760 7.5211 7.5211 7.7903 7.7903 7.8736 7.8736 8.1678 8.1678 8.3720 8.3720 8.7124 8.7124 8.7590 8.7590 8.8661 8.8661 9.0493 9.0493 9.2756 9.2756 9.6039 9.6039 9.7131 9.7131 10.0550 10.0550 10.2714 10.2714 10.3770 10.3770 10.5631 10.5631 10.6922 10.6922 10.7351 10.7351 10.7643 10.7643 10.8639 10.8639 11.6148 11.6148 k = 0.4302-0.5753-0.0545 ( 3985 PWs) bands (ev): 0.0353 0.0353 1.2079 1.2079 1.8824 1.8824 2.7929 2.7929 4.9458 4.9458 6.2930 6.2930 6.7954 6.7954 7.4079 7.4079 7.5324 7.5324 7.8122 7.8122 7.8827 7.8827 8.1302 8.1302 8.3581 8.3581 8.7140 8.7140 8.7595 8.7595 8.8704 8.8704 9.0506 9.0506 9.2671 9.2671 9.6020 9.6020 9.6961 9.6961 10.0607 10.0607 10.2422 10.2422 10.3807 10.3807 10.5527 10.5527 10.6880 10.6880 10.7245 10.7245 10.7542 10.7542 10.8253 10.8253 11.6024 11.6024 k = 0.4419-0.5908-0.0560 ( 3984 PWs) bands (ev): 0.1216 0.1216 1.1334 1.1334 1.8703 1.8703 2.7875 2.7875 4.9300 4.9300 6.2985 6.2985 6.8337 6.8337 7.4128 7.4128 7.5641 7.5641 7.8281 7.8281 7.8982 7.8982 8.0938 8.0938 8.3436 8.3436 8.7155 8.7155 8.7579 8.7579 8.8740 8.8740 9.0537 9.0537 9.2566 9.2566 9.5962 9.5962 9.6903 9.6903 10.0659 10.0659 10.2130 10.2130 10.3840 10.3840 10.5404 10.5404 10.6839 10.6839 10.7157 10.7157 10.7441 10.7441 10.7974 10.7974 11.5910 11.5910 k = 0.4535-0.6064-0.0574 ( 3980 PWs) bands (ev): 0.2064 0.2064 1.0560 1.0560 1.8627 1.8627 2.7827 2.7827 4.9172 4.9172 6.3037 6.3037 6.8691 6.8691 7.4002 7.4002 7.6096 7.6096 7.8378 7.8378 7.9137 7.9137 8.0619 8.0619 8.3293 8.3293 8.7169 8.7169 8.7551 8.7551 8.8767 8.8767 9.0581 9.0581 9.2452 9.2452 9.5866 9.5866 9.6947 9.6947 10.0699 10.0699 10.1859 10.1859 10.3869 10.3869 10.5263 10.5263 10.6806 10.6806 10.7090 10.7090 10.7341 10.7341 10.7789 10.7789 11.5809 11.5809 k = 0.4651-0.6219-0.0589 ( 3976 PWs) bands (ev): 0.2876 0.2876 0.9792 0.9792 1.8583 1.8583 2.7787 2.7787 4.9072 4.9072 6.3083 6.3083 6.9002 6.9002 7.3820 7.3820 7.6591 7.6591 7.8427 7.8427 7.9190 7.9190 8.0403 8.0403 8.3163 8.3163 8.7181 8.7181 8.7516 8.7516 8.8786 8.8786 9.0632 9.0632 9.2340 9.2340 9.5761 9.5761 9.7046 9.7046 10.0711 10.0711 10.1637 10.1637 10.3893 10.3893 10.5121 10.5121 10.6785 10.6785 10.7045 10.7045 10.7248 10.7248 10.7675 10.7675 11.5726 11.5726 k = 0.4767-0.6375-0.0604 ( 3982 PWs) bands (ev): 0.3606 0.3606 0.9085 0.9085 1.8559 1.8559 2.7756 2.7756 4.9002 4.9002 6.3117 6.3117 6.9250 6.9250 7.3648 7.3648 7.7083 7.7083 7.8413 7.8413 7.9091 7.9091 8.0332 8.0332 8.3058 8.3058 8.7192 8.7192 8.7484 8.7484 8.8798 8.8798 9.0679 9.0679 9.2246 9.2246 9.5672 9.5672 9.7154 9.7154 10.0691 10.0691 10.1487 10.1487 10.3912 10.3912 10.4996 10.4996 10.6776 10.6776 10.7020 10.7020 10.7171 10.7171 10.7606 10.7606 11.5664 11.5664 k = 0.4884-0.6530-0.0618 ( 3978 PWs) bands (ev): 0.4163 0.4163 0.8541 0.8541 1.8547 1.8547 2.7737 2.7737 4.8959 4.8959 6.3139 6.3139 6.9413 6.9413 7.3526 7.3526 7.7549 7.7549 7.8274 7.8274 7.8952 7.8952 8.0345 8.0345 8.2989 8.2989 8.7199 8.7199 8.7461 8.7461 8.8805 8.8805 9.0714 9.0714 9.2181 9.2181 9.5615 9.5615 9.7235 9.7235 10.0654 10.0654 10.1410 10.1410 10.3925 10.3925 10.4912 10.4912 10.6774 10.6774 10.7013 10.7013 10.7115 10.7115 10.7569 10.7569 11.5627 11.5627 k = 0.5000-0.6686-0.0633 ( 3980 PWs) bands (ev): 0.4384 0.4384 0.8324 0.8324 1.8543 1.8543 2.7731 2.7731 4.8945 4.8945 6.3146 6.3146 6.9471 6.9471 7.3481 7.3481 7.7923 7.7923 7.8007 7.8007 7.8900 7.8900 8.0359 8.0359 8.2965 8.2965 8.7201 8.7201 8.7453 8.7453 8.8806 8.8806 9.0727 9.0727 9.2158 9.2158 9.5595 9.5595 9.7266 9.7266 10.0636 10.0636 10.1388 10.1388 10.3930 10.3930 10.4881 10.4881 10.6774 10.6774 10.7015 10.7015 10.7093 10.7093 10.7557 10.7557 11.5614 11.5614 k = 0.5000-0.6686 0.5869 ( 3990 PWs) bands (ev): 1.2983 1.2983 1.3944 1.3944 1.8223 1.8223 2.2702 2.2702 4.4816 4.4816 4.9572 4.9572 5.8839 5.8839 6.4472 6.4472 