Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17: 7:30 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./K2MgCl4.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 165 101 28 4563 2171 324 Max 166 102 29 4565 2190 326 Sum 5973 3659 1023 164317 78475 11703 bravais-lattice index = 14 lattice parameter (alat) = 16.1332 a.u. unit-cell volume = 1282.8854 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 16.133203 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.832590 celldm(5)= -0.832590 celldm(6)= 0.665181 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.665181 0.746682 0.000000 ) a(3) = ( -0.832590 -0.373341 0.409157 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.890848 1.222024 ) b(2) = ( 0.000000 1.339258 1.222024 ) b(3) = ( 0.000000 0.000000 2.444048 ) PseudoPot. # 1 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 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 PseudoPot. # 2 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 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 PseudoPot. # 3 for Mg read from file: /users/gautes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 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 atomic species valence mass pseudopotential Cl 7.00 35.45300 Cl( 1.00) K 9.00 39.09830 K( 1.00) Mg 10.00 24.30500 Mg( 1.00) 4 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 282 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0000000 0.0000000 0.0271561), wk = 0.0035461 k( 3) = ( 0.0000000 0.0000000 0.0543122), wk = 0.0035461 k( 4) = ( 0.0000000 0.0000000 0.0814683), wk = 0.0035461 k( 5) = ( 0.0000000 0.0000000 0.1086244), wk = 0.0035461 k( 6) = ( 0.0000000 0.0000000 0.1357805), wk = 0.0035461 k( 7) = ( 0.0000000 0.0000000 0.1629366), wk = 0.0035461 k( 8) = ( 0.0000000 0.0000000 0.1900927), wk = 0.0035461 k( 9) = ( 0.0000000 0.0000000 0.2172488), wk = 0.0035461 k( 10) = ( 0.0000000 0.0000000 0.2444048), wk = 0.0035461 k( 11) = ( 0.0000000 0.0000000 0.2715609), wk = 0.0035461 k( 12) = ( 0.0000000 0.0000000 0.2987170), wk = 0.0035461 k( 13) = ( 0.0000000 0.0000000 0.3258731), wk = 0.0035461 k( 14) = ( 0.0000000 0.0000000 0.3530292), wk = 0.0035461 k( 15) = ( 0.0000000 0.0000000 0.3801853), wk = 0.0035461 k( 16) = ( 0.0000000 0.0000000 0.4073414), wk = 0.0035461 k( 17) = ( 0.0000000 0.0000000 0.4344975), wk = 0.0035461 k( 18) = ( 0.0000000 0.0000000 0.4616536), wk = 0.0035461 k( 19) = ( 0.0000000 0.0000000 0.4888097), wk = 0.0035461 k( 20) = ( 0.0000000 0.0000000 0.5159658), wk = 0.0035461 k( 21) = ( 0.0000000 0.0000000 0.5431219), wk = 0.0035461 k( 22) = ( 0.0000000 0.0000000 0.5702780), wk = 0.0035461 k( 23) = ( 0.0000000 0.0000000 0.5974341), wk = 0.0035461 k( 24) = ( 0.0000000 0.0000000 0.6245902), wk = 0.0035461 k( 25) = ( 0.0000000 0.0000000 0.6517463), wk = 0.0035461 k( 26) = ( 0.0000000 0.0000000 0.6789024), wk = 0.0035461 k( 27) = ( 0.0000000 0.0000000 0.7060584), wk = 0.0035461 k( 28) = ( 0.0000000 0.0000000 0.7332145), wk = 0.0035461 k( 29) = ( 0.0000000 0.0000000 0.7603706), wk = 0.0035461 k( 30) = ( 0.0000000 0.0000000 0.7875267), wk = 0.0035461 k( 31) = ( 0.0000000 0.0000000 0.8146828), wk = 0.0035461 k( 32) = ( 0.0000000 0.0000000 0.8418389), wk = 0.0035461 k( 33) = ( 0.0000000 0.0000000 0.8689950), wk = 0.0035461 k( 34) = ( 0.0000000 0.0000000 0.8961511), wk = 0.0035461 k( 35) = ( 0.0000000 0.0000000 0.9233072), wk = 0.0035461 k( 36) = ( 0.0000000 0.0000000 0.9504633), wk = 0.0035461 k( 37) = ( 0.0000000 0.0000000 0.9776194), wk = 0.0035461 k( 38) = ( 0.0000000 0.0000000 1.0047755), wk = 0.0035461 k( 39) = ( 0.0000000 0.0000000 1.0319316), wk = 0.0035461 k( 40) = ( 0.0000000 0.0000000 1.0590876), wk = 0.0035461 k( 41) = ( 0.0000000 0.0000000 1.0862437), wk = 0.0035461 k( 42) = ( 0.0000000 0.0000000 1.1133999), wk = 0.0035461 k( 43) = ( 0.0000000 0.0000000 1.1405559), wk = 0.0035461 k( 44) = ( 0.0000000 0.0000000 1.1677120), wk = 0.0035461 k( 45) = ( 0.0000000 0.0000000 1.1948681), wk = 0.0035461 k( 46) = ( 0.0000000 0.0000000 1.2220242), wk = 0.0035461 k( 47) = ( 0.0000000 0.0000000 1.2220242), wk = 0.0035461 k( 48) = ( -0.0100535 0.0224205 1.2220242), wk = 0.0035461 k( 49) = ( -0.0201071 0.0448409 1.2220242), wk = 0.0035461 k( 50) = ( -0.0301606 0.0672614 1.2220242), wk = 0.0035461 k( 51) = ( -0.0402142 0.0896818 1.2220242), wk = 0.0035461 k( 52) = ( -0.0502677 0.1121023 1.2220242), wk = 0.0035461 k( 53) = ( -0.0502677 0.1121023 1.2220242), wk = 0.0035461 k( 54) = ( -0.0580217 0.1293945 1.2030730), wk = 0.0035461 k( 55) = ( -0.0657757 0.1466868 1.1841219), wk = 0.0035461 k( 56) = ( -0.0735297 0.1639790 1.1651707), wk = 0.0035461 k( 57) = ( -0.0812837 0.1812713 1.1462196), wk = 0.0035461 k( 58) = ( -0.0890377 0.1985636 1.1272684), wk = 0.0035461 k( 59) = ( -0.0967917 0.2158558 1.1083172), wk = 0.0035461 k( 60) = ( -0.1045457 0.2331481 1.0893661), wk = 0.0035461 k( 61) = ( -0.1122997 0.2504403 1.0704149), wk = 0.0035461 k( 62) = ( -0.1200537 0.2677326 1.0514637), wk = 0.0035461 k( 63) = ( -0.1278077 0.2850248 1.0325126), wk = 0.0035461 k( 64) = ( -0.1355618 0.3023171 1.0135614), wk = 0.0035461 k( 65) = ( -0.1433158 0.3196093 0.9946103), wk = 0.0035461 k( 66) = ( -0.1510698 0.3369016 0.9756591), wk = 0.0035461 k( 67) = ( -0.1588238 0.3541938 0.9567079), wk = 0.0035461 k( 68) = ( -0.1665778 0.3714861 0.9377568), wk = 0.0035461 k( 69) = ( -0.1743318 0.3887783 0.9188056), wk = 0.0035461 k( 70) = ( -0.1820858 0.4060706 0.8998544), wk = 0.0035461 k( 71) = ( -0.1898398 0.4233629 0.8809033), wk = 0.0035461 k( 72) = ( -0.1975938 0.4406551 0.8619521), wk = 0.0035461 k( 73) = ( -0.2053478 0.4579474 0.8430009), wk = 0.0035461 k( 74) = ( -0.2131018 0.4752396 0.8240498), wk = 0.0035461 k( 75) = ( -0.2208558 0.4925319 0.8050986), wk = 0.0035461 k( 76) = ( -0.2286098 0.5098241 0.7861474), wk = 0.0035461 k( 77) = ( -0.2363638 0.5271164 0.7671963), wk = 0.0035461 k( 78) = ( -0.2441178 0.5444086 0.7482451), wk = 0.0035461 k( 79) = ( -0.2518718 0.5617009 0.7292939), wk = 0.0035461 k( 80) = ( -0.2596258 0.5789931 0.7103428), wk = 0.0035461 k( 81) = ( -0.2673798 0.5962854 0.6913916), wk = 0.0035461 k( 82) = ( -0.2751339 0.6135777 0.6724405), wk = 0.0035461 k( 83) = ( -0.2751339 0.6135777 0.6724405), wk = 0.0035461 k( 84) = ( -0.2672729 0.5960469 0.6532279), wk = 0.0035461 k( 85) = ( -0.2594119 0.5785161 0.6340153), wk = 0.0035461 k( 86) = ( -0.2515509 0.5609853 0.6148027), wk = 0.0035461 k( 87) = ( -0.2436900 0.5434545 0.5955901), wk = 0.0035461 k( 88) = ( -0.2358290 0.5259237 0.5763775), wk = 0.0035461 k( 89) = ( -0.2279681 0.5083929 0.5571650), wk = 0.0035461 k( 90) = ( -0.2201071 0.4908621 0.5379524), wk = 0.0035461 k( 91) = ( -0.2122461 0.4733313 0.5187398), wk = 0.0035461 k( 92) = ( -0.2043851 0.4558005 0.4995272), wk = 0.0035461 k( 93) = ( -0.1965242 0.4382698 0.4803146), wk = 0.0035461 k( 94) = ( -0.1886632 0.4207390 0.4611020), wk = 0.0035461 k( 95) = ( -0.1808022 0.4032082 0.4418894), wk = 0.0035461 k( 96) = ( -0.1729413 0.3856774 0.4226769), wk = 0.0035461 k( 97) = ( -0.1650803 0.3681466 0.4034643), wk = 0.0035461 k( 98) = ( -0.1572193 0.3506158 0.3842517), wk = 0.0035461 k( 99) = ( -0.1493584 0.3330850 0.3650391), wk = 0.0035461 k( 100) = ( -0.1414974 0.3155542 0.3458265), wk = 0.0035461 k( 101) = ( -0.1336364 0.2980234 0.3266139), wk = 0.0035461 k( 102) = ( -0.1257755 0.2804926 0.3074013), wk = 0.0035461 k( 103) = ( -0.1179145 0.2629619 0.2881888), wk = 0.0035461 k( 104) = ( -0.1100535 0.2454311 0.2689762), wk = 0.0035461 k( 105) = ( -0.1021926 0.2279003 0.2497636), wk = 0.0035461 k( 106) = ( -0.0943316 0.2103695 0.2305510), wk = 0.0035461 k( 107) = ( -0.0864706 0.1928387 0.2113384), wk = 0.0035461 k( 108) = ( -0.0786097 0.1753079 0.1921258), wk = 0.0035461 k( 109) = ( -0.0707487 0.1577771 0.1729132), wk = 0.0035461 k( 110) = ( -0.0628877 0.1402463 0.1537007), wk = 0.0035461 k( 111) = ( -0.0550268 0.1227155 0.1344881), wk = 0.0035461 k( 112) = ( -0.0471658 0.1051847 0.1152755), wk = 0.0035461 k( 113) = ( -0.0393048 0.0876540 0.0960629), wk = 0.0035461 k( 114) = ( -0.0314439 0.0701232 0.0768503), wk = 0.0035461 k( 115) = ( -0.0235829 0.0525924 0.0576377), wk = 0.0035461 k( 116) = ( -0.0157219 0.0350616 0.0384252), wk = 0.0035461 k( 117) = ( -0.0078610 0.0175308 0.0192126), wk = 0.0035461 k( 118) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 120) = ( 0.0238095 0.0106764 0.0000000), wk = 0.0035461 k( 121) = ( 0.0476191 0.0213528 0.0000000), wk = 0.0035461 k( 122) = ( 0.0714286 0.0320292 0.0000000), wk = 0.0035461 k( 123) = ( 0.0952381 0.0427056 0.0000000), wk = 0.0035461 k( 124) = ( 0.1190476 0.0533820 0.0000000), wk = 0.0035461 k( 125) = ( 0.1428571 0.0640585 0.0000000), wk = 0.0035461 k( 126) = ( 0.1666667 0.0747349 0.0000000), wk = 0.0035461 k( 127) = ( 0.1904762 0.0854113 0.0000000), wk = 0.0035461 k( 128) = ( 0.2142857 0.0960877 0.0000000), wk = 0.0035461 k( 129) = ( 0.2380952 0.1067641 0.0000000), wk = 0.0035461 k( 130) = ( 0.2619048 0.1174405 0.0000000), wk = 0.0035461 k( 131) = ( 0.2857143 0.1281169 0.0000000), wk = 0.0035461 k( 132) = ( 0.3095238 0.1387933 0.0000000), wk = 0.0035461 k( 133) = ( 0.3333333 0.1494697 0.0000000), wk = 0.0035461 k( 134) = ( 0.3571429 0.1601461 0.0000000), wk = 0.0035461 k( 135) = ( 0.3809524 0.1708225 0.0000000), wk = 0.0035461 k( 136) = ( 0.4047619 0.1814990 0.0000000), wk = 0.0035461 k( 137) = ( 0.4285714 0.1921754 0.0000000), wk = 0.0035461 k( 138) = ( 0.4523810 0.2028518 0.0000000), wk = 0.0035461 k( 139) = ( 0.4761905 0.2135282 0.0000000), wk = 0.0035461 k( 140) = ( 0.5000000 0.2242046 0.0000000), wk = 0.0035461 k( 141) = ( 0.5000000 0.2242046 0.0000000), wk = 0.0035461 k( 142) = ( 0.4922460 0.2414969 0.0189512), wk = 0.0035461 k( 143) = ( 0.4844920 0.2587891 0.0379023), wk = 0.0035461 k( 144) = ( 0.4767380 0.2760814 0.0568535), wk = 0.0035461 k( 145) = ( 0.4689840 0.2933736 0.0758047), wk = 0.0035461 k( 146) = ( 0.4612300 0.3106659 0.0947558), wk = 0.0035461 k( 147) = ( 