7.1780 7.1780 7.3894 7.3894 7.6040 7.6040 8.3189 8.3189 8.6681 8.6681 8.8902 8.8902 9.0851 9.0851 9.1315 9.1315 9.3080 9.3080 9.5776 9.5776 9.6947 9.6947 9.7771 9.7771 9.9401 9.9401 10.1573 10.1573 10.2796 10.2796 10.4500 10.4500 10.6461 10.6461 10.6937 10.6937 10.8204 10.8204 11.0360 11.0360 11.9867 11.9867 k = 0.4904-0.6557 0.5756 ( 3991 PWs) bands (ev): 1.2803 1.2803 1.3965 1.3965 1.8357 1.8357 2.2712 2.2712 4.4828 4.4828 4.9612 4.9612 5.8778 5.8778 6.4538 6.4538 7.1660 7.1660 7.3988 7.3988 7.6048 7.6048 8.3195 8.3195 8.6678 8.6678 8.8904 8.8904 9.0804 9.0804 9.1367 9.1367 9.3077 9.3077 9.5757 9.5757 9.6886 9.6886 9.7851 9.7851 9.9362 9.9362 10.1619 10.1619 10.2803 10.2803 10.4494 10.4494 10.6459 10.6459 10.6954 10.6954 10.8199 10.8199 11.0370 11.0370 11.9824 11.9824 k = 0.4808-0.6428 0.5643 ( 3991 PWs) bands (ev): 1.2332 1.2332 1.4002 1.4002 1.8716 1.8716 2.2745 2.2745 4.4865 4.4865 4.9730 4.9730 5.8607 5.8607 6.4721 6.4721 7.1356 7.1356 7.4216 7.4216 7.6072 7.6072 8.3212 8.3212 8.6671 8.6671 8.8912 8.8912 9.0699 9.0699 9.1489 9.1489 9.3068 9.3068 9.5703 9.5703 9.6750 9.6750 9.8045 9.8045 9.9253 9.9253 10.1745 10.1745 10.2823 10.2823 10.4477 10.4477 10.6456 10.6456 10.7002 10.7002 10.8186 10.8186 11.0400 11.0400 11.9711 11.9711 k = 0.4712-0.6300 0.5530 ( 3988 PWs) bands (ev): 1.1676 1.1676 1.4033 1.4033 1.9212 1.9212 2.2802 2.2802 4.4927 4.4927 4.9925 4.9925 5.8351 5.8351 6.4986 6.4986 7.0964 7.0964 7.4495 7.4495 7.6113 7.6113 8.3239 8.3239 8.6661 8.6661 8.8924 8.8924 9.0576 9.0576 9.1640 9.1640 9.3050 9.3050 9.5623 9.5623 9.6588 9.6588 9.8296 9.8296 9.9101 9.9101 10.1928 10.1928 10.2853 10.2853 10.4455 10.4455 10.6453 10.6453 10.7076 10.7076 10.8168 10.8168 11.0450 11.0450 11.9562 11.9562 k = 0.4615-0.6171 0.5417 ( 3986 PWs) bands (ev): 1.0906 1.0906 1.4058 1.4058 1.9768 1.9768 2.2889 2.2889 4.5016 4.5016 5.0193 5.0193 5.8043 5.8043 6.5282 6.5282 7.0558 7.0558 7.4774 7.4774 7.6170 7.6170 8.3271 8.3271 8.6647 8.6647 8.8939 8.8939 9.0447 9.0447 9.1806 9.1806 9.3020 9.3020 9.5526 9.5526 9.6425 9.6425 9.8564 9.8564 9.8939 9.8939 10.2142 10.2142 10.2892 10.2892 10.4435 10.4435 10.6452 10.6452 10.7165 10.7165 10.8150 10.8150 11.0518 11.0518 11.9404 11.9404 k = 0.4519-0.6043 0.5304 ( 3984 PWs) bands (ev): 1.0066 1.0066 1.4082 1.4082 2.0329 2.0329 2.3015 2.3015 4.5133 4.5133 5.0529 5.0529 5.7709 5.7709 6.5547 6.5547 7.0203 7.0203 7.5030 7.5030 7.6244 7.6244 8.3306 8.3306 8.6633 8.6633 8.8955 8.8955 9.0316 9.0316 9.1980 9.1980 9.2973 9.2973 9.5423 9.5423 9.6269 9.6269 9.8652 9.8652 9.8969 9.8969 10.2365 10.2365 10.2935 10.2935 10.4429 10.4429 10.6450 10.6450 10.7264 10.7264 10.8139 10.8139 11.0605 11.0605 11.9259 11.9259 k = 0.4423-0.5914 0.5191 ( 3982 PWs) bands (ev): 0.9181 0.9181 1.4106 1.4106 2.0853 2.0853 2.3192 2.3192 4.5280 4.5280 5.0926 5.0926 5.7374 5.7374 6.5705 6.5705 6.9968 6.9968 7.5253 7.5253 7.6333 7.6333 8.3339 8.3339 8.6618 8.6618 8.8970 8.8970 9.0186 9.0186 9.2157 9.2157 9.2905 9.2905 9.5319 9.5319 9.6132 9.6132 9.8487 9.8487 9.9267 9.9267 10.2569 10.2569 10.2987 10.2987 10.4450 10.4450 10.6443 10.6443 10.7362 10.7362 10.8145 10.8145 11.0709 11.0709 11.9138 11.9138 k = 0.4327-0.5786 0.5079 ( 3984 PWs) bands (ev): 0.8267 0.8267 1.4132 1.4132 2.1310 2.1310 2.3433 2.3433 4.5457 4.5457 5.1376 5.1376 5.7059 5.7059 6.5688 6.5688 6.9919 6.9919 7.5440 7.5440 7.6434 7.6434 8.3366 8.3366 8.6604 8.6604 8.8984 8.8984 9.0055 9.0055 9.2331 9.2331 9.2817 9.2817 9.5212 9.5212 9.6025 9.6025 9.8303 9.8303 9.9604 9.9604 10.2712 10.2712 10.3072 10.3072 10.4512 10.4512 10.6428 10.6428 10.7454 10.7454 10.8174 10.8174 11.0830 11.0830 11.9049 11.9049 k = 0.4231-0.5657 0.4966 ( 3983 PWs) bands (ev): 0.7335 0.7335 1.4160 1.4160 2.1682 2.1682 2.3745 2.3745 4.5667 4.5667 5.1865 5.1865 5.6782 5.6782 6.5472 6.5472 7.0075 7.0075 7.5598 7.5598 7.6542 7.6542 8.3385 8.3385 8.6589 8.6589 8.8995 8.8995 8.9921 8.9921 9.2466 9.2466 9.2738 9.2738 9.5099 9.5099 9.5962 9.5962 9.8125 9.8125 9.9956 9.9956 10.2756 10.2756 10.3216 10.3216 10.4625 10.4625 10.6397 10.6397 10.7538 10.7538 10.8231 10.8231 11.0967 11.0967 11.8996 11.8996 k = 0.4135-0.5528 0.4853 ( 3980 PWs) bands (ev): 0.6393 0.6393 1.4191 1.4191 2.1971 2.1971 2.4118 2.4118 4.5908 4.5908 5.2373 5.2373 5.6567 5.6567 6.5092 6.5092 7.0399 7.0399 7.5731 7.5731 7.6652 7.6652 8.3394 8.3394 8.6575 8.6575 8.9002 8.9002 8.9783 8.9783 9.2430 9.2430 9.2797 9.2797 9.4977 9.4977 9.5951 9.5951 9.7962 9.7962 10.0315 10.0315 10.2730 10.2730 10.3390 10.3390 10.4789 10.4789 10.6346 10.6346 10.7621 10.7621 10.8314 10.8314 11.1119 11.1119 11.8982 11.8982 k = 0.4038-0.5400 0.4740 ( 3980 PWs) bands (ev): 0.5446 0.5446 1.4225 1.4225 2.2197 2.2197 2.4526 2.4526 4.6183 4.6183 5.2870 5.2870 5.6445 5.6445 6.4605 6.4605 7.0831 7.0831 7.5844 7.5844 7.6761 7.6761 8.3392 8.3392 8.6557 8.6557 8.9006 8.9006 8.9641 8.9641 9.2259 9.2259 9.2956 9.2956 9.4852 9.4852 9.5988 9.5988 9.7819 9.7819 10.0671 10.0671 10.2675 10.2675 10.3566 10.3566 10.4996 10.4996 10.6272 10.6272 10.7710 10.7710 10.8413 10.8413 11.1284 11.1284 11.9008 11.9008 k = 0.3942-0.5271 0.4627 ( 3977 PWs) bands (ev): 0.4498 0.4498 1.4262 1.4262 2.2382 2.2382 2.4946 2.4946 4.6491 4.6491 5.3311 5.3311 5.6459 5.6459 6.4058 6.4058 7.1323 7.1323 7.5940 7.5940 7.6871 7.6871 8.3380 8.3380 8.6536 8.6536 8.9006 8.9006 8.9493 8.9493 9.2038 9.2038 9.3126 9.3126 9.4729 9.4729 9.6069 9.6069 9.7699 9.7699 10.1007 10.1007 10.2623 10.2623 10.3738 10.3738 10.5236 10.5236 10.6175 10.6175 10.7813 10.7813 10.8523 10.8523 11.1459 11.1459 11.9076 11.9076 k = 0.3846-0.5143 0.4514 ( 3981 PWs) bands (ev): 0.3553 0.3553 1.4302 1.4302 2.2541 2.2541 2.5357 2.5357 4.6831 4.6831 5.3648 5.3648 5.6655 5.6655 6.3484 6.3484 7.1840 7.1840 7.6020 7.6020 7.6984 7.6984 8.3358 8.3358 8.6509 8.6509 8.8999 8.8999 8.9341 8.9341 9.1784 9.1784 9.3291 9.3291 9.4615 9.4615 9.6182 9.6182 9.7608 9.7608 10.1288 10.1288 10.2617 10.2617 10.3905 10.3905 10.5495 10.5495 10.6059 10.6059 10.7934 10.7934 10.8635 10.8635 11.1644 11.1644 11.9183 11.9183 k = 0.3750-0.5014 0.4401 ( 3980 PWs) bands (ev): 0.2615 0.2615 1.4345 1.4345 2.2685 2.2685 2.5748 2.5748 4.7204 4.7204 5.3859 5.3859 5.7043 5.7043 6.2908 6.2908 7.2360 7.2360 7.6081 7.6081 7.7108 7.7108 8.3328 8.3328 8.6475 8.6475 8.8979 8.8979 8.9191 8.9191 9.1500 9.1500 9.3443 9.3443 9.4515 9.4515 9.6320 9.6320 9.7552 9.7552 10.1459 10.1459 10.2719 10.2719 10.4066 10.4066 10.5747 10.5747 10.5949 10.5949 10.8074 10.8074 10.8749 10.8749 11.1835 11.1835 11.9328 11.9328 k = 0.3654-0.4886 0.4289 ( 3979 PWs) bands (ev): 0.1684 0.1684 1.4391 1.4391 2.2821 2.2821 2.6111 2.6111 4.7608 4.7608 5.3975 5.3975 5.7581 5.7581 6.2354 6.2354 7.2865 7.2865 7.6121 7.6121 7.7250 7.7250 8.3292 8.3292 8.6431 8.6431 8.8915 8.8915 8.9079 8.9079 9.1193 9.1193 9.3574 9.3574 9.4433 9.4433 9.6474 9.6474 9.7535 9.7535 10.1492 10.1492 10.2959 10.2959 10.4223 10.4223 10.5739 10.5739 10.6095 10.6095 10.8231 10.8231 10.8863 10.8863 11.2030 11.2030 11.9506 11.9506 k = 0.3558-0.4757 0.4176 ( 3977 PWs) bands (ev): 0.0764 0.0764 1.4438 1.4438 2.2953 2.2953 2.6443 2.6443 4.8043 4.8043 5.4041 5.4041 5.8193 5.8193 6.1855 6.1855 7.3342 7.3342 7.6140 7.6140 7.7414 7.7414 8.3251 8.3251 8.6377 8.6377 8.8776 8.8776 8.9035 8.9035 9.0867 9.0867 9.3673 9.3673 9.4378 9.4378 9.6636 9.6636 9.7563 9.7563 10.1429 10.1429 10.3297 10.3297 10.4372 10.4372 10.5590 10.5590 10.6378 10.6378 10.8403 10.8403 10.8979 10.8979 11.2230 11.2230 11.9712 11.9712 k = 0.3462-0.4628 0.4063 ( 3980 PWs) bands (ev): -0.0144 -0.0144 1.4487 1.4487 2.3084 2.3084 2.6742 2.6742 4.8507 4.8507 5.4094 5.4094 5.8773 5.8773 6.1482 6.1482 7.3779 7.3779 7.6139 7.6139 