0.4534760 0.3279581 0.1137070), wk = 0.0035461 k( 148) = ( 0.4457220 0.3452504 0.1326582), wk = 0.0035461 k( 149) = ( 0.4379680 0.3625426 0.1516093), wk = 0.0035461 k( 150) = ( 0.4302140 0.3798349 0.1705605), wk = 0.0035461 k( 151) = ( 0.4224599 0.3971271 0.1895116), wk = 0.0035461 k( 152) = ( 0.4147059 0.4144194 0.2084628), wk = 0.0035461 k( 153) = ( 0.4069519 0.4317116 0.2274140), wk = 0.0035461 k( 154) = ( 0.3991979 0.4490039 0.2463651), wk = 0.0035461 k( 155) = ( 0.3914439 0.4662961 0.2653163), wk = 0.0035461 k( 156) = ( 0.3836899 0.4835884 0.2842675), wk = 0.0035461 k( 157) = ( 0.3759359 0.5008806 0.3032186), wk = 0.0035461 k( 158) = ( 0.3681819 0.5181729 0.3221698), wk = 0.0035461 k( 159) = ( 0.3604279 0.5354651 0.3411209), wk = 0.0035461 k( 160) = ( 0.3526739 0.5527574 0.3600721), wk = 0.0035461 k( 161) = ( 0.3449199 0.5700497 0.3790233), wk = 0.0035461 k( 162) = ( 0.3371659 0.5873419 0.3979745), wk = 0.0035461 k( 163) = ( 0.3294119 0.6046342 0.4169256), wk = 0.0035461 k( 164) = ( 0.3216579 0.6219264 0.4358768), wk = 0.0035461 k( 165) = ( 0.3139039 0.6392187 0.4548280), wk = 0.0035461 k( 166) = ( 0.3061499 0.6565109 0.4737791), wk = 0.0035461 k( 167) = ( 0.2983959 0.6738032 0.4927303), wk = 0.0035461 k( 168) = ( 0.2906419 0.6910954 0.5116814), wk = 0.0035461 k( 169) = ( 0.2828878 0.7083877 0.5306326), wk = 0.0035461 k( 170) = ( 0.2751339 0.7256799 0.5495838), wk = 0.0035461 k( 171) = ( 0.2751339 0.7256799 0.5495838), wk = 0.0035461 k( 172) = ( 0.2501217 0.7205844 0.5551682), wk = 0.0035461 k( 173) = ( 0.2251095 0.7154888 0.5607526), wk = 0.0035461 k( 174) = ( 0.2000973 0.7103933 0.5663370), wk = 0.0035461 k( 175) = ( 0.1750852 0.7052977 0.5719213), wk = 0.0035461 k( 176) = ( 0.1500730 0.7002021 0.5775057), wk = 0.0035461 k( 177) = ( 0.1250608 0.6951066 0.5830901), wk = 0.0035461 k( 178) = ( 0.1000487 0.6900110 0.5886745), wk = 0.0035461 k( 179) = ( 0.0750365 0.6849155 0.5942589), wk = 0.0035461 k( 180) = ( 0.0500243 0.6798199 0.5998433), wk = 0.0035461 k( 181) = ( 0.0250122 0.6747244 0.6054277), wk = 0.0035461 k( 182) = ( 0.0000000 0.6696288 0.6110121), wk = 0.0035461 k( 183) = ( 0.0000000 0.6696288 0.6110121), wk = 0.0035461 k( 184) = ( 0.0078125 0.6522061 0.6301062), wk = 0.0035461 k( 185) = ( 0.0156250 0.6347834 0.6492004), wk = 0.0035461 k( 186) = ( 0.0234375 0.6173607 0.6682945), wk = 0.0035461 k( 187) = ( 0.0312500 0.5999380 0.6873886), wk = 0.0035461 k( 188) = ( 0.0390625 0.5825153 0.7064828), wk = 0.0035461 k( 189) = ( 0.0468750 0.5650926 0.7255769), wk = 0.0035461 k( 190) = ( 0.0546875 0.5476699 0.7446710), wk = 0.0035461 k( 191) = ( 0.0625000 0.5302472 0.7637651), wk = 0.0035461 k( 192) = ( 0.0703125 0.5128245 0.7828593), wk = 0.0035461 k( 193) = ( 0.0781250 0.4954018 0.8019534), wk = 0.0035461 k( 194) = ( 0.0859375 0.4779791 0.8210475), wk = 0.0035461 k( 195) = ( 0.0937500 0.4605564 0.8401417), wk = 0.0035461 k( 196) = ( 0.1015625 0.4431337 0.8592358), wk = 0.0035461 k( 197) = ( 0.1093750 0.4257110 0.8783299), wk = 0.0035461 k( 198) = ( 0.1171875 0.4082882 0.8974240), wk = 0.0035461 k( 199) = ( 0.1250000 0.3908655 0.9165182), wk = 0.0035461 k( 200) = ( 0.1328125 0.3734428 0.9356123), wk = 0.0035461 k( 201) = ( 0.1406250 0.3560201 0.9547064), wk = 0.0035461 k( 202) = ( 0.1484375 0.3385974 0.9738006), wk = 0.0035461 k( 203) = ( 0.1562500 0.3211747 0.9928947), wk = 0.0035461 k( 204) = ( 0.1640625 0.3037520 1.0119888), wk = 0.0035461 k( 205) = ( 0.1718750 0.2863293 1.0310829), wk = 0.0035461 k( 206) = ( 0.1796875 0.2689066 1.0501771), wk = 0.0035461 k( 207) = ( 0.1875000 0.2514839 1.0692712), wk = 0.0035461 k( 208) = ( 0.1953125 0.2340612 1.0883653), wk = 0.0035461 k( 209) = ( 0.2031250 0.2166385 1.1074594), wk = 0.0035461 k( 210) = ( 0.2109375 0.1992158 1.1265536), wk = 0.0035461 k( 211) = ( 0.2187500 0.1817931 1.1456477), wk = 0.0035461 k( 212) = ( 0.2265625 0.1643704 1.1647418), wk = 0.0035461 k( 213) = ( 0.2343750 0.1469477 1.1838360), wk = 0.0035461 k( 214) = ( 0.2421875 0.1295250 1.2029301), wk = 0.0035461 k( 215) = ( 0.2500000 0.1121023 1.2220242), wk = 0.0035461 k( 216) = ( 0.2500000 0.1121023 1.2220242), wk = 0.0035461 k( 217) = ( 0.2708333 0.1214442 1.2117862), wk = 0.0035461 k( 218) = ( 0.2916667 0.1307860 1.2015481), wk = 0.0035461 k( 219) = ( 0.3125000 0.1401279 1.1913101), wk = 0.0035461 k( 220) = ( 0.3333333 0.1494697 1.1810720), wk = 0.0035461 k( 221) = ( 0.3541667 0.1588116 1.1708339), wk = 0.0035461 k( 222) = ( 0.3750000 0.1681534 1.1605959), wk = 0.0035461 k( 223) = ( 0.3958333 0.1774953 1.1503578), wk = 0.0035461 k( 224) = ( 0.4166667 0.1868372 1.1401198), wk = 0.0035461 k( 225) = ( 0.4375000 0.1961790 1.1298817), wk = 0.0035461 k( 226) = ( 0.4583333 0.2055209 1.1196436), wk = 0.0035461 k( 227) = ( 0.4791667 0.2148627 1.1094056), wk = 0.0035461 k( 228) = ( 0.5000000 0.2242046 1.0991675), wk = 0.0035461 k( 229) = ( 0.5000000 0.2242046 1.0991675), wk = 0.0035461 k( 230) = ( 0.5000000 0.2242046 1.0723586), wk = 0.0035461 k( 231) = ( 0.5000000 0.2242046 1.0455496), wk = 0.0035461 k( 232) = ( 0.5000000 0.2242046 1.0187406), wk = 0.0035461 k( 233) = ( 0.5000000 0.2242046 0.9919317), wk = 0.0035461 k( 234) = ( 0.5000000 0.2242046 0.9651227), wk = 0.0035461 k( 235) = ( 0.5000000 0.2242046 0.9383137), wk = 0.0035461 k( 236) = ( 0.5000000 0.2242046 0.9115048), wk = 0.0035461 k( 237) = ( 0.5000000 0.2242046 0.8846958), wk = 0.0035461 k( 238) = ( 0.5000000 0.2242046 0.8578869), wk = 0.0035461 k( 239) = ( 0.5000000 0.2242046 0.8310779), wk = 0.0035461 k( 240) = ( 0.5000000 0.2242046 0.8042689), wk = 0.0035461 k( 241) = ( 0.5000000 0.2242046 0.7774600), wk = 0.0035461 k( 242) = ( 0.5000000 0.2242046 0.7506510), wk = 0.0035461 k( 243) = ( 0.5000000 0.2242046 0.7238420), wk = 0.0035461 k( 244) = ( 0.5000000 0.2242046 0.6970331), wk = 0.0035461 k( 245) = ( 0.5000000 0.2242046 0.6702241), wk = 0.0035461 k( 246) = ( 0.5000000 0.2242046 0.6434151), wk = 0.0035461 k( 247) = ( 0.5000000 0.2242046 0.6166062), wk = 0.0035461 k( 248) = ( 0.5000000 0.2242046 0.5897972), wk = 0.0035461 k( 249) = ( 0.5000000 0.2242046 0.5629882), wk = 0.0035461 k( 250) = ( 0.5000000 0.2242046 0.5361793), wk = 0.0035461 k( 251) = ( 0.5000000 0.2242046 0.5093703), wk = 0.0035461 k( 252) = ( 0.5000000 0.2242046 0.4825614), wk = 0.0035461 k( 253) = ( 0.5000000 0.2242046 0.4557524), wk = 0.0035461 k( 254) = ( 0.5000000 0.2242046 0.4289434), wk = 0.0035461 k( 255) = ( 0.5000000 0.2242046 0.4021345), wk = 0.0035461 k( 256) = ( 0.5000000 0.2242046 0.3753255), wk = 0.0035461 k( 257) = ( 0.5000000 0.2242046 0.3485165), wk = 0.0035461 k( 258) = ( 0.5000000 0.2242046 0.3217076), wk = 0.0035461 k( 259) = ( 0.5000000 0.2242046 0.2948986), wk = 0.0035461 k( 260) = ( 0.5000000 0.2242046 0.2680897), wk = 0.0035461 k( 261) = ( 0.5000000 0.2242046 0.2412807), wk = 0.0035461 k( 262) = ( 0.5000000 0.2242046 0.2144717), wk = 0.0035461 k( 263) = ( 0.5000000 0.2242046 0.1876627), wk = 0.0035461 k( 264) = ( 0.5000000 0.2242046 0.1608538), wk = 0.0035461 k( 265) = ( 0.5000000 0.2242046 0.1340448), wk = 0.0035461 k( 266) = ( 0.5000000 0.2242046 0.1072359), wk = 0.0035461 k( 267) = ( 0.5000000 0.2242046 0.0804269), wk = 0.0035461 k( 268) = ( 0.5000000 0.2242046 0.0536179), wk = 0.0035461 k( 269) = ( 0.5000000 0.2242046 0.0268090), wk = 0.0035461 k( 270) = ( 0.5000000 0.2242046 0.0000000), wk = 0.0035461 k( 271) = ( 0.0000000 0.0000000 1.2220242), wk = 0.0035461 k( 272) = ( 0.0227273 0.0101911 1.2220242), wk = 0.0035461 k( 273) = ( 0.0454546 0.0203822 1.2220242), wk = 0.0035461 k( 274) = ( 0.0681818 0.0305734 1.2220242), wk = 0.0035461 k( 275) = ( 0.0909091 0.0407645 1.2220242), wk = 0.0035461 k( 276) = ( 0.1136364 0.0509556 1.2220242), wk = 0.0035461 k( 277) = ( 0.1363636 0.0611467 1.2220242), wk = 0.0035461 k( 278) = ( 0.1590909 0.0713378 1.2220242), wk = 0.0035461 k( 279) = ( 0.1818182 0.0815289 1.2220242), wk = 0.0035461 k( 280) = ( 0.2045454 0.0917201 1.2220242), wk = 0.0035461 k( 281) = ( 0.2272727 0.1019112 1.2220242), wk = 0.0035461 k( 282) = ( 0.2500000 0.1121023 1.2220242), wk = 0.0035461 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0000000 0.0000000 0.0111111), wk = 0.0035461 k( 3) = ( 0.0000000 0.0000000 0.0222222), wk = 0.0035461 k( 4) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0035461 k( 5) = ( 0.0000000 0.0000000 0.0444444), wk = 0.0035461 k( 6) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0035461 k( 7) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0035461 k( 8) = ( 0.0000000 0.0000000 0.0777778), wk = 0.0035461 k( 9) = ( 0.0000000 0.0000000 0.0888889), wk = 0.0035461 k( 10) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0035461 k( 11) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0035461 k( 12) = ( 0.0000000 0.0000000 0.1222222), wk = 0.0035461 k( 13) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0035461 k( 14) = ( 0.0000000 0.0000000 0.1444444), wk = 0.0035461 k( 15) = ( 0.0000000 0.0000000 0.1555556), wk = 0.0035461 k( 16) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0035461 k( 17) = ( 0.0000000 0.0000000 0.1777778), wk = 0.0035461 k( 18) = ( 0.0000000 0.0000000 0.1888889), wk = 0.0035461 k( 19) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0035461 k( 20) = ( 0.0000000 0.0000000 0.2111111), wk = 0.0035461 k( 21) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0035461 k( 22) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0035461 k( 23) = ( 0.0000000 0.0000000 0.2444444), wk = 0.0035461 k( 24) = ( 0.0000000 0.0000000 0.2555556), wk = 0.0035461 k( 25) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0035461 k( 26) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0035461 k( 27) = ( 0.0000000 0.0000000 0.2888889), wk = 0.0035461 k( 28) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0035461 k( 29) = ( 0.0000000 0.0000000 0.3111111), wk = 0.0035461 k( 30) = ( 0.0000000 0.0000000 0.3222222), wk = 0.0035461 k( 31) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0035461 