7.7607 7.7607 8.3207 8.3207 8.6310 8.6310 8.8604 8.8604 8.9019 8.9019 9.0527 9.0527 9.3726 9.3726 9.4359 9.4359 9.6797 9.6797 9.7641 9.7641 10.1318 10.1318 10.3682 10.3682 10.4507 10.4507 10.5435 10.5435 10.6671 10.6671 10.8585 10.8585 10.9101 10.9101 11.2433 11.2433 11.9937 11.9937 k = 0.3365-0.4500 0.3950 ( 3982 PWs) bands (ev): -0.1038 -0.1038 1.4538 1.4538 2.3213 2.3213 2.7009 2.7009 4.8998 4.8998 5.4158 5.4158 5.9142 5.9142 6.1390 6.1390 7.4167 7.4167 7.6119 7.6119 7.7829 7.7829 8.3161 8.3161 8.6229 8.6229 8.8422 8.8422 8.9008 8.9008 9.0179 9.0179 9.3725 9.3725 9.4383 9.4383 9.6951 9.6951 9.7769 9.7769 10.1187 10.1187 10.4079 10.4079 10.4616 10.4616 10.5301 10.5301 10.6967 10.6967 10.8769 10.8769 10.9237 10.9237 11.2642 11.2642 12.0171 12.0171 k = 0.3269-0.4371 0.3837 ( 3980 PWs) bands (ev): -0.1917 -0.1917 1.4589 1.4589 2.3343 2.3343 2.7243 2.7243 4.9514 4.9514 5.4243 5.4243 5.9140 5.9140 6.1726 6.1726 7.4497 7.4497 7.6088 7.6088 7.8079 7.8079 8.3115 8.3115 8.6134 8.6134 8.8235 8.8235 8.8997 8.8997 8.9831 8.9831 9.3681 9.3681 9.4439 9.4439 9.7099 9.7099 9.7943 9.7943 10.1051 10.1051 10.4450 10.4450 10.4667 10.4667 10.5246 10.5246 10.7263 10.7263 10.8944 10.8944 10.9400 10.9400 11.2861 11.2861 12.0400 12.0400 k = 0.3173-0.4243 0.3724 ( 3983 PWs) bands (ev): -0.2779 -0.2779 1.4641 1.4641 2.3473 2.3473 2.7447 2.7447 5.0052 5.0052 5.4354 5.4354 5.8886 5.8886 6.2361 6.2361 7.4764 7.4764 7.6054 7.6054 7.8350 7.8350 8.3069 8.3069 8.6024 8.6024 8.8044 8.8044 8.8981 8.8981 8.9492 8.9492 9.3610 9.3610 9.4510 9.4510 9.7243 9.7243 9.8152 9.8152 10.0921 10.0921 10.4540 10.4540 10.4830 10.4830 10.5343 10.5343 10.7559 10.7559 10.9100 10.9100 10.9597 10.9597 11.3095 11.3095 12.0611 12.0611 k = 0.3077-0.4114 0.3611 ( 3986 PWs) bands (ev): -0.3624 -0.3624 1.4692 1.4692 2.3604 2.3604 2.7623 2.7623 5.0609 5.0609 5.4492 5.4492 5.8554 5.8554 6.3118 6.3118 7.4958 7.4958 7.6029 7.6029 7.8634 7.8634 8.3025 8.3025 8.5898 8.5898 8.7851 8.7851 8.8934 8.8934 8.9195 8.9195 9.3528 9.3528 9.4583 9.4583 9.7386 9.7386 9.8384 9.8384 10.0803 10.0803 10.4393 10.4393 10.5048 10.5048 10.5597 10.5597 10.7852 10.7852 10.9238 10.9238 10.9827 10.9827 11.3353 11.3353 12.0790 12.0790 k = 0.2981-0.3986 0.3499 ( 3992 PWs) bands (ev): -0.4449 -0.4449 1.4741 1.4741 2.3735 2.3735 2.7775 2.7775 5.1180 5.1180 5.4652 5.4652 5.8226 5.8226 6.3912 6.3912 7.5070 7.5070 7.6030 7.6030 7.8922 7.8922 8.2984 8.2984 8.5755 8.5755 8.7653 8.7653 8.8747 8.8747 8.9053 8.9053 9.3441 9.3441 9.4653 9.4653 9.7531 9.7531 9.8627 9.8627 10.0709 10.0709 10.4203 10.4203 10.5199 10.5199 10.5931 10.5931 10.8142 10.8142 10.9366 10.9366 11.0077 11.0077 11.3645 11.3645 12.0924 12.0924 k = 0.2885-0.3857 0.3386 ( 3990 PWs) bands (ev): -0.5256 -0.5256 1.4789 1.4789 2.3866 2.3866 2.7906 2.7906 5.1760 5.1760 5.4827 5.4827 5.7944 5.7944 6.4706 6.4706 7.5097 7.5097 7.6067 7.6067 7.9205 7.9205 8.2946 8.2946 8.5598 8.5598 8.7452 8.7452 8.8475 8.8475 8.9019 8.9019 9.3354 9.3354 9.4717 9.4717 9.7678 9.7678 9.8866 9.8866 10.0651 10.0651 10.3996 10.3996 10.5318 10.5318 10.6277 10.6277 10.8426 10.8426 10.9494 10.9494 11.0334 11.0334 11.3984 11.3984 12.1006 12.1006 k = 0.2788-0.3728 0.3273 ( 3989 PWs) bands (ev): -0.6041 -0.6041 1.4834 1.4834 2.3997 2.3997 2.8019 2.8019 5.2341 5.2341 5.5000 5.5000 5.7739 5.7739 6.5481 6.5481 7.5052 7.5052 7.6134 7.6134 7.9473 7.9473 8.2914 8.2914 8.5424 8.5424 8.7247 8.7247 8.8213 8.8213 8.9001 8.9001 9.3272 9.3272 9.4775 9.4775 9.7824 9.7824 9.9080 9.9080 10.0648 10.0648 10.3781 10.3781 10.5419 10.5419 10.6609 10.6609 10.8700 10.8700 10.9631 10.9631 11.0586 11.0586 11.4382 11.4382 12.1033 12.1033 k = 0.2692-0.3600 0.3160 ( 3988 PWs) bands (ev): -0.6805 -0.6805 1.4875 1.4875 2.4125 2.4125 2.8118 2.8118 5.2915 5.2915 5.5152 5.5152 5.7642 5.7642 6.6221 6.6221 7.4955 7.4955 7.6215 7.6215 7.9719 7.9719 8.2888 8.2888 8.5234 8.5234 8.7044 8.7044 8.7976 8.7976 8.8983 8.8983 9.3196 9.3196 9.4828 9.4828 9.7968 9.7968 9.9247 9.9247 10.0723 10.0723 10.3562 10.3562 10.5506 10.5506 10.6918 10.6918 10.8958 10.8958 10.9785 10.9785 11.0822 11.0822 11.4849 11.4849 12.1006 12.1006 k = 0.2596-0.3471 0.3047 ( 3993 PWs) bands (ev): -0.7547 -0.7547 1.4912 1.4912 2.4251 2.4251 2.8207 2.8207 5.3465 5.3465 5.5270 5.5270 5.7682 5.7682 6.6916 6.6916 7.4822 7.4822 7.6298 7.6298 7.9939 7.9939 8.2868 8.2868 8.5030 8.5030 8.6847 8.6847 8.7767 8.7767 8.8961 8.8961 9.3129 9.3129 9.4876 9.4876 9.8104 9.8104 9.9355 9.9355 10.0886 10.0886 10.3340 10.3340 10.5580 10.5580 10.7198 10.7198 10.9195 10.9195 10.9962 10.9962 11.1034 11.1034 11.5391 11.5391 12.0934 12.0934 k = 0.2500-0.3343 0.2934 ( 3996 PWs) bands (ev): -0.8267 -0.8267 1.4943 1.4943 2.4373 2.4373 2.8292 2.8292 5.3968 5.3968 5.5363 5.5363 5.7869 5.7869 6.7557 6.7557 7.4665 7.4665 7.6376 7.6376 8.0132 8.0132 8.2854 8.2854 8.4812 8.4812 8.6663 8.6663 8.7582 8.7582 8.8933 8.8933 9.3072 9.3072 9.4923 9.4923 9.8229 9.8229 9.9415 9.9415 10.1132 10.1132 10.3120 10.3120 10.5641 10.5641 10.7450 10.7450 10.9406 10.9406 11.0168 11.0168 11.1220 11.1220 11.6012 11.6012 12.0825 12.0825 k = 0.2404-0.3214 0.2821 ( 3994 PWs) bands (ev): -0.8963 -0.8963 1.4970 1.4970 2.4490 2.4490 2.8375 2.8375 5.4374 5.4374 5.5488 5.5488 5.8190 5.8190 6.8138 6.8138 7.4490 7.4490 7.6448 7.6448 8.0298 8.0298 8.2845 8.2845 8.4583 8.4583 8.6495 8.6495 8.7419 8.7419 8.8896 8.8896 9.3026 9.3026 9.4970 9.4970 9.8338 9.8338 9.9447 9.9447 10.1437 10.1437 10.2902 10.2902 10.5689 10.5689 10.7674 10.7674 10.9594 10.9594 11.0401 11.0401 11.1381 11.1381 11.6707 11.6707 12.0688 12.0688 k = 0.2308-0.3086 0.2709 ( 3990 PWs) bands (ev): -0.9636 -0.9636 1.4990 1.4990 2.4598 2.4598 2.8462 2.8462 5.4628 5.4628 5.5719 5.5719 5.8620 5.8620 6.8654 6.8654 7.4302 7.4302 7.6511 7.6511 8.0441 8.0441 8.2838 8.2838 8.4343 8.4343 8.6346 8.6346 8.7277 8.7277 8.8850 8.8850 9.2994 9.2994 9.5019 9.5019 9.8427 9.8427 9.9473 9.9473 10.1778 10.1778 10.2691 10.2691 10.5725 10.5725 10.7870 10.7870 10.9765 10.9765 11.0656 11.0656 11.1519 11.1519 11.7469 11.7469 12.0532 12.0532 k = 0.2212-0.2957 0.2596 ( 3987 PWs) bands (ev): -1.0284 -1.0284 1.5004 1.5004 2.4697 2.4697 2.8556 2.8556 5.4743 5.4743 5.6057 5.6057 5.9134 5.9134 6.9101 6.9101 7.4107 7.4107 7.6565 7.6565 8.0568 8.0568 8.2829 8.2829 8.4095 8.4095 8.6212 8.6212 8.7155 8.7155 8.8794 8.8794 9.2975 9.2975 9.5072 9.5072 9.8494 9.8494 9.9504 9.9504 10.2130 10.2130 10.2500 10.2500 10.5749 10.5749 10.8038 10.8038 10.9926 10.9926 11.0922 11.0922 11.1641 11.1641 11.8287 11.8287 12.0366 12.0366 k = 0.2115-0.2828 0.2483 ( 3988 PWs) bands (ev): -1.0907 -1.0907 1.5012 1.5012 2.4783 2.4783 2.8663 2.8663 5.4798 5.4798 5.6436 5.6436 5.9713 5.9713 6.9478 6.9478 7.3910 7.3910 7.6610 7.6610 8.0682 8.0682 8.2816 8.2816 8.3841 8.3841 8.6091 8.6091 8.7055 8.7055 8.8725 8.8725 9.2972 9.2972 9.5132 9.5132 9.8538 9.8538 9.9545 9.9545 10.2229 10.2229 10.2583 10.2583 10.5762 10.5762 10.8180 10.8180 11.0085 11.0085 11.1194 11.1194 11.1753 11.1753 11.9138 11.9138 12.0203 12.0203 k = 0.2019-0.2700 0.2370 ( 3985 PWs) bands (ev): -1.1505 -1.1505 1.5013 1.5013 2.4856 2.4856 2.8785 2.8785 5.4844 5.4844 5.6809 5.6809 6.0339 6.0339 6.9784 6.9784 7.3722 7.3722 7.6646 7.6646 8.0788 8.0788 8.2795 8.2795 8.3581 8.3581 8.5976 8.5976 8.6976 8.6976 8.8643 8.8643 9.2985 9.2985 9.5198 9.5198 9.8563 9.8563 9.9594 9.9594 10.2056 10.2056 10.2956 10.2956 10.5765 10.5765 10.8295 10.8295 11.0245 11.0245 11.1461 11.1461 11.1866 11.1866 11.9810 11.9810 12.0243 12.0243 k = 0.1923-0.2571 0.2257 ( 3987 PWs) bands (ev): -1.2077 -1.2077 1.5008 1.5008 2.4913 2.4913 2.8925 2.8925 5.4905 5.4905 5.7154 5.7154 6.0999 6.0999 7.0019 7.0019 7.3552 