k( 32) = ( 0.0000000 0.0000000 0.3444444), wk = 0.0035461 k( 33) = ( 0.0000000 0.0000000 0.3555556), wk = 0.0035461 k( 34) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0035461 k( 35) = ( 0.0000000 0.0000000 0.3777778), wk = 0.0035461 k( 36) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0035461 k( 37) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0035461 k( 38) = ( 0.0000000 0.0000000 0.4111111), wk = 0.0035461 k( 39) = ( 0.0000000 0.0000000 0.4222222), wk = 0.0035461 k( 40) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0035461 k( 41) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0035461 k( 42) = ( 0.0000000 0.0000000 0.4555556), wk = 0.0035461 k( 43) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0035461 k( 44) = ( 0.0000000 0.0000000 0.4777778), wk = 0.0035461 k( 45) = ( 0.0000000 0.0000000 0.4888889), wk = 0.0035461 k( 46) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 47) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 48) = ( -0.0100535 0.0100535 0.5000000), wk = 0.0035461 k( 49) = ( -0.0201071 0.0201071 0.5000000), wk = 0.0035461 k( 50) = ( -0.0301606 0.0301606 0.5000000), wk = 0.0035461 k( 51) = ( -0.0402142 0.0402142 0.5000000), wk = 0.0035461 k( 52) = ( -0.0502677 0.0502677 0.5000000), wk = 0.0035461 k( 53) = ( -0.0502677 0.0502677 0.5000000), wk = 0.0035461 k( 54) = ( -0.0580217 0.0580217 0.4922460), wk = 0.0035461 k( 55) = ( -0.0657757 0.0657757 0.4844920), wk = 0.0035461 k( 56) = ( -0.0735297 0.0735297 0.4767380), wk = 0.0035461 k( 57) = ( -0.0812837 0.0812837 0.4689840), wk = 0.0035461 k( 58) = ( -0.0890377 0.0890377 0.4612300), wk = 0.0035461 k( 59) = ( -0.0967917 0.0967917 0.4534760), wk = 0.0035461 k( 60) = ( -0.1045457 0.1045457 0.4457220), wk = 0.0035461 k( 61) = ( -0.1122997 0.1122997 0.4379680), wk = 0.0035461 k( 62) = ( -0.1200537 0.1200537 0.4302140), wk = 0.0035461 k( 63) = ( -0.1278077 0.1278078 0.4224600), wk = 0.0035461 k( 64) = ( -0.1355618 0.1355618 0.4147059), wk = 0.0035461 k( 65) = ( -0.1433158 0.1433158 0.4069519), wk = 0.0035461 k( 66) = ( -0.1510698 0.1510698 0.3991979), wk = 0.0035461 k( 67) = ( -0.1588238 0.1588238 0.3914439), wk = 0.0035461 k( 68) = ( -0.1665778 0.1665778 0.3836899), wk = 0.0035461 k( 69) = ( -0.1743318 0.1743318 0.3759359), wk = 0.0035461 k( 70) = ( -0.1820858 0.1820858 0.3681819), wk = 0.0035461 k( 71) = ( -0.1898398 0.1898398 0.3604279), wk = 0.0035461 k( 72) = ( -0.1975938 0.1975938 0.3526739), wk = 0.0035461 k( 73) = ( -0.2053478 0.2053478 0.3449199), wk = 0.0035461 k( 74) = ( -0.2131018 0.2131018 0.3371659), wk = 0.0035461 k( 75) = ( -0.2208558 0.2208558 0.3294119), wk = 0.0035461 k( 76) = ( -0.2286098 0.2286098 0.3216579), wk = 0.0035461 k( 77) = ( -0.2363638 0.2363638 0.3139039), wk = 0.0035461 k( 78) = ( -0.2441178 0.2441178 0.3061499), wk = 0.0035461 k( 79) = ( -0.2518718 0.2518718 0.2983959), wk = 0.0035461 k( 80) = ( -0.2596258 0.2596258 0.2906419), wk = 0.0035461 k( 81) = ( -0.2673798 0.2673798 0.2828878), wk = 0.0035461 k( 82) = ( -0.2751339 0.2751339 0.2751338), wk = 0.0035461 k( 83) = ( -0.2751339 0.2751339 0.2751338), wk = 0.0035461 k( 84) = ( -0.2672729 0.2672729 0.2672729), wk = 0.0035461 k( 85) = ( -0.2594119 0.2594119 0.2594119), wk = 0.0035461 k( 86) = ( -0.2515509 0.2515509 0.2515509), wk = 0.0035461 k( 87) = ( -0.2436900 0.2436900 0.2436900), wk = 0.0035461 k( 88) = ( -0.2358290 0.2358290 0.2358290), wk = 0.0035461 k( 89) = ( -0.2279681 0.2279681 0.2279681), wk = 0.0035461 k( 90) = ( -0.2201071 0.2201071 0.2201071), wk = 0.0035461 k( 91) = ( -0.2122461 0.2122461 0.2122461), wk = 0.0035461 k( 92) = ( -0.2043851 0.2043851 0.2043851), wk = 0.0035461 k( 93) = ( -0.1965242 0.1965242 0.1965242), wk = 0.0035461 k( 94) = ( -0.1886632 0.1886632 0.1886632), wk = 0.0035461 k( 95) = ( -0.1808022 0.1808022 0.1808022), wk = 0.0035461 k( 96) = ( -0.1729413 0.1729413 0.1729413), wk = 0.0035461 k( 97) = ( -0.1650803 0.1650803 0.1650803), wk = 0.0035461 k( 98) = ( -0.1572193 0.1572193 0.1572193), wk = 0.0035461 k( 99) = ( -0.1493584 0.1493584 0.1493584), wk = 0.0035461 k( 100) = ( -0.1414974 0.1414974 0.1414974), wk = 0.0035461 k( 101) = ( -0.1336364 0.1336364 0.1336364), wk = 0.0035461 k( 102) = ( -0.1257755 0.1257755 0.1257755), wk = 0.0035461 k( 103) = ( -0.1179145 0.1179145 0.1179145), wk = 0.0035461 k( 104) = ( -0.1100535 0.1100535 0.1100535), wk = 0.0035461 k( 105) = ( -0.1021926 0.1021926 0.1021926), wk = 0.0035461 k( 106) = ( -0.0943316 0.0943316 0.0943316), wk = 0.0035461 k( 107) = ( -0.0864706 0.0864706 0.0864706), wk = 0.0035461 k( 108) = ( -0.0786097 0.0786097 0.0786097), wk = 0.0035461 k( 109) = ( -0.0707487 0.0707487 0.0707487), wk = 0.0035461 k( 110) = ( -0.0628877 0.0628877 0.0628877), wk = 0.0035461 k( 111) = ( -0.0550268 0.0550268 0.0550268), wk = 0.0035461 k( 112) = ( -0.0471658 0.0471658 0.0471658), wk = 0.0035461 k( 113) = ( -0.0393048 0.0393048 0.0393048), wk = 0.0035461 k( 114) = ( -0.0314439 0.0314439 0.0314439), wk = 0.0035461 k( 115) = ( -0.0235829 0.0235829 0.0235829), wk = 0.0035461 k( 116) = ( -0.0157219 0.0157219 0.0157219), wk = 0.0035461 k( 117) = ( -0.0078610 0.0078610 0.0078610), wk = 0.0035461 k( 118) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 120) = ( 0.0238095 0.0238095 -0.0238095), wk = 0.0035461 k( 121) = ( 0.0476191 0.0476191 -0.0476191), wk = 0.0035461 k( 122) = ( 0.0714286 0.0714286 -0.0714286), wk = 0.0035461 k( 123) = ( 0.0952381 0.0952381 -0.0952381), wk = 0.0035461 k( 124) = ( 0.1190476 0.1190476 -0.1190476), wk = 0.0035461 k( 125) = ( 0.1428571 0.1428571 -0.1428571), wk = 0.0035461 k( 126) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0035461 k( 127) = ( 0.1904762 0.1904762 -0.1904762), wk = 0.0035461 k( 128) = ( 0.2142857 0.2142857 -0.2142857), wk = 0.0035461 k( 129) = ( 0.2380952 0.2380952 -0.2380952), wk = 0.0035461 k( 130) = ( 0.2619048 0.2619048 -0.2619048), wk = 0.0035461 k( 131) = ( 0.2857143 0.2857143 -0.2857143), wk = 0.0035461 k( 132) = ( 0.3095238 0.3095238 -0.3095238), wk = 0.0035461 k( 133) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0035461 k( 134) = ( 0.3571429 0.3571429 -0.3571429), wk = 0.0035461 k( 135) = ( 0.3809524 0.3809524 -0.3809524), wk = 0.0035461 k( 136) = ( 0.4047619 0.4047619 -0.4047619), wk = 0.0035461 k( 137) = ( 0.4285714 0.4285714 -0.4285714), wk = 0.0035461 k( 138) = ( 0.4523810 0.4523810 -0.4523809), wk = 0.0035461 k( 139) = ( 0.4761905 0.4761905 -0.4761905), wk = 0.0035461 k( 140) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 141) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 142) = ( 0.4922460 0.5077540 -0.4922460), wk = 0.0035461 k( 143) = ( 0.4844920 0.5155080 -0.4844920), wk = 0.0035461 k( 144) = ( 0.4767380 0.5232620 -0.4767380), wk = 0.0035461 k( 145) = ( 0.4689840 0.5310160 -0.4689840), wk = 0.0035461 k( 146) = ( 0.4612300 0.5387700 -0.4612300), wk = 0.0035461 k( 147) = ( 0.4534760 0.5465240 -0.4534760), wk = 0.0035461 k( 148) = ( 0.4457220 0.5542780 -0.4457220), wk = 0.0035461 k( 149) = ( 0.4379680 0.5620320 -0.4379680), wk = 0.0035461 k( 150) = ( 0.4302140 0.5697861 -0.4302139), wk = 0.0035461 k( 151) = ( 0.4224599 0.5775400 -0.4224600), wk = 0.0035461 k( 152) = ( 0.4147059 0.5852941 -0.4147059), wk = 0.0035461 k( 153) = ( 0.4069519 0.5930481 -0.4069519), wk = 0.0035461 k( 154) = ( 0.3991979 0.6008021 -0.3991979), wk = 0.0035461 k( 155) = ( 0.3914439 0.6085561 -0.3914439), wk = 0.0035461 k( 156) = ( 0.3836899 0.6163101 -0.3836899), wk = 0.0035461 k( 157) = ( 0.3759359 0.6240641 -0.3759359), wk = 0.0035461 k( 158) = ( 0.3681819 0.6318181 -0.3681819), wk = 0.0035461 k( 159) = ( 0.3604279 0.6395721 -0.3604279), wk = 0.0035461 k( 160) = ( 0.3526739 0.6473261 -0.3526739), wk = 0.0035461 k( 161) = ( 0.3449199 0.6550801 -0.3449199), wk = 0.0035461 k( 162) = ( 0.3371659 0.6628341 -0.3371659), wk = 0.0035461 k( 163) = ( 0.3294119 0.6705881 -0.3294119), wk = 0.0035461 k( 164) = ( 0.3216579 0.6783421 -0.3216579), wk = 0.0035461 k( 165) = ( 0.3139039 0.6860961 -0.3139039), wk = 0.0035461 k( 166) = ( 0.3061499 0.6938501 -0.3061499), wk = 0.0035461 k( 167) = ( 0.2983959 0.7016041 -0.2983959), wk = 0.0035461 k( 168) = ( 0.2906419 0.7093581 -0.2906419), wk = 0.0035461 k( 169) = ( 0.2828878 0.7171121 -0.2828878), wk = 0.0035461 k( 170) = ( 0.2751339 0.7248661 -0.2751339), wk = 0.0035461 k( 171) = ( 0.2751339 0.7248661 -0.2751339), wk = 0.0035461 k( 172) = ( 0.2501217 0.7044238 -0.2501217), wk = 0.0035461 k( 173) = ( 0.2251095 0.6839814 -0.2251095), wk = 0.0035461 k( 174) = ( 0.2000973 0.6635390 -0.2000973), wk = 0.0035461 k( 175) = ( 0.1750852 0.6430966 -0.1750852), wk = 0.0035461 k( 176) = ( 0.1500730 0.6226543 -0.1500730), wk = 0.0035461 k( 177) = ( 0.1250608 0.6022119 -0.1250608), wk = 0.0035461 k( 178) = ( 0.1000487 0.5817695 -0.1000487), wk = 0.0035461 k( 179) = ( 0.0750365 0.5613271 -0.0750365), wk = 0.0035461 k( 180) = ( 0.0500243 0.5408848 -0.0500243), wk = 0.0035461 k( 181) = ( 0.0250122 0.5204424 -0.0250122), wk = 0.0035461 k( 182) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035461 k( 183) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035461 k( 184) = ( 0.0078125 0.4921875 0.0078125), wk = 0.0035461 k( 185) = ( 0.0156250 0.4843750 0.0156250), wk = 0.0035461 k( 186) = ( 0.0234375 0.4765625 0.0234375), wk = 0.0035461 k( 187) = ( 0.0312500 0.4687500 0.0312500), wk = 0.0035461 k( 188) = ( 0.0390625 0.4609375 0.0390625), wk = 0.0035461 k( 189) = ( 0.0468750 0.4531250 0.0468750), wk = 0.0035461 k( 190) = ( 0.0546875 0.4453125 0.0546875), wk = 0.0035461 k( 191) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0035461 k( 192) = ( 0.0703125 0.4296875 0.0703125), wk = 0.0035461 k( 193) = ( 0.0781250 0.4218750 0.0781250), wk = 0.0035461 k( 194) = ( 0.0859375 0.4140625 0.0859375), wk = 0.0035461 k( 195) = ( 0.0937500 0.4062500 0.0937500), wk = 0.0035461 k( 196) = ( 0.1015625 0.3984375 0.1015625), wk = 0.0035461 k( 197) = ( 0.1093750 0.3906250 0.1093750), wk = 0.0035461 k( 198) = ( 0.1171875 0.3828125 0.1171875), wk = 0.0035461 k( 199) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0035461 k( 200) = ( 0.1328125 0.3671875 0.1328125), wk = 0.0035461 k( 201) = ( 0.1406250 0.3593750 0.1406250), wk = 0.0035461 k( 202) = ( 0.1484375 0.3515625 0.1484375), wk = 0.0035461 k( 203) = ( 0.1562500 0.3437500 0.1562500), wk = 0.0035461 k( 204) = ( 0.1640625 0.3359375 0.1640625), wk = 0.0035461 k( 205) = ( 0.1718750 0.3281250 0.1718750), wk = 0.0035461 k( 206) = ( 0.1796875 0.3203125 0.1796875), wk = 0.0035461 k( 207) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0035461 k( 208) = ( 0.1953125 0.3046875 0.1953125), wk = 0.0035461 k( 209) = ( 0.2031250 0.2968750 0.2031250), wk = 0.0035461 k( 210) = ( 0.2109375 0.2890625 0.2109375), wk = 0.0035461 k( 211) = ( 0.2187500 0.2812500 0.2187500), wk = 0.0035461 k( 212) = ( 0.2265625 0.2734375 0.2265625), wk = 0.0035461 k( 213) = ( 0.2343750 0.2656250 0.2343750), wk = 0.0035461 k( 214) = ( 0.2421875 0.2578125 0.2421875), wk = 0.0035461 k( 215) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 k( 216) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 k( 217) = ( 0.2708333 0.2708333 0.2249777), wk = 0.0035461 k( 218) = ( 0.2916667 0.2916667 0.1999554), wk = 0.0035461 k( 219) = ( 0.3125000 0.3125000 0.1749331), wk = 0.0035461 k( 220) = ( 0.3333333 0.3333333 0.1499108), wk = 0.0035461 k( 221) = ( 0.3541667 0.3541667 0.1248885), wk = 0.0035461 k( 222) = ( 0.3750000 0.3750000 0.0998661), wk = 0.0035461 k( 223) = ( 0.3958333 0.3958333 0.0748438), wk = 0.0035461 k( 224) = ( 0.4166667 0.4166667 0.0498215), wk = 0.0035461 k( 225) = ( 0.4375000 0.4375000 0.0247992), wk = 0.0035461 k( 226) = ( 0.4583333 0.4583333 -0.0002231), wk = 0.0035461 k( 227) = ( 0.4791667 0.4791667 -0.0252454), wk = 0.0035461 k( 228) = ( 0.5000000 0.5000000 -0.0502677), wk = 0.0035461 k( 229) = ( 0.5000000 0.5000000 -0.0502677), wk = 0.0035461 k( 230) = ( 0.5000000 0.5000000 -0.0612368), wk = 0.0035461 k( 231) = ( 0.5000000 0.5000000 -0.0722059), wk = 0.0035461 k( 232) = ( 0.5000000 0.5000000 -0.0831749), wk = 0.0035461 k( 233) = ( 0.5000000 0.5000000 -0.0941440), wk = 0.0035461 k( 234) = ( 0.5000000 0.5000000 -0.1051131), wk = 0.0035461 k( 235) = ( 0.5000000 0.5000000 -0.1160822), wk = 0.0035461 k( 236) = ( 0.5000000 0.5000000 -0.1270513), wk = 0.0035461 k( 237) = ( 0.5000000 0.5000000 -0.1380203), wk = 0.0035461 k( 238) = ( 0.5000000 0.5000000 -0.1489894), wk = 0.0035461 k( 239) = ( 0.5000000 0.5000000 -0.1599585), wk = 0.0035461 k( 240) = ( 0.5000000 0.5000000 -0.1709276), wk = 0.0035461 k( 241) = ( 0.5000000 0.5000000 -0.1818967), wk = 0.0035461 k( 242) = ( 0.5000000 0.5000000 -0.1928657), wk = 0.0035461 k( 243) = ( 0.5000000 0.5000000 -0.2038348), wk = 0.0035461 k( 244) = ( 0.5000000 0.5000000 -0.2148039), wk = 0.0035461 k( 245) = ( 0.5000000 0.5000000 -0.2257730), wk = 0.0035461 k( 246) = ( 0.5000000 0.5000000 -0.2367421), wk = 0.0035461 k( 247) = ( 0.5000000 0.5000000 -0.2477111), wk = 0.0035461 k( 248) = ( 0.5000000 0.5000000 -0.2586802), wk = 0.0035461 k( 249) = ( 0.5000000 0.5000000 -0.2696493), wk = 0.0035461 k( 250) = ( 0.5000000 0.5000000 -0.2806184), wk = 0.0035461 k( 251) = ( 0.5000000 0.5000000 -0.2915875), wk = 0.0035461 k( 252) = ( 0.5000000 0.5000000 -0.3025565), wk = 0.0035461 k( 253) = ( 0.5000000 0.5000000 -0.3135256), wk = 0.0035461 k( 254) = ( 0.5000000 0.5000000 -0.3244947), wk = 0.0035461 k( 255) = ( 0.5000000 0.5000000 -0.3354638), wk = 0.0035461 k( 256) = ( 0.5000000 0.5000000 -0.3464329), wk = 0.0035461 k( 257) = ( 0.5000000 0.5000000 -0.3574019), wk = 0.0035461 k( 258) = ( 0.5000000 0.5000000 -0.3683710), wk = 0.0035461 k( 259) = ( 0.5000000 0.5000000 -0.3793401), wk = 0.0035461 k( 260) = ( 0.5000000 0.5000000 -0.3903092), wk = 0.0035461 k( 261) = ( 0.5000000 0.5000000 -0.4012783), wk = 0.0035461 k( 262) = ( 0.5000000 0.5000000 -0.4122474), wk = 0.0035461 k( 263) = ( 0.5000000 0.5000000 -0.4232164), wk = 0.0035461 k( 264) = ( 0.5000000 0.5000000 -0.4341855), wk = 0.0035461 k( 265) = ( 0.5000000 0.5000000 -0.4451546), wk = 0.0035461 k( 266) = ( 0.5000000 0.5000000 -0.4561237), wk = 0.0035461 k( 267) = ( 0.5000000 0.5000000 -0.4670928), wk = 0.0035461 k( 268) = ( 0.5000000 0.5000000 -0.4780618), wk = 0.0035461 k( 269) = ( 0.5000000 0.5000000 -0.4890309), wk = 0.0035461 k( 270) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 271) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 272) = ( 0.0227273 0.0227273 0.4772727), wk = 0.0035461 k( 273) = ( 0.0454546 0.0454546 0.4545455), wk = 0.0035461 k( 274) = ( 0.0681818 0.0681818 0.4318182), wk = 0.0035461 k( 275) = ( 0.0909091 0.0909091 0.4090909), wk = 0.0035461 k( 276) = ( 0.1136364 0.1136364 0.3863636), wk = 0.0035461 k( 277) = ( 0.1363636 0.1363636 0.3636364), wk = 0.0035461 k( 278) = ( 0.1590909 0.1590909 0.3409091), wk = 0.0035461 k( 279) = ( 0.1818182 0.1818182 0.3181818), wk = 0.0035461 k( 280) = ( 0.2045454 0.2045454 0.2954546), wk = 0.0035461 k( 281) = ( 0.2272727 0.2272727 0.2727273), wk = 0.0035461 k( 282) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 Dense grid: 164317 G-vectors FFT dimensions: ( 108, 108, 108) Smooth grid: 78475 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.57 Mb ( 552, 68) NL pseudopotentials 0.92 Mb ( 276, 218) Each V/rho on FFT grid 0.53 Mb ( 34992) Each G-vector array 0.03 Mb ( 4565) G-vector shells 0.02 Mb ( 2073) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.29 Mb ( 552, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.45 Mb ( 218, 2, 68) Check: negative/imaginary core charge= -0.000006 0.000000 The potential is recalculated from file : ./K2MgCl4.save/charge-density.dat Starting wfc are 74 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.1 secs Computing kpt #: 2 total cpu time spent up to now is 8.3 secs Computing kpt #: 3 total cpu time spent up to now is 10.5 secs Computing kpt #: 4 total cpu time spent up to now is 12.7 secs Computing kpt #: 5 total cpu time spent up to now is 14.9 secs Computing kpt #: 6 total cpu time spent up to now is 17.0 secs Computing kpt #: 7 total cpu time spent up to now is 19.3 secs Computing kpt #: 8 total cpu time spent up to now is 21.4 secs Computing kpt #: 9 total cpu time spent up to now is 23.6 secs Computing kpt #: 10 total cpu time spent up to now is 25.8 secs Computing kpt #: 11 total cpu time spent up to now is 28.0 secs Computing kpt #: 12 total cpu time spent up to now is 30.3 secs Computing kpt #: 13 total cpu time spent up to now is 32.5 secs Computing kpt #: 14 total cpu time spent up to now is 34.9 secs Computing kpt #: 15 total cpu time spent up to now is 37.3 secs Computing kpt #: 16 total cpu time spent up to now is 39.6 secs Computing kpt #: 17 total cpu time spent up to now is 42.3 secs Computing kpt #: 18 total cpu time spent up to now is 45.1 secs Computing kpt #: 19 total cpu time spent up to now is 47.4 secs Computing kpt #: 20 total cpu time spent up to now is 50.2 secs Computing kpt #: 21 total cpu time spent up to now is 52.5 secs Computing kpt #: 22 total cpu time spent up to now is 54.7 secs Computing kpt #: 23 total cpu time spent up to now is 56.9 secs Computing kpt #: 24 total cpu time spent up to now is 59.1 secs Computing kpt #: 25 total cpu time spent up to now is 61.3 secs Computing kpt #: 26 total cpu time spent up to now is 63.4 secs Computing kpt #: 27 total cpu time spent up to now is 65.3 secs Computing kpt #: 28 total cpu time spent up to now is 67.2 secs Computing kpt #: 29 total cpu time spent up to now is 69.1 secs Computing kpt #: 30 total cpu time spent up to now is 71.3 secs Computing kpt #: 31 total cpu time spent up to now is 73.5 secs Computing kpt #: 32 total cpu time spent up to now is 75.7 secs Computing kpt #: 33 total cpu time spent up to now is 78.0 secs Computing kpt #: 34 total cpu time spent up to now is 80.3 secs Computing kpt #: 35 total cpu time spent up to now is 82.5 secs Computing kpt #: 36 total cpu time spent up to now is 84.8 secs Computing kpt #: 37 total cpu time spent up to now is 87.0 secs Computing kpt #: 38 total cpu time spent up to now is 89.3 secs Computing kpt #: 39 total cpu time spent up to now is 91.5 secs Computing kpt #: 40 total cpu time spent up to now is 93.7 secs Computing kpt #: 41 total cpu time spent up to now is 96.0 secs Computing kpt #: 42 total cpu time spent up to now is 98.2 secs Computing kpt #: 43 total cpu time spent up to now is 100.5 secs Computing kpt #: 44 total cpu time spent up to now is 102.7 secs Computing kpt #: 45 total cpu time spent up to now is 104.9 secs Computing kpt #: 46 total cpu time spent up to now is 107.1 secs Computing kpt #: 47 total cpu time spent up to 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Computing kpt #: 63 total cpu time spent up to now is 145.0 secs Computing kpt #: 64 total cpu time spent up to now is 147.2 secs Computing kpt #: 65 total cpu time spent up to now is 149.6 secs Computing kpt #: 66 total cpu time spent up to now is 151.9 secs Computing kpt #: 67 total cpu time spent up to now is 154.2 secs Computing kpt #: 68 total cpu time spent up to now is 156.5 secs Computing kpt #: 69 total cpu time spent up to now is 158.7 secs Computing kpt #: 70 total cpu time spent up to now is 160.9 secs Computing kpt #: 71 total cpu time spent up to now is 163.2 secs Computing kpt #: 72 total cpu time spent up to now is 165.4 secs Computing kpt #: 73 total cpu time spent up to now is 167.7 secs Computing kpt #: 74 total cpu time spent up to now is 170.0 secs Computing kpt #: 75 total cpu time spent up to now is 172.2 secs Computing kpt #: 76 total cpu time spent up to now is 174.6 secs Computing kpt #: 77 total cpu time spent up to now is 177.0 secs Computing kpt #: 78 total cpu time spent up to now is 179.3 secs Computing kpt #: 79 total cpu time spent up to now is 181.8 secs Computing kpt #: 80 total cpu time spent up to now is 184.3 secs Computing kpt #: 81 total cpu time spent