7.3552 7.6674 7.6674 8.0887 8.0887 8.2764 8.2764 8.3318 8.3318 8.5865 8.5865 8.6918 8.6918 8.8551 8.8551 9.3014 9.3014 9.5272 9.5272 9.8575 9.8575 9.9645 9.9645 10.1877 10.1877 10.3347 10.3347 10.5757 10.5757 10.8384 10.8384 11.0410 11.0410 11.1703 11.1703 11.2002 11.2002 11.9733 11.9733 12.1043 12.1043 k = 0.1827-0.2443 0.2144 ( 3984 PWs) bands (ev): -1.2624 -1.2624 1.4997 1.4997 2.4954 2.4954 2.9086 2.9086 5.4992 5.4992 5.7458 5.7458 6.1683 6.1683 7.0187 7.0187 7.3412 7.3412 7.6694 7.6694 8.0978 8.0978 8.2713 8.2713 8.3065 8.3065 8.5757 8.5757 8.6881 8.6881 8.8446 8.8446 9.3059 9.3059 9.5354 9.5354 9.8579 9.8579 9.9690 9.9690 10.1711 10.1711 10.3739 10.3739 10.5742 10.5742 10.8447 10.8447 11.0581 11.0581 11.1885 11.1885 11.2200 11.2200 11.9541 11.9541 12.1948 12.1948 k = 0.1731-0.2314 0.2031 ( 3983 PWs) bands (ev): -1.3144 -1.3144 1.4980 1.4980 2.4978 2.4978 2.9268 2.9268 5.5108 5.5108 5.7714 5.7714 6.2381 6.2381 7.0291 7.0291 7.3311 7.3311 7.6709 7.6709 8.1056 8.1056 8.2596 8.2596 8.2867 8.2867 8.5652 8.5652 8.6860 8.6860 8.8332 8.8332 9.3120 9.3120 9.5443 9.5443 9.8578 9.8578 9.9723 9.9723 10.1564 10.1564 10.4123 10.4123 10.5719 10.5719 10.8485 10.8485 11.0760 11.0760 11.2013 11.2013 11.2456 11.2456 11.9332 11.9332 12.2835 12.2835 k = 0.1635-0.2186 0.1919 ( 3979 PWs) bands (ev): -1.3638 -1.3638 1.4958 1.4958 2.4986 2.4986 2.9472 2.9472 5.5254 5.5254 5.7914 5.7914 6.3087 6.3087 7.0339 7.0339 7.3257 7.3257 7.6719 7.6719 8.1115 8.1115 8.2371 8.2371 8.2775 8.2775 8.5553 8.5553 8.6851 8.6851 8.8210 8.8210 9.3196 9.3196 9.5538 9.5538 9.8574 9.8574 9.9736 9.9736 10.1440 10.1440 10.4493 10.4493 10.5693 10.5693 10.8498 10.8498 11.0948 11.0948 11.2122 11.2122 11.2735 11.2735 11.9115 11.9115 12.3669 12.3669 k = 0.1538-0.2057 0.1806 ( 3975 PWs) bands (ev): -1.4105 -1.4105 1.4932 1.4932 2.4979 2.4979 2.9695 2.9695 5.5431 5.5431 5.8056 5.8056 6.3792 6.3792 7.0342 7.0342 7.3249 7.3249 7.6728 7.6728 8.1143 8.1143 8.2100 8.2100 8.2733 8.2733 8.5462 8.5462 8.6849 8.6849 8.8081 8.8081 9.3286 9.3286 9.5639 9.5639 9.8568 9.8568 9.9727 9.9727 10.1343 10.1343 10.4840 10.4840 10.5669 10.5669 10.8488 10.8488 11.1143 11.1143 11.2228 11.2228 11.3025 11.3025 11.8892 11.8892 12.4415 12.4415 k = 0.1442-0.1929 0.1693 ( 3970 PWs) bands (ev): -1.4544 -1.4544 1.4902 1.4902 2.4959 2.4959 2.9937 2.9937 5.5635 5.5635 5.8136 5.8136 6.4491 6.4491 7.0316 7.0316 7.3278 7.3278 7.6742 7.6742 8.1126 8.1126 8.1830 8.1830 8.2709 8.2709 8.5382 8.5382 8.6854 8.6854 8.7950 8.7950 9.3388 9.3388 9.5744 9.5744 9.8561 9.8561 9.9694 9.9694 10.1273 10.1273 10.5144 10.5144 10.5665 10.5665 10.8457 10.8457 11.1347 11.1347 11.2338 11.2338 11.3318 11.3318 11.8665 11.8665 12.5021 12.5021 k = 0.1346-0.1800 0.1580 ( 3963 PWs) bands (ev): -1.4957 -1.4957 1.4869 1.4869 2.4928 2.4928 3.0194 3.0194 5.5863 5.5863 5.8157 5.8157 6.5179 6.5179 7.0274 7.0274 7.3330 7.3330 7.6766 7.6766 8.1033 8.1033 8.1600 8.1600 8.2695 8.2695 8.5316 8.5316 8.6860 8.6860 8.7818 8.7818 9.3502 9.3502 9.5851 9.5851 9.8550 9.8550 9.9639 9.9639 10.1228 10.1228 10.5335 10.5335 10.5751 10.5751 10.8408 10.8408 11.1556 11.1556 11.2456 11.2456 11.3615 11.3615 11.8439 11.8439 12.5302 12.5302 k = 0.1250-0.1671 0.1467 ( 3963 PWs) bands (ev): -1.5341 -1.5341 1.4834 1.4834 2.4888 2.4888 3.0462 3.0462 5.6106 5.6106 5.8125 5.8125 6.5849 6.5849 7.0231 7.0231 7.3390 7.3390 7.6810 7.6810 8.0837 8.0837 8.1440 8.1440 8.2686 8.2686 8.5262 8.5262 8.6868 8.6868 8.7689 8.7689 9.3626 9.3626 9.5959 9.5959 9.8534 9.8534 9.9571 9.9571 10.1204 10.1204 10.5370 10.5370 10.5966 10.5966 10.8343 10.8343 11.1767 11.1767 11.2585 11.2585 11.3911 11.3911 11.8216 11.8216 12.5145 12.5145 k = 0.1154-0.1543 0.1354 ( 3963 PWs) bands (ev): -1.5698 -1.5698 1.4798 1.4798 2.4841 2.4841 3.0738 3.0738 5.6354 5.6354 5.8056 5.8056 6.6494 6.6494 7.0198 