up to now is 187.1 secs Computing kpt #: 82 total cpu time spent up to now is 189.9 secs Computing kpt #: 83 total cpu time spent up to now is 192.7 secs Computing kpt #: 84 total cpu time spent up to now is 196.0 secs Computing kpt #: 85 total cpu time spent up to now is 200.6 secs Computing kpt #: 86 total cpu time spent up to now is 205.0 secs Computing kpt #: 87 total cpu time spent up to now is 208.6 secs Computing kpt #: 88 total cpu time spent up to now is 211.1 secs Computing kpt #: 89 total cpu time spent up to now is 213.5 secs Computing kpt #: 90 total cpu time spent up to now is 215.9 secs Computing kpt #: 91 total cpu time spent up to now is 218.3 secs Computing kpt #: 92 total cpu time spent up to now is 220.6 secs Computing kpt #: 93 total cpu time spent up to now is 222.9 secs Computing kpt #: 94 total cpu time spent up to now is 225.6 secs Computing kpt #: 95 total cpu time spent up to now is 228.0 secs Computing kpt #: 96 total cpu time spent up to now is 230.3 secs Computing kpt #: 97 total cpu time spent up to now is 232.6 secs Computing kpt #: 98 total cpu time spent up to now is 234.9 secs Computing kpt #: 99 total cpu time spent up to now is 237.1 secs Computing kpt #: 100 total cpu time spent up to now is 239.3 secs Computing kpt #: 101 total cpu time spent up to now is 241.6 secs Computing kpt #: 102 total cpu time spent up to now is 243.8 secs Computing kpt #: 103 total cpu time spent up to now is 246.1 secs Computing kpt #: 104 total cpu time spent up to now is 248.3 secs Computing kpt #: 105 total cpu time spent up to now is 250.8 secs Computing kpt #: 106 total cpu time spent up to now is 253.0 secs Computing kpt #: 107 total cpu time spent up to now is 255.3 secs Computing kpt #: 108 total cpu time spent up to now is 257.6 secs Computing kpt #: 109 total cpu time spent up to now is 259.9 secs Computing kpt #: 110 total cpu time spent up to now is 262.1 secs Computing kpt #: 111 total cpu time spent up to now is 264.4 secs Computing kpt #: 112 total cpu time spent up to now is 266.6 secs Computing kpt #: 113 total cpu time spent up to now is 268.9 secs Computing kpt #: 114 total cpu time spent up to now is 271.1 secs Computing kpt #: 115 total cpu time spent up to now is 273.9 secs Computing kpt #: 116 total cpu time spent up to now is 276.2 secs Computing kpt #: 117 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 280.7 secs Computing kpt #: 118 total cpu time spent up to now is 283.0 secs Computing kpt #: 119 total cpu time spent up to now is 285.2 secs Computing kpt #: 120 total cpu time spent up to now is 287.4 secs Computing kpt #: 121 total cpu time spent up to now is 289.6 secs Computing kpt #: 122 total cpu time spent up to now is 291.9 secs Computing kpt #: 123 total cpu time spent up to now is 294.2 secs Computing kpt #: 124 total cpu time spent up to now is 296.4 secs Computing kpt #: 125 total cpu time spent up to now is 298.6 secs Computing kpt #: 126 total cpu time spent up to now is 300.8 secs Computing kpt #: 127 total cpu time spent up to now is 302.9 secs Computing kpt #: 128 total cpu time spent up to now is 305.1 secs Computing kpt #: 129 total cpu time spent up to now is 307.2 secs Computing kpt #: 130 total cpu time spent up to now is 309.4 secs Computing kpt #: 131 total cpu time spent up to now is 311.6 secs Computing kpt #: 132 total cpu time spent up to now is 313.7 secs Computing kpt #: 133 total cpu time spent up to now is 315.9 secs Computing kpt #: 134 total cpu time spent up to now is 318.1 secs Computing kpt #: 135 total cpu time spent up to now is 320.2 secs Computing kpt #: 136 total cpu time spent up to now is 322.4 secs Computing kpt #: 137 total cpu time spent up to now is 324.6 secs Computing kpt #: 138 total cpu time spent up to now is 326.7 secs Computing kpt #: 139 total cpu time spent up to now is 328.9 secs Computing kpt #: 140 total cpu time spent up to now is 331.1 secs Computing kpt #: 141 total cpu time spent up to now is 333.3 secs Computing kpt #: 142 total cpu time spent up to now is 335.5 secs Computing kpt #: 143 total cpu time spent up to now is 337.7 secs Computing kpt #: 144 total cpu time spent up to now is 339.9 secs Computing kpt #: 145 total cpu time spent up to now is 342.1 secs Computing kpt #: 146 total cpu time spent up to now is 344.2 secs Computing kpt #: 147 total cpu time spent up to now is 346.4 secs Computing kpt #: 148 total cpu time spent up to now is 348.6 secs Computing kpt #: 149 total cpu time spent up to now is 350.9 secs Computing kpt #: 150 total cpu time spent up to now is 353.1 secs Computing kpt #: 151 total cpu time spent up to now is 355.3 secs Computing kpt #: 152 total cpu time spent up to now is 357.6 secs Computing kpt #: 153 total cpu time spent up to now is 359.9 secs Computing kpt #: 154 total cpu time spent up to now is 362.2 secs Computing kpt #: 155 total cpu time spent up to now is 364.4 secs Computing kpt #: 156 total cpu time spent up to now is 366.8 secs Computing kpt #: 157 total cpu time spent up to now is 369.1 secs Computing kpt #: 158 total cpu time spent up to now is 371.5 secs Computing kpt #: 159 total cpu time spent up to now is 374.3 secs Computing kpt #: 160 total cpu time spent up to now is 377.2 secs Computing kpt #: 161 total cpu time spent up to now is 380.1 secs Computing kpt #: 162 total cpu time spent up to now is 383.5 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 388.4 secs Computing kpt #: 164 total cpu time spent up to now is 391.4 secs Computing kpt #: 165 total cpu time spent up to now is 394.2 secs Computing kpt #: 166 total cpu time spent up to now is 397.0 secs Computing kpt #: 167 total cpu time spent up to now is 399.5 secs Computing kpt #: 168 total cpu time spent up to now is 401.9 secs Computing kpt #: 169 total cpu time spent up to now is 404.7 secs Computing kpt #: 170 total cpu time spent up to now is 407.6 secs Computing kpt #: 171 total cpu time spent up to now is 410.4 secs Computing kpt #: 172 total cpu time spent up to now is 413.2 secs Computing kpt #: 173 total cpu time spent up to now is 416.0 secs Computing kpt #: 174 total cpu time spent up to now is 418.8 secs Computing kpt #: 175 total cpu time spent up to now is 421.2 secs Computing kpt #: 176 total cpu time spent up to now is 423.6 secs Computing kpt #: 177 total cpu time spent up to now is 426.0 secs Computing kpt #: 178 total cpu time spent up to now is 428.7 secs Computing kpt #: 179 total cpu time spent up to now is 432.1 secs Computing kpt #: 180 total cpu time spent up to now is 435.7 secs Computing kpt #: 181 total cpu time spent up to now is 440.2 secs Computing kpt #: 182 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 444.9 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 449.8 secs Computing kpt #: 184 total cpu time spent up to now is 452.7 secs Computing kpt #: 185 total cpu time spent up to now is 455.0 secs Computing kpt #: 186 total cpu time spent up to now is 457.2 secs Computing kpt #: 187 total cpu time spent up to now is 459.5 secs Computing kpt #: 188 total cpu time spent up to now is 461.7 secs Computing kpt #: 189 total cpu time spent up to now is 463.9 secs Computing kpt #: 190 total cpu time spent up to now is 466.1 secs Computing kpt #: 191 total cpu time spent up to now is 468.4 secs Computing kpt #: 192 total cpu time spent up to now is 470.6 secs Computing kpt #: 193 total cpu time spent up to now is 472.9 secs Computing kpt #: 194 total cpu time spent up to now is 475.2 secs Computing kpt #: 195 total cpu time spent up to now is 477.4 secs Computing kpt #: 196 total cpu time spent up to now is 479.7 secs Computing kpt #: 197 total cpu time spent up to now is 482.0 secs Computing kpt #: 198 total cpu time spent up to now is 484.2 secs Computing kpt #: 199 total cpu time spent up to now is 486.5 secs Computing kpt #: 200 total cpu time spent up to now is 488.7 secs Computing kpt #: 201 total cpu time spent up to now is 491.0 secs Computing kpt #: 202 total cpu time spent up to now is 493.2 secs Computing kpt #: 203 total cpu time spent up to now is 495.4 secs Computing kpt #: 204 total cpu time spent up to now is 497.7 secs Computing kpt #: 205 total cpu time spent up to now is 499.6 secs Computing kpt #: 206 total cpu time spent up to now is 501.5 secs Computing kpt #: 207 total cpu time spent up to now is 503.4 secs Computing kpt #: 208 total cpu time spent up to now is 505.3 secs Computing kpt #: 209 total cpu time spent up to now is 507.2 secs Computing kpt #: 210 total cpu time spent up to now is 509.0 secs Computing kpt #: 211 total cpu time spent up to now is 510.9 secs Computing kpt #: 212 total cpu time spent up to now is 512.8 secs Computing kpt #: 213 total cpu time spent up to now is 514.7 secs Computing kpt #: 214 total cpu time spent up to now is 516.5 secs Computing kpt #: 215 total cpu time spent up to now is 518.4 secs Computing kpt #: 216 total cpu time spent up to now is 520.6 secs Computing kpt #: 217 total cpu time spent up to now is 522.9 secs Computing kpt #: 218 total cpu time spent up to now is 525.3 secs Computing kpt #: 219 total cpu time spent up to now is 527.7 secs Computing kpt #: 220 total cpu time spent up to now is 529.9 secs Computing kpt #: 221 total cpu time spent up to now is 532.1 secs Computing kpt #: 222 total cpu time spent up to now is 534.4 secs Computing kpt #: 223 total cpu time spent up to now is 536.7 secs Computing kpt #: 224 total cpu time spent up to now is 538.9 secs Computing kpt #: 225 total cpu time spent up to now is 541.1 secs Computing kpt #: 226 total cpu time spent up to now is 543.4 secs Computing kpt #: 227 total cpu time spent up to now is 545.6 secs Computing kpt #: 228 total cpu time spent up to now is 547.9 secs Computing kpt #: 229 total cpu time spent up to now is 550.1 secs Computing kpt #: 230 total cpu time spent up to now is 552.4 secs Computing kpt #: 231 total cpu time