7.0198 7.3437 7.3437 7.6884 7.6884 8.0566 8.0566 8.1333 8.1333 8.2677 8.2677 8.5221 8.5221 8.6874 8.6874 8.7566 8.7566 9.3758 9.3758 9.6065 9.6065 9.8509 9.8509 9.9497 9.9497 10.1194 10.1194 10.5339 10.5339 10.6220 10.6220 10.8265 10.8265 11.1974 11.1974 11.2731 11.2731 11.4207 11.4207 11.8000 11.8000 12.4905 12.4905 k = 0.1058-0.1414 0.1241 ( 3961 PWs) bands (ev): -1.6027 -1.6027 1.4762 1.4762 2.4790 2.4790 3.1019 3.1019 5.6583 5.6583 5.7974 5.7974 6.7105 6.7105 7.0185 7.0185 7.3458 7.3458 7.6996 7.6996 8.0260 8.0260 8.1247 8.1247 8.2661 8.2661 8.5194 8.5194 8.6879 8.6879 8.7453 8.7453 9.3897 9.3897 9.6166 9.6166 9.8473 9.8473 9.9428 9.9428 10.1195 10.1195 10.5288 10.5288 10.6467 10.6467 10.8179 10.8179 11.2168 11.2168 11.2900 11.2900 11.4501 11.4501 11.7794 11.7794 12.4664 12.4664 k = 0.0962-0.1286 0.1129 ( 3964 PWs) bands (ev): -1.6328 -1.6328 1.4725 1.4725 2.4737 2.4737 3.1298 3.1298 5.6749 5.6749 5.7931 5.7931 6.7669 6.7669 7.0203 7.0203 7.3442 7.3442 7.7148 7.7148 7.9944 7.9944 8.1168 8.1168 8.2634 8.2634 8.5176 8.5176 8.6883 8.6883 8.7352 8.7352 9.4043 9.4043 9.6258 9.6258 9.8421 9.8421 9.9370 9.9370 10.1199 10.1199 10.5228 10.5228 10.6695 10.6695 10.8087 10.8087 11.2343 11.2343 11.3099 11.3099 11.4790 11.4790 11.7601 11.7601 12.4432 12.4432 k = 0.0865-0.1157 0.1016 ( 3964 PWs) bands (ev): -1.6601 -1.6601 1.4690 1.4690 2.4683 2.4683 3.1573 3.1573 5.6793 5.6793 5.7990 5.7990 6.8167 6.8167 7.0262 7.0262 7.3392 7.3392 7.7332 7.7332 7.9635 7.9635 8.1092 8.1092 8.2592 8.2592 8.5167 8.5167 8.6884 8.6884 8.7267 8.7267 9.4195 9.4195 9.6338 9.6338 9.8357 9.8357 9.9328 9.9328 10.1206 10.1206 10.5165 10.5165 10.6899 10.6899 10.7996 10.7996 11.2492 11.2492 11.3329 11.3329 11.5072 11.5072 11.7422 11.7422 12.4208 12.4208 k = 0.0769-0.1029 0.0903 ( 3963 PWs) bands (ev): -1.6845 -1.6845 1.4657 1.4657 2.4631 2.4631 3.1838 3.1838 5.6706 5.6706 5.8166 5.8166 6.8580 6.8580 7.0369 7.0369 7.3324 7.3324 7.7525 7.7525 7.9352 7.9352 8.1020 8.1020 8.2532 8.2532 8.5163 8.5163 8.6882 8.6882 8.7200 8.7200 9.4353 9.4353 9.6399 9.6399 9.8283 9.8283 9.9302 9.9302 10.1212 10.1212 10.5100 10.5100 10.7076 10.7076 10.7911 10.7911 11.2618 11.2618 11.3586 11.3586 11.5345 11.5345 11.7261 11.7261 12.3991 12.3991 k = 0.0673-0.0900 0.0790 ( 3957 PWs) bands (ev): -1.7061 -1.7061 1.4626 1.4626 2.4581 2.4581 3.2087 3.2087 5.6541 5.6541 5.8409 5.8409 6.8896 6.8896 7.0514 7.0514 7.3266 7.3266 7.7677 7.7677 7.9134 7.9134 8.0955 8.0955 8.2454 8.2454 8.5162 8.5162 8.6879 8.6879 8.7150 8.7150 9.4516 9.4516 9.6435 9.6435 9.8208 9.8208 9.9291 9.9291 10.1216 10.1216 10.5037 10.5037 10.7221 10.7221 10.7838 10.7838 11.2722 11.2722 11.3861 11.3861 11.5603 11.5603 11.7119 11.7119 12.3777 12.3777 k = 0.0577-0.0771 0.0677 ( 3958 PWs) bands (ev): -1.7248 -1.7248 1.4597 1.4597 2.4535 2.4535 3.2317 3.2317 5.6347 5.6347 5.8674 5.8674 6.9124 6.9124 7.0658 7.0658 7.3256 7.3256 7.7710 7.7710 7.9048 7.9048 8.0897 8.0897 8.2358 8.2358 8.5163 8.5163 8.6874 8.6874 8.7116 8.7116 9.4684 9.4684 9.6441 9.6441 9.8138 9.8138 9.9290 9.9290 10.1217 10.1217 10.4975 10.4975 10.7326 10.7326 10.7789 10.7789 11.2809 11.2809 11.4145 11.4145 11.5843 11.5843 11.6995 11.6995 12.3564 12.3564 k = 0.0481-0.0643 0.0564 ( 3951 PWs) bands (ev): -1.7407 -1.7407 1.4573 1.4573 2.4494 2.4494 3.2522 3.2522 5.6151 5.6151 5.8934 5.8934 6.9293 6.9293 7.0746 7.0746 7.3334 7.3334 7.7579 7.7579 7.9127 7.9127 8.0847 8.0847 8.2246 8.2246 8.5165 8.5165 8.6870 8.6870 8.7096 8.7096 9.4856 9.4856 9.6413 9.6413 9.8081 9.8081 9.9296 9.9296 10.1216 10.1216 10.4920 10.4920 10.7380 10.7380 10.7776 10.7776 11.2881 11.2881 11.4428 11.4428 11.6058 11.6058 11.6893 11.6893 12.3349 12.3349 k = 0.0385-0.0514 0.0451 ( 3945 PWs) bands (ev): -1.7536 -1.7536 1.4552 1.4552 2.4460 2.4460 3.2697 3.2697 5.5973 5.5973 5.9170 5.9170 6.9429 6.9429 7.0746 7.0746 7.3510 7.3510 7.7337 7.7337 7.9309 7.9309 8.0805 8.0805 8.2124 8.2124 8.5167 8.5167 8.6867 8.6867 8.7086 8.7086 9.5031 9.5031 9.6348 9.6348 9.8040 9.8040 9.9305 9.9305 10.1213 10.1213 10.4871 10.4871 10.7389 10.7389 10.7798 10.7798 11.2939 11.2939 11.4695 11.4695 11.6241 11.6241 11.6811 11.6811 12.3133 12.3133 k = 0.0288-0.0386 0.0339 ( 3943 PWs) bands (ev): -1.7638 -1.7638 1.4536 1.4536 2.4432 2.4432 3.2838 3.2838 5.5822 5.5822 5.9369 5.9369 6.9552 6.9552 7.0669 7.0669 7.3755 7.3755 7.7054 7.7054 7.9520 7.9520 8.0772 8.0772 8.1999 8.1999 8.5168 8.5168 8.6866 8.6866 8.7081 8.7081 9.5208 9.5208 9.6252 9.6252 9.8015 9.8015 9.9316 9.9316 10.1210 10.1210 10.4831 10.4831 10.7374 10.7374 10.7836 10.7836 11.2983 11.2983 11.4933 11.4933 11.6386 11.6386 11.6751 11.6751 12.2925 12.2925 k = 0.0192-0.0257 0.0226 ( 3936 PWs) bands (ev): -1.7710 -1.7710 1.4524 1.4524 2.4412 2.4412 3.2941 3.2941 5.5710 5.5710 5.9520 5.9520 6.9666 6.9666 7.0552 7.0552 7.4017 7.4017 7.6781 7.6781 7.9711 7.9711 8.0747 8.0747 8.1886 8.1886 8.5168 8.5168 8.6866 8.6866 8.7080 8.7080 9.5380 9.5380 9.6132 9.6132 9.8001 9.8001 9.9325 9.9325 10.1206 10.1206 10.4801 10.4801 10.7354 10.7354 10.7870 10.7870 11.3015 11.3015 11.5123 11.5123 11.6486 11.6486 11.6715 11.6715 12.2745 12.2745 k = 0.0096-0.0129 0.0113 ( 3934 PWs) bands (ev): -1.7753 -1.7753 1.4516 1.4516 2.4400 2.4400 3.3005 3.3005 5.5640 5.5640 5.9614 5.9614 6.9763 6.9763 7.0440 7.0440 7.4226 7.4226 7.6572 7.6572 7.9846 7.9846 8.0730 8.0730 8.1803 8.1803 8.5169 8.5169 8.6866 8.6866 8.7080 8.7080 9.5534 9.5534 9.6006 9.6006 9.7995 9.7995 9.9331 9.9331 10.1203 10.1203 10.4783 10.4783 10.7339 10.7339 10.7893 10.7893 11.3034 11.3034 11.5246 11.5246 11.6538 11.6538 11.6702 11.6702 12.2621 12.2621 k = 0.0000 0.0000 0.0000 ( 3933 PWs) bands (ev): -1.7767 -1.7767 1.4514 1.4514 2.4396 2.4396 3.3026 3.3026 5.5616 5.5616 5.9646 5.9646 6.9805 6.9805 7.0390 7.0390 7.4308 7.4308 7.6491 7.6491 7.9896 7.9896 8.0724 8.0724 8.1773 8.1773 8.5169 8.5169 8.6866 8.6866 8.7081 8.7081 9.5614 9.5614 9.5936 9.5936 9.7993 9.7993 9.9333 9.9333 10.1203 10.1203 10.4776 10.4776 10.7334 10.7334 10.7901 10.7901 11.3040 11.3040 11.5289 11.5289 11.6552 11.6552 11.6702 11.6702 12.2577 12.2577 Writing output data file FeGe.save init_run : 2.78s CPU 13.29s WALL ( 1 calls) electrons : 961.66s CPU 970.93s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.22s CPU 1.40s WALL ( 1 calls) Called by electrons: c_bands : 961.63s CPU 970.55s WALL ( 1 calls) v_of_rho : 0.10s CPU 0.83s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.10s CPU 0.51s WALL ( 1 calls) newd : 0.36s CPU 0.60s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.08s WALL ( 352 calls) cegterg : 882.98s CPU 888.91s WALL ( 877 calls) Called by sum_band: Called by *egterg: h_psi : 403.08s CPU 411.98s WALL ( 14163 calls) s_psi : 54.25s CPU 54.87s WALL ( 14163 calls) g_psi : 0.89s CPU 0.89s WALL ( 12934 calls) cdiaghg : 319.16s CPU 316.30s WALL ( 13286 calls) cegterg:over : 77.28s CPU 74.65s WALL ( 12934 calls) cegterg:upda : 14.89s CPU 18.33s WALL ( 12934 calls) cegterg:last : 13.91s CPU 14.78s WALL ( 2417 calls) Called by h_psi: h_psi:vloc : 295.31s CPU 302.49s WALL ( 14163 calls) h_psi:vnl : 107.47s CPU 108.54s WALL ( 14163 calls) add_vuspsi : 38.38s CPU 42.56s WALL ( 14163 calls) General routines calbec : 69.04s CPU 65.84s WALL ( 14163 calls) fft : 0.27s CPU 1.21s WALL ( 19 calls) ffts : 0.00s CPU 0.03s WALL ( 4 calls) fftw : 282.10s CPU 287.11s WALL ( 1704272 calls) interpolate : 0.04s CPU 0.10s WALL ( 4 calls) davcio : 0.03s CPU 2.33s WALL ( 704 calls) Parallel routines fft_scatter : 160.85s CPU 163.59s WALL ( 1704295 calls) PWSCF : 17m 7.80s CPU 18m42.37s WALL This run was terminated on: 23:30:26 28May2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=