spent up to now is 554.6 secs Computing kpt #: 232 total cpu time spent up to now is 556.8 secs Computing kpt #: 233 total cpu time spent up to now is 559.1 secs Computing kpt #: 234 total cpu time spent up to now is 561.3 secs Computing kpt #: 235 total cpu time spent up to now is 563.5 secs Computing kpt #: 236 total cpu time spent up to now is 565.8 secs Computing kpt #: 237 total cpu time spent up to now is 568.0 secs Computing kpt #: 238 total cpu time spent up to now is 570.2 secs Computing kpt #: 239 total cpu time spent up to now is 572.9 secs Computing kpt #: 240 total cpu time spent up to now is 575.2 secs Computing kpt #: 241 total cpu time spent up to now is 577.5 secs Computing kpt #: 242 total cpu time spent up to now is 579.8 secs Computing kpt #: 243 total cpu time spent up to now is 582.0 secs Computing kpt #: 244 total cpu time spent up to now is 584.3 secs Computing kpt #: 245 total cpu time spent up to now is 586.5 secs Computing kpt #: 246 total cpu time spent up to now is 588.7 secs Computing kpt #: 247 total cpu time spent up to now is 591.0 secs Computing kpt #: 248 total cpu time spent up to now is 593.3 secs Computing kpt #: 249 total cpu time spent up to now is 595.6 secs Computing kpt #: 250 total cpu time spent up to now is 597.9 secs Computing kpt #: 251 total cpu time spent up to now is 600.1 secs Computing kpt #: 252 total cpu time spent up to now is 602.4 secs Computing kpt #: 253 total cpu time spent up to now is 604.8 secs Computing kpt #: 254 total cpu time spent up to now is 607.1 secs Computing kpt #: 255 total cpu time spent up to now is 609.5 secs Computing kpt #: 256 total cpu time spent up to now is 611.8 secs Computing kpt #: 257 total cpu time spent up to now is 614.0 secs Computing kpt #: 258 total cpu time spent up to now is 616.3 secs Computing kpt #: 259 total cpu time spent up to now is 618.5 secs Computing kpt #: 260 total cpu time spent up to now is 620.7 secs Computing kpt #: 261 total cpu time spent up to now is 622.9 secs Computing kpt #: 262 total cpu time spent up to now is 625.1 secs Computing kpt #: 263 total cpu time spent up to now is 627.3 secs Computing kpt #: 264 total cpu time spent up to now is 629.4 secs Computing kpt #: 265 total cpu time spent up to now is 631.6 secs Computing kpt #: 266 total cpu time spent up to now is 633.7 secs Computing kpt #: 267 total cpu time spent up to now is 635.9 secs Computing kpt #: 268 total cpu time spent up to now is 638.1 secs Computing kpt #: 269 total cpu time spent up to now is 640.3 secs Computing kpt #: 270 total cpu time spent up to now is 642.6 secs Computing kpt #: 271 total cpu time spent up to now is 644.8 secs Computing kpt #: 272 total cpu time spent up to now is 647.0 secs Computing kpt #: 273 total cpu time spent up to now is 649.2 secs Computing kpt #: 274 total cpu time spent up to now is 651.5 secs Computing kpt #: 275 total cpu time spent up to now is 653.7 secs Computing kpt #: 276 total cpu time spent up to now is 656.0 secs Computing kpt #: 277 total cpu time spent up to now is 658.3 secs Computing kpt #: 278 total cpu time spent up to now is 660.5 secs Computing kpt #: 279 total cpu time spent up to now is 662.7 secs Computing kpt #: 280 total cpu time spent up to now is 664.9 secs Computing kpt #: 281 total cpu time spent up to now is 667.1 secs Computing kpt #: 282 total cpu time spent up to now is 669.0 secs ethr = 1.79E-08, avg # of iterations = 30.6 total cpu time spent up to now is 669.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9863 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9101 -11.9101 -11.1589 -11.1589 -10.7885 -10.7885 -10.7770 -10.7770 -9.6532 -9.6532 -9.6430 -9.6430 -9.4070 -9.4070 -9.4018 -9.4018 -9.3732 -9.3732 -9.3396 -9.3396 -1.1720 -1.1720 -1.1303 -1.1303 -0.5229 -0.5229 0.0879 0.0879 0.7643 0.7643 0.9649 0.9649 0.9893 0.9893 1.0317 1.0317 1.0620 1.0620 1.3427 1.3427 1.4701 1.4701 1.5156 1.5156 6.6575 6.6575 7.7284 7.7284 8.9020 8.9020 9.1933 9.1933 9.3884 9.3884 9.5279 9.5288 k = 0.0000 0.0000 0.0272 ( 9851 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9097 -11.9097 -11.1594 -11.1594 -10.7885 -10.7885 -10.7771 -10.7771 -9.6531 -9.6531 -9.6430 -9.6430 -9.4070 -9.4070 -9.4017 -9.4017 -9.3732 -9.3732 -9.3397 -9.3397 -1.1722 -1.1722 -1.1304 -1.1304 -0.5227 -0.5227 0.0893 0.0893 0.7606 0.7606 0.9638 0.9638 0.9907 0.9907 1.0307 1.0307 1.0631 1.0631 1.3428 1.3428 1.4693 1.4693 1.5146 1.5146 6.6613 6.6613 7.7309 7.7309 8.9044 8.9044 9.1889 9.1889 9.3914 9.3914 9.5257 9.5257 k = 0.0000 0.0000 0.0543 ( 9847 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9084 -11.9084 -11.1607 -11.1607 -10.7887 -10.7887 -10.7774 -10.7774 -9.6530 -9.6530 -9.6428 -9.6428 -9.4069 -9.4069 -9.4014 -9.4014 -9.3730 -9.3730 -9.3399 -9.3399 -1.1738 -1.1738 -1.1295 -1.1295 -0.5222 -0.5222 0.0935 0.0935 0.7502 0.7502 0.9601 0.9601 0.9940 0.9940 1.0282 1.0282 1.0668 1.0668 1.3432 1.3432 1.4670 1.4670 1.5116 1.5116 6.6727 6.6727 7.7385 7.7385 8.9116 8.9116 9.1767 9.1767 9.4004 9.4004 9.5209 9.5209 k = 0.0000 0.0000 0.0815 ( 9851 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9063 -11.9063 -11.1628 -11.1628 -10.7889 -10.7889 -10.7780 -10.7780 -9.6527 -9.6527 -9.6426 -9.6426 -9.4068 -9.4068 -9.4010 -9.4010 -9.3727 -9.3727 -9.3401 -9.3401 -1.1793 -1.1793 -1.1251 -1.1251 -0.5213 -0.5213 0.1003 0.1003 0.7342 0.7342 0.9530 0.9530 0.9971 0.9971 1.0251 1.0251 1.0739 1.0739 1.3436 1.3436 1.4630 1.4630 1.5071 1.5071 6.6916 6.6916 7.7512 7.7512 8.9233 8.9233 9.1596 9.1596 9.4156 9.4156 9.5178 9.5178 k = 0.0000 0.0000 0.1086 ( 9845 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9033 -11.9033 -11.1658 -11.1658 -10.7893 -10.7893 -10.7787 -10.7787 -9.6523 -9.6523 -9.6423 -9.6423 -9.4066 -9.4066 -9.4003 -9.4003 -9.3724 -9.3724 -9.3405 -9.3405 -1.1901 -1.1901 -1.1157 -1.1157 -0.5200 -0.5200 0.1094 0.1094 0.7142 0.7142 0.9410 0.9410 0.9985 0.9985 1.0225 1.0225 1.0850 1.0850 1.3440 1.3440 1.4570 1.4570 1.5017 1.5017 6.7178 6.7178 7.7686 7.7686 8.9394 8.9394 9.1401 9.1401 9.4369 9.4369 9.5178 9.5178 k = 0.0000 0.0000 0.1358 ( 9853 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0016 -26.0016 -11.8994 -11.8994 -11.1696 -11.1696 -10.7897 -10.7897 -10.7796 -10.7796 -9.6519 -9.6519 -9.6419 -9.6419 -9.4064 -9.4064 -9.3995 -9.3995 -9.3719 -9.3719 -9.3410 -9.3410 -1.2058 -1.2058 -1.1014 -1.1014 -0.5184 -0.5184 0.1206 0.1206 0.6913 0.6913 0.9238 0.9238 0.9974 0.9974 1.0213 1.0213 1.0996 1.0996 1.3438 1.3438 1.4491 1.4491 1.4960 1.4960 6.7511 6.7511 7.7908 7.7908 8.9596 8.9596 9.1202 9.1202 9.4646 9.4646 9.5217 9.5217 k = 0.0000 0.0000 0.1629 ( 9841 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0016 -26.0016 -11.8947 -11.8947 -11.1742 -11.1742 -10.7903 -10.7903 -10.7807 -10.7807 -9.6514 -9.6514 -9.6415 -9.6415 -9.4062 -9.4062 -9.3986 -9.3986 -9.3714 -9.3714 -9.3417 -9.3417 -1.2257 -1.2257 -1.0827 -1.0827 -0.5163 -0.5163 0.1334 0.1334 0.6663 0.6663 0.9012 0.9012 0.9937 0.9937 1.0221 1.0221 1.1168 1.1168 1.3425 1.3425 1.4397 1.4397 1.4905 1.4905 6.7910 6.7910 7.8175 7.8175 8.9834 8.9834 9.1012 9.1012 9.4989 9.4989 9.5295 9.5295 k = 0.0000 0.0000 0.1901 ( 9842 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0016 -26.0016 -11.8892 -11.8892 -11.1795 -11.1795 -10.7908 -10.7908 -10.7820 -10.7820 -9.6509 -9.6509 -9.6410 -9.6410 -9.4059 -9.4059 -9.3975 -9.3975 -9.3708 -9.3708 -9.3424 -9.3424 -1.2491 -1.2491 -1.0601 -1.0601 -0.5138 -0.5138 0.1473 0.1473 0.6399 0.6399 0.8741 0.8741 0.9878 0.9878 1.0248 1.0248 1.1354 1.1354 1.3392 1.3392 1.4300 1.4300 1.4853 1.4853 6.8374 6.8374 7.8484 7.8484 9.0105 9.0105 9.0838 9.0838 9.5388 9.5388 9.5420 9.5420 k = 0.0000 0.0000 0.2172 ( 9846 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0016 -26.0016 -11.8830 -11.8830 -11.1856 -11.1856 -10.7915 -10.7915 -10.7833 -10.7833 -9.6503 -9.6503 -9.6404 -9.6404 -9.4057 -9.4057 -9.3963 -9.3963 -9.3702 -9.3702 -9.3431 -9.3431 -1.2755 -1.2755 -1.0338 -1.0338 -0.5109 -0.5109 0.1618 0.1618 0.6126 0.6126 0.8432 0.8432 0.9801 0.9801 1.0291 1.0291 1.1549 1.1549 1.3326 1.3326 1.4213 1.4213 1.4803 1.4803 6.8897 6.8897 7.8832 7.8832 9.0405 9.0405 9.0687 9.0687 9.5564 9.5564 9.5874 9.5874 k = 0.0000 0.0000 0.2444 ( 9846 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0052 -26.0052 -26.0016 -26.0016 -11.8759 -11.8759 -11.1924 -11.1924 -10.7922 -10.7922 -10.7848 -10.7848 -9.6497 -9.6497 -9.6398 -9.6398 -9.4054 -9.4054 -9.3950 -9.3950 -9.3695 -9.3695 -9.3440 -9.3440 -1.3045 -1.3045 -1.0042 -1.0042 -0.5074 -0.5074 0.1761 0.1761 0.5847 0.5847 0.8095 0.8095 0.9710 0.9710 1.0348 1.0348 1.1745 1.1745 1.3220 1.3220 1.4150 1.4150 1.4756 1.4756 6.9476 6.9476 7.9217 7.9217 9.0560 9.0560 9.0732 9.0732 9.5755 9.5755 9.6414 9.6414 k = 0.0000 0.0000 0.2716 ( 9842 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0052 -26.0052 -26.0016 -26.0016 -11.8680 -11.8680 -11.1998 -11.1998 -10.7929 -10.7929 -10.7863 -10.7863 -9.6492 -9.6492 -9.6392 -9.6392 -9.4052 -9.4052 -9.3936 -9.3936 -9.3689 -9.3689 -9.3449 -9.3449 -1.3358 -1.3358 -0.9712 -0.9712 -0.5034 -0.5034 0.1894 0.1894 0.5565 0.5565 0.7741 0.7741 0.9609 0.9609 1.0416 1.0416 1.1940 1.1940 1.3073 1.3073 1.4114 1.4114 1.4711 1.4711 7.0106 7.0106 7.9635 7.9635 9.0459 9.0459 9.1081 9.1081 9.5978 9.5978 9.7018 9.7018 k = 0.0000 0.0000 0.2987 ( 9854 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0051 -26.0051 -26.0016 -26.0016 -11.8595 -11.8595 -11.2079 -11.2079 -10.7936 -10.7936 -10.7878 -10.7878 -9.6487 -9.6487 -9.6385 -9.6385 -9.4049 -9.4049 -9.3922 -9.3922 -9.3683 -9.3683 -9.3459 -9.3459 -1.3690 -1.3690 -0.9350 -0.9350 -0.4989 -0.4989 0.2007 0.2007 0.5280 0.5280 0.7384 0.7384 0.9498 0.9498 1.0495 1.0495 1.2131 1.2131 1.2892 1.2892 1.4098 1.4098 1.4672 1.4672 7.0784 7.0784 8.0082 8.0082 9.0386 9.0386 9.1452 9.1452 9.6230 9.6230 9.7645 9.7646 k = 0.0000 0.0000 0.3259 ( 9856 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0050 -26.0050 -26.0016 -26.0016 -11.8502 -11.8502 -11.2165 -11.2165 -10.7944 -10.7944 -10.7894 -10.7894 -9.6484 -9.6484 -9.6378 -9.6378 -9.4047 -9.4047 -9.3907 -9.3907 -9.3678 -9.3678 -9.3468 -9.3468 -1.4038 -1.4038 -0.8959 -0.8959 -0.4938 -0.4938 0.2086 0.2086 0.4995 0.4995 0.7038 0.7038 0.9379 0.9379 1.0583 1.0583 1.2312 1.2312 1.2691 1.2691 1.4093 1.4093 1.4639 1.4639 7.1505 7.1505 8.0555 8.0555 9.0340 9.0340 9.1844 9.1844 9.6507 9.6507 9.8064 9.8064 k = 0.0000 0.0000 0.3530 ( 9856 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0050 -26.0050 -26.0016 -26.0016 -11.8402 -11.8402 -11.2256 -11.2256 -10.7951 -10.7951 -10.7909 -10.7909 -9.6481 -9.6481 -9.6370 -9.6370 -9.4046 -9.4046 -9.3892 -9.3892 -9.3674 -9.3674 -9.3478 -9.3478 -1.4401 -1.4401 -0.8540 -0.8540 -0.4880 -0.4880 0.2116 0.2116 0.4710 0.4710 0.6725 0.6725 0.9253 0.9253 1.0680 1.0680 1.2414 1.2414 1.2546 1.2546 1.4088 1.4088 1.4618 1.4618 7.2265 7.2265 8.1049 8.1049 9.0321 9.0321 9.2254 9.2254 9.6801 9.6801 9.8512 9.8512 k = 0.0000 0.0000 0.3802 ( 9844 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0049 -26.0049 -26.0015 -26.0015 -11.8296 -11.8296 -11.2352 -11.2352 -10.7959 -10.7959 -10.7923 -10.7923 -9.6480 -9.6480 -9.6363 -9.6363 -9.4045 -9.4045 -9.3878 -9.3878 -9.3672 -9.3672 -9.3487 -9.3487 -1.4776 -1.4776 -0.8093 -0.8093 -0.4815 -0.4815 0.2079 0.2079 0.4425 0.4425 0.6465 0.6465 0.9121 0.9121 1.0787 1.0787 1.2218 1.2218 1.2684 1.2684 1.4074 1.4074 1.4614 1.4614 7.3061 7.3061 8.1562 8.1562 9.0328 9.0328 9.2685 9.2685 9.7107 9.7107 9.8988 9.8988 k = 0.0000 0.0000 0.4073 ( 9832 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0048 -26.0048 -26.0015 -26.0015 -11.8184 -11.8184 -11.2451 -11.2451 -10.7967 -10.7967 -10.7937 -10.7937 -9.6480 -9.6480 -9.6355 -9.6355 -9.4045 -9.4045 -9.3863 -9.3863 -9.3673 -9.3673 -9.3494 -9.3494 -1.5160 -1.5160 -0.7622 -0.7622 -0.4742 -0.4742 0.1962 0.1962 0.4141 0.4141 0.6276 0.6276 0.8983 0.8983 1.0901 1.0901 1.1985 1.1985 1.2844 1.2844 1.4047 1.4047 1.4630 1.4630 7.3888 7.3888 8.2087 8.2087 9.0361 9.0361 9.3134 9.3134 9.7414 9.7414 9.9492 9.9492 k = 0.0000 0.0000 0.4345 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0047 -26.0047 -26.0015 -26.0015 -11.8066 -11.8066 -11.2555 -11.2555 -10.7975 -10.7975 -10.7948 -10.7948 -9.6482 -9.6482 -9.6347 -9.6347 -9.4045 -9.4045 -9.3849 -9.3849 -9.3676 -9.3676 -9.3501 -9.3501 -1.5553 -1.5553 -0.7128 -0.7128 -0.4662 -0.4662 0.1757 0.1757 0.3859 0.3859 0.6168 0.6168 0.8840 0.8840 1.1025 1.1025 1.1749 1.1749 1.2999 1.2999 1.4003 1.4003 1.4665 1.4665 7.4744 7.4744 8.2619 8.2619 9.0417 9.0417 9.3603 9.3603 9.7713 9.7713 10.0020 10.0020 k = 0.0000 0.0000 0.4617 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0046 -26.0046 -26.0015 -26.0015 -11.7942 -11.7942 -11.2661 -11.2661 -10.7982 -10.7982 -10.7959 -10.7959 -9.6485 -9.6485 -9.6339 -9.6339 -9.4047 -9.4047 -9.3835 -9.3835 -9.3683 -9.3683 -9.3506 -9.3506 -1.5952 -1.5952 -0.6613 -0.6613 -0.4573 -0.4573 0.1470 0.1470 0.3579 0.3579 0.6137 0.6137 0.8691 0.8691 1.1157 1.1157 1.1513 1.1513 1.3146 1.3146 1.3946 1.3946 1.4718 1.4718 7.5624 7.5624 8.3155 8.3155 9.0496 9.0496 9.4091 9.4091 9.7990 9.7990 10.0569 10.0569 k = 0.0000 0.0000 0.4888 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0045 -26.0045 -26.0015 -26.0015 -11.7814 -11.7814 -11.2769 -11.2769 -10.7990 -10.7990 -10.7967 -10.7967 -9.6490 -9.6490 -9.6332 -9.6332 -9.4049 -9.4049 -9.3822 -9.3822 -9.3693 -9.3693 -9.3510 -9.3510 -1.6355 -1.6355 -0.6080 -0.6080 -0.4476 -0.4476 0.1113 0.1113 0.3306 0.3306 0.6173 0.6173 0.8538 0.8538 1.1276 1.1276 1.1300 1.1300 1.3284 1.3284 1.3878 1.3878 1.4784 1.4784 7.6526 7.6526 8.3686 8.3686 9.0596 9.0596 9.4598 9.4598 9.8233 9.8233 10.1137 10.1137 k = 0.0000 0.0000 0.5160 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0044 -26.0044 -26.0015 -26.0015 -11.7681 -11.7681 -11.2880 -11.2880 -10.7997 -10.7997 -10.7974 -10.7974 -9.6497 -9.6497 -9.6324 -9.6324 -9.4052 -9.4052 -9.3810 -9.3810 -9.3705 -9.3705 -9.3514 -9.3514 -1.6762 -1.6762 -0.5533 -0.5533 -0.4367 -0.4367 0.0704 0.0704 0.3039 0.3039 0.6261 0.6261 0.8380 0.8380 1.1051 1.1051 1.1445 1.1445 1.3414 1.3414 1.3800 1.3800 1.4862 1.4862 7.7447 7.7447 8.4208 8.4208 9.0714 9.0714 9.5123 9.5123 9.8425 9.8425 10.1719 10.1719 k = 0.0000 0.0000 0.5431 ( 9802 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0044 -26.0044 -26.0015 -26.0015 -11.7544 -11.7544 -11.2991 -11.2991 -10.8003 -10.8003 -10.7980 -10.7980 -9.6505 -9.6505 -9.6318 -9.6318 -9.4057 -9.4057 -9.3799 -9.3799 -9.3720 -9.3720 -9.3517 -9.3517 -1.7171 -1.7171 -0.4979 -0.4979 -0.4242 -0.4242 0.0259 0.0259 0.2780 0.2780 0.6385 0.6385 0.8218 0.8218 1.0829 1.0829 1.1602 1.1602 1.3536 1.3536 1.3716 1.3716 1.4949 1.4949 7.8384 7.8384 8.4714 8.4714 9.0848 9.0848 9.5666 9.5666 9.8551 9.8551 10.2166 10.2166 k = 0.0000 0.0000 0.5703 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0043 -26.0043 -26.0015 -26.0015 -11.7404 -11.7404 -11.3103 -11.3103 -10.8008 -10.8008 -10.7985 -10.7985 -9.6515 -9.6515 -9.6312 -9.6312 -9.4062 -9.4062 -9.3789 -9.3789 -9.3737 -9.3737 -9.3520 -9.3520 -1.7580 -1.7580 -0.4446 -0.4446 -0.4077 -0.4077 -0.0206 -0.0206 0.2529 0.2529 0.6535 0.6535 0.8052 0.8052 1.0615 1.0615 1.1766 1.1766 1.3626 1.3626 1.3649 1.3649 1.5044 1.5044 7.9334 7.9334 8.5196 8.5196 9.0998 9.0998 9.6223 9.6223 9.8598 9.8598 10.2151 10.2151 k = 0.0000 0.0000 0.5974 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0042 -26.0042 -26.0014 -26.0014 -11.7260 -11.7260 -11.3215 -11.3215 -10.8012 -10.8012 -10.7989 -10.7989 -9.6526 -9.6526 -9.6307 -9.6307 -9.4069 -9.4069 -9.3780 -9.3780 -9.3755 -9.3755 -9.3524 -9.3524 -1.7988 -1.7988 -0.4097 -0.4097 -0.3712 -0.3712 -0.0680 -0.0680 0.2286 0.2286 0.6700 0.6700 0.7883 0.7883 1.0410 1.0410 1.1939 1.1939 1.3531 1.3531 1.3754 1.3754 1.5146 1.5146 8.0296 8.0296 8.5647 8.5647 9.1159 9.1159 9.6791 9.6791 9.8550 9.8550 10.2025 10.2025 k = 0.0000 0.0000 0.6246 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0041 -26.0041 -26.0014 -26.0014 -11.7114 -11.7114 -11.3327 -11.3327 -10.8014 -10.8014 -10.7992 -10.7992 -9.6539 -9.6539 -9.6302 -9.6302 -9.4076 -9.4076 -9.3777 -9.3777 -9.3770 -9.3770 -9.3528 -9.3528 -1.8394 -1.8394 -0.3918 -0.3918 -0.3167 -0.3167 -0.1149 -0.1149 0.2052 0.2052 0.6871 0.6871 0.7713 0.7713 1.0214 1.0214 1.2119 1.2119 1.3432 1.3432 1.3852 1.3852 1.5254 1.5254 8.1267 8.1267 8.6060 8.6060 9.1331 9.1331 9.7365 9.7365 9.8397 9.8397 10.1811 10.1811 k = 0.0000 0.0000 0.6517 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0040 -26.0040 -26.0014 -26.0014 -11.6967 -11.6967 -11.3438 -11.3438 -10.8015 -10.8015 -10.7994 -10.7994 -9.6553 -9.6553 -9.6299 -9.6299 -9.4085 -9.4085 -9.3797 -9.3797 -9.3764 -9.3764 -9.3533 -9.3533 -1.8796 -1.8796 -0.3761 -0.3761 -0.2616 -0.2616 -0.1586 -0.1586 0.1827 0.1827 0.7036 0.7036 0.7551 0.7551 1.0029 1.0029 1.2307 1.2307 1.3328 1.3328 1.3942 1.3942 1.5367 1.5367 8.2244 8.2244 8.6428 8.6428 9.1510 9.1510 9.7937 9.7937 9.8135 9.8135 10.1543 10.1543 k = 0.0000 0.0000 0.6789 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0039 -26.0039 -26.0014 -26.0014 -11.6818 -11.6818 -11.3547 -11.3547 -10.8016 -10.8016 -10.7995 -10.7995 -9.6568 -9.6568 -9.6296 -9.6296 -9.4095 -9.4095 -9.3818 -9.3818 -9.3757 -9.3757 -9.3540 -9.3540 -1.9193 -1.9193 -0.3604 -0.3604 -0.2318 -0.2318 -0.1750 -0.1750 0.1612 0.1612 0.7142 0.7142 0.7444 0.7444 0.9855 0.9855 1.2502 1.2502 1.3221 1.3221 1.4025 1.4025 1.5485 1.5485 8.3225 8.3225 8.6746 8.6746 9.1694 9.1694 9.7754 9.7754 9.8509 9.8509 10.1253 10.1253 k = 0.0000 0.0000 0.7061 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0038 -26.0038 -26.0014 -26.0014 -11.6669 -11.6669 -11.3655 -11.3655 -10.8017 -10.8017 -10.7993 -10.7993 -9.6584 -9.6584 -9.6294 -9.6294 -9.4106 -9.4106 -9.3840 -9.3840 -9.3752 -9.3752 -9.3547 -9.3547 -1.9583 -1.9583 -0.3450 -0.3450 -0.2623 -0.2623 -0.1289 -0.1289 0.1407 0.1407 0.7066 0.7066 0.7513 0.7513 0.9693 0.9693 1.2703 1.2703 1.3112 1.3112 1.4102 1.4102 1.5606 1.5606 8.4210 8.4210 8.7008 8.7008 9.1882 9.1882 9.7279 9.7279 9.9061 9.9061 10.0964 10.0964 k = 0.0000 0.0000 0.7332 ( 9800 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0037 -26.0037 -26.0014 -26.0014 -11.6520 -11.6520 -11.3760 -11.3760 -10.8019 -10.8019 -10.7989 -10.7989 -9.6600 -9.6600 -9.6293 -9.6293 -9.4118 -9.4118 -9.3863 -9.3863 -9.3748 -9.3748 -9.3555 -9.3555 -1.9965 -1.9965 -0.3349 -0.3349 -0.2964 -0.2964 -0.0723 -0.0723 0.1215 0.1215 0.6897 0.6897 0.7667 0.7667 0.9543 0.9543 1.2904 1.2904 1.3004 1.3004 1.4173 1.4173 1.5732 1.5732 8.5195 8.5195 8.7215 8.7215 9.2070 9.2070 9.6723 9.6723 9.9593 9.9593 10.0686 10.0686 k = 0.0000 0.0000 0.7604 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0036 -26.0036 -26.0014 -26.0014 -11.6372 -11.6372 -11.3861 -11.3861 -10.8022 -10.8022 -10.7982 -10.7982 -9.6618 -9.6618 -9.6293 -9.6293 -9.4131 -9.4131 -9.3885 -9.3885 -9.3745 -9.3745 -9.3564 -9.3564 -2.0338 -2.0338 -0.3553 -0.3553 -0.2988 -0.2988 -0.0159 -0.0159 0.1043 0.1043 0.6706 0.6706 0.7830 0.7830 0.9408 0.9408 1.2877 1.2877 1.3128 1.3128 1.4238 1.4238 1.5859 1.5859 8.6178 8.6178 8.7364 8.7364 9.2258 9.2258 9.6108 9.6108 10.0102 10.0102 10.0420 10.0420 k = 0.0000 0.0000 0.7875 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0014 -26.0014 -11.6226 -11.6226 -11.3960 -11.3960 -10.8026 -10.8026 -10.7974 -10.7974 -9.6636 -9.6636 -9.6293 -9.6293 -9.4144 -9.4144 -9.3908 -9.3908 -9.3743 -9.3743 -9.3574 -9.3574 -2.0700 -2.0700 -0.3918 -0.3918 -0.2828 -0.2828 0.0351 0.0351 0.0928 0.0928 0.6506 0.6506 0.7988 0.7988 0.9289 0.9289 1.2760 1.2760 1.3342 1.3342 1.4299 1.4299 1.5988 1.5988 8.7156 8.7156 8.7461 8.7461 9.2443 9.2443 9.5457 9.5457 10.0163 10.0163 10.0591 10.0591 k = 0.0000 0.0000 0.8147 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0034 -26.0034 -26.0013 -26.0013 -11.6083 -11.6083 -11.4055 -11.4055 -10.8030 -10.8030 -10.7964 -10.7964 -9.6654 -9.6654 -9.6294 -9.6294 -9.4158 -9.4158 -9.3930 -9.3930 -9.3741 -9.3741 -9.3584 -9.3584 -2.1050 -2.1050 -0.4286 -0.4286 -0.2639 -0.2639 0.0541 0.0541 0.1132 0.1132 0.6300 0.6300 0.8133 0.8133 0.9189 0.9189 1.2640 1.2640 1.3559 1.3559 1.4358 1.4358 1.6118 1.6118 8.7503 8.7503 8.8134 8.8134 9.2623 9.2623 9.4787 9.4787 9.9916 9.9916 10.1062 10.1062 k = 0.0000 0.0000 0.8418 ( 9804 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0033 -26.0033 -26.0013 -26.0013 -11.5942 -11.5942 -11.4145 -11.4145 -10.8035 -10.8035 -10.7952 -10.7952 -9.6673 -9.6673 -9.6296 -9.6296 -9.4172 -9.4172 -9.3952 -9.3952 -9.3741 -9.3741 -9.3594 -9.3594 -2.1386 -2.1386 -0.4637 -0.4637 -0.2439 -0.2439 0.0441 0.0441 0.1620 0.1620 0.6091 0.6091 0.8258 0.8258 0.9112 0.9112 1.2517 1.2517 1.3774 1.3774 1.4416 1.4416 1.6248 1.6248 8.7506 8.7506 8.9100 8.9100 9.2796 9.2796 9.4114 9.4114 9.9677 9.9677 10.1522 10.1522 k = 0.0000 0.0000 0.8690 ( 9790 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0013 -26.0013 -11.5806 -11.5806 -11.4231 -11.4231 -10.8041 -10.8041 -10.7940 -10.7940 -9.6691 -9.6691 -9.6299 -9.6299 -9.4186 -9.4186 -9.3974 -9.3974 -9.3742 -9.3742 -9.3604 -9.3604 -2.1706 -2.1706 -0.4966 -0.4966 -0.2232 -0.2232 0.0309 0.0309 0.2134 0.2134 0.5878 0.5878 0.8354 0.8354 0.9069 0.9069 1.2393 1.2393 1.3979 1.3979 1.4481 1.4481 1.6377 1.6377 8.7472 8.7472 9.0056 9.0056 9.2960 9.2960 9.3452 9.3452 9.9446 9.9446 10.1855 10.1855 k = 0.0000 0.0000 0.8962 ( 9802 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0032 -26.0032 -26.0013 -26.0013 -11.5675 -11.5675 -11.4312 -11.4312 -10.8047 -10.8047 -10.7927 -10.7927 -9.6709 -9.6709 -9.6302 -9.6302 -9.4201 -9.4201 -9.3995 -9.3995 -9.3745 -9.3745 -9.3614 -9.3614 -2.2010 -2.2010 -0.5273 -0.5273 -0.2020 -0.2020 0.0177 0.0177 0.2635 0.2635 0.5662 0.5662 0.8409 0.8409 0.9065 0.9065 1.2268 1.2268 1.4161 1.4161 1.4564 1.4564 1.6502 1.6502 8.7411 8.7411 9.0998 9.0998 9.2798 9.2798 9.3125 9.3125 9.9224 9.9224 10.0952 10.0952 k = 0.0000 0.0000 0.9233 ( 9790 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0031 -26.0031 -26.0013 -26.0013 -11.5550 -11.5550 -11.4388 -11.4388 -10.8053 -10.8053 -10.7914 -10.7914 -9.6727 -9.6727 -9.6305 -9.6305 -9.4214 -9.4214 -9.4015 -9.4015 -9.3748 -9.3748 -9.3622 -9.3622 -2.2295 -2.2295 -0.5556 -0.5556 -0.1804 -0.1804 0.0053 0.0053 0.3114 0.3114 0.5446 0.5446 0.8425 0.8425 0.9103 0.9103 1.2143 1.2143 1.4297 1.4297 1.4684 1.4684 1.6624 1.6624 8.7328 8.7328 9.1923 9.1923 9.2182 9.2182 9.3270 9.3270 9.9012 9.9012 10.0054 10.0054 k = 0.0000 0.0000 0.9505 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0031 -26.0031 -26.0013 -26.0013 -11.5432 -11.5432 -11.4458 -11.4458 -10.8060 -10.8060 -10.7900 -10.7900 -9.6744 -9.6744 -9.6309 -9.6309 -9.4228 -9.4228 -9.4034 -9.4034 -9.3753 -9.3753 -9.3630 -9.3630 -2.2561 -2.2561 -0.5814 -0.5814 -0.1588 -0.1588 -0.0062 -0.0062 0.3568 0.3568 0.5230 0.5230 0.8411 0.8411 0.9169 0.9169 1.2018 1.2018 1.4384 1.4384 1.4846 1.4846 1.6741 1.6741 8.7232 8.7232 9.1597 9.1597 9.2827 9.2827 9.3406 9.3406 9.8812 9.8812 9.9195 9.9195 k = 0.0000 0.0000 0.9776 ( 9772 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0013 -26.0013 -11.5322 -11.5322 -11.4522 -11.4522 -10.8068 -10.8068 -10.7887 -10.7887 -9.6760 -9.6760 -9.6313 -9.6313 -9.4241 -9.4241 -9.4052 -9.4052 -9.3758 -9.3758 -9.3636 -9.3636 -2.2806 -2.2806 -0.6048 -0.6048 -0.1373 -0.1373 -0.0166 -0.0166 0.3992 0.3992 0.5015 0.5015 0.8382 0.8382 0.9247 0.9247 1.1895 1.1895 1.4438 1.4438 1.5029 1.5029 1.6852 1.6852 8.7128 8.7128 9.1051 9.1051 9.3530 9.3530 9.3706 9.3706 9.8387 9.8387 9.8626 9.8626 k = 0.0000 0.0000 1.0048 ( 9776 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0013 -26.0013 -11.5221 -11.5221 -11.4580 -11.4580 -10.8075 -10.8075 -10.7874 -10.7874 -9.6775 -9.6775 -9.6317 -9.6317 -9.4253 -9.4253 -9.4069 -9.4069 -9.3765 -9.3765 -9.3641 -9.3641 -2.3028 -2.3028 -0.6257 -0.6257 -0.1162 -0.1162 -0.0259 -0.0259 0.4384 0.4384 0.4806 0.4806 0.8348 0.8348 0.9329 0.9329 1.1776 1.1776 1.4474 1.4474 1.5214 1.5214 1.6955 1.6955 8.7023 8.7023 9.0550 9.0550 9.3643 9.3643 9.4551 9.4551 9.7641 9.7641 9.8455 9.8455 k = 0.0000 0.0000 1.0319 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0013 -26.0013 -11.5128 -11.5128 -11.4632 -11.4632 -10.8082 -10.8082 -10.7862 -10.7862 -9.6789 -9.6789 -9.6320 -9.6320 -9.4263 -9.4263 -9.4084 -9.4084 -9.3771 -9.3771 -9.3646 -9.3646 -2.3228 -2.3228 -0.6441 -0.6441 -0.0959 -0.0959 -0.0339 -0.0339 0.4599 0.4599 0.4745 0.4745 0.8314 0.8314 0.9407 0.9407 1.1660 1.1660 1.4501 1.4501 1.5392 1.5392 1.7050 1.7050 8.6921 8.6921 9.0098 9.0098 9.3744 9.3744 9.5357 9.5357 9.6965 9.6965 9.8300 9.8300 k = 0.0000 0.0000 1.0591 ( 9790 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0013 -26.0013 -11.5047 -11.5047 -11.4677 -11.4677 -10.8089 -10.8089 -10.7851 -10.7851 -9.6801 -9.6801 -9.6324 -9.6324 -9.4273 -9.4273 -9.4097 -9.4097 -9.3778 -9.3778 -9.3649 -9.3649 -2.3402 -2.3402 -0.6600 -0.6600 -0.0771 -0.0771 -0.0403 -0.0403 0.4407 0.4407 0.5062 0.5062 0.8282 0.8282 0.9478 0.9478 1.1552 1.1552 1.4521 1.4521 1.5557 1.5557 1.7134 1.7134 8.6825 8.6825 8.9699 8.9699 9.3831 9.3831 9.6110 9.6110 9.6368 9.6368 9.8163 9.8163 k = 0.0000 0.0000 1.0862 ( 9796 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4976 -11.4976 -11.4716 -11.4716 -10.8096 -10.8096 -10.7842 -10.7842 -9.6811 -9.6811 -9.6327 -9.6327 -9.4282 -9.4282 -9.4108 -9.4108 -9.3784 -9.3784 -9.3651 -9.3651 -2.3552 -2.3552 -0.6735 -0.6735 -0.0621 -0.0621 -0.0433 -0.0433 0.4228 0.4228 0.5341 0.5341 0.8253 0.8253 0.9540 0.9540 1.1453 1.1453 1.4537 1.4537 1.5704 1.5704 1.7208 1.7208 8.6739 8.6739 8.9355 8.9355 9.3905 9.3905 9.5847 9.5847 9.6806 9.6806 9.8045 9.8045 k = 0.0000 0.0000 1.1134 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4918 -11.4918 -11.4748 -11.4748 -10.8101 -10.8101 -10.7833 -10.7833 -9.6820 -9.6820 -9.6330 -9.6330 -9.4289 -9.4289 -9.4118 -9.4118 -9.3790 -9.3790 -9.3653 -9.3653 -2.3675 -2.3675 -0.6845 -0.6845 -0.0579 -0.0579 -0.0362 -0.0362 0.4068 0.4068 0.5575 0.5575 0.8230 0.8230 0.9592 0.9592 1.1366 1.1366 1.4549 1.4549 1.5828 1.5828 1.7270 1.7270 8.6666 8.6666 8.9071 8.9071 9.3966 9.3966 9.5418 9.5418 9.7419 9.7419 9.7947 9.7947 k = 0.0000 0.0000 1.1406 ( 9794 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4872 -11.4872 -11.4772 -11.4772 -10.8106 -10.8106 -10.7827 -10.7827 -9.6827 -9.6827 -9.6332 -9.6332 -9.4295 -9.4295 -9.4125 -9.4125 -9.3794 -9.3794 -9.3654 -9.3654 -2.3772 -2.3772 -0.6930 -0.6930 -0.0599 -0.0599 -0.0245 -0.0245 0.3934 0.3934 0.5763 0.5763 0.8211 0.8211 0.9633 0.9633 1.1293 1.1293 1.4558 1.4558 1.5928 1.5928 1.7319 1.7319 8.6607 8.6607 8.8847 8.8847 9.4014 9.4014 9.5080 9.5080 9.7865 9.7865 9.7940 9.7940 k = 0.0000 0.0000 1.1677 ( 9794 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4840 -11.4840 -11.4789 -11.4789 -10.8109 -10.8109 -10.7822 -10.7822 -9.6832 -9.6832 -9.6334 -9.6334 -9.4299 -9.4299 -9.4131 -9.4131 -9.3798 -9.3798 -9.3655 -9.3655 -2.3842 -2.3842 -0.6991 -0.6991 -0.0621 -0.0621 -0.0146 -0.0146 0.3831 0.3831 0.5899 0.5899 0.8197 0.8197 0.9663 0.9663 1.1239 1.1239 1.4564 1.4564 1.6002 1.6002 1.7354 1.7354 8.6564 8.6564 8.8686 8.8686 9.4047 9.4047 9.4837 9.4837 9.7814 9.7814 9.8329 9.8329 k = 0.0000 0.0000 1.1949 ( 9786 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4823 -11.4823 -11.4796 -11.4796 -10.8111 -10.8111 -10.7819 -10.7819 -9.6836 -9.6836 -9.6335 -9.6335 -9.4301 -9.4301 -9.4134 -9.4134 -9.3800 -9.3800 -9.3656 -9.3656 -2.3883 -2.3883 -0.7028 -0.7028 -0.0636 -0.0636 -0.0082 -0.0082 0.3767 0.3767 0.5983 0.5983 0.8189 0.8189 0.9681 0.9681 1.1206 1.1206 1.4567 1.4567 1.6046 1.6046 1.7376 1.7376 8.6538 8.6538 8.8589 8.8589 9.4068 9.4068 9.4689 9.4689 9.7780 9.7780 9.8577 9.8577 k = 0.0000 0.0000 1.2220 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8112 -10.8112 -10.7818 -10.7818 -9.6837 -9.6837 -9.6335 -9.6335 -9.4302 -9.4302 -9.4135 -9.4135 -9.3801 -9.3801 -9.3656 -9.3656 -2.3897 -2.3897 -0.7040 -0.7040 -0.0641 -0.0641 -0.0061 -0.0061 0.3745 0.3745 0.6011 0.6011 0.8186 0.8186 0.9687 0.9687 1.1194 1.1194 1.4568 1.4568 1.6061 1.6061 1.7383 1.7383 8.6530 8.6530 8.8557 8.8557 9.4075 9.4075 9.4640 9.4640 9.7769 9.7769 9.8662 9.8662 k = 0.0000 0.0000 1.2220 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8112 -10.8112 -10.7818 -10.7818 -9.6837 -9.6837 -9.6335 -9.6335 -9.4302 -9.4302 -9.4135 -9.4135 -9.3801 -9.3801 -9.3656 -9.3656 -2.3897 -2.3897 -0.7040 -0.7040 -0.0641 -0.0641 -0.0061 -0.0061 0.3745 0.3745 0.6011 0.6011 0.8186 0.8186 0.9687 0.9687 1.1194 1.1194 1.4568 1.4568 1.6061 1.6061 1.7383 1.7383 8.6530 8.6530 8.8557 8.8557 9.4075 9.4075 9.4640 9.4640 9.7769 9.7769 9.8662 9.8662 k =-0.0101 0.0224 1.2220 ( 9772 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4821 -11.4821 -11.4798 -11.4798 -10.8110 -10.8110 -10.7819 -10.7819 -9.6836 -9.6836 -9.6336 -9.6336 -9.4301 -9.4301 -9.4135 -9.4135 -9.3800 -9.3800 -9.3655 -9.3655 -2.3885 -2.3885 -0.7031 -0.7031 -0.0646 -0.0646 -0.0056 -0.0056 0.3743 0.3743 0.5979 0.5979 0.8205 0.8205 0.9672 0.9672 1.1206 1.1206 1.4572 1.4572 1.6048 1.6048 1.7381 1.7381 8.6557 8.6557 8.8529 8.8529 9.4096 9.4096 9.4615 9.4615 9.7809 9.7809 9.8684 9.8684 k =-0.0201 0.0448 1.2220 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4834 -11.4834 -11.4795 -11.4795 -10.8102 -10.8102 -10.7824 -10.7824 -9.6833 -9.6833 -9.6336 -9.6336 -9.4298 -9.4298 -9.4137 -9.4137 -9.3797 -9.3797 -9.3653 -9.3653 -2.3848 -2.3848 -0.7004 -0.7004 -0.0660 -0.0660 -0.0043 -0.0043 0.3738 0.3738 0.5888 0.5888 0.8260 0.8260 0.9627 0.9627 1.1240 1.1240 1.4582 1.4582 1.6010 1.6010 1.7373 1.7373 8.6637 8.6637 8.8446 8.8446 9.4161 9.4161 9.4541 9.4541 9.7926 9.7926 9.8748 9.8748 k =-0.0302 0.0673 1.2220 ( 9796 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4862 -11.4862 -11.4782 -11.4782 -10.8089 -10.8089 -10.7831 -10.7831 -9.6830 -9.6830 -9.6338 -9.6338 -9.4292 -9.4292 -9.4139 -9.4139 -9.3794 -9.3794 -9.3649 -9.3649 -2.3786 -2.3786 -0.6959 -0.6959 -0.0683 -0.0683 -0.0022 -0.0022 0.3730 0.3730 0.5744 0.5744 0.8343 0.8343 0.9556 0.9556 1.1291 1.1291 1.4598 1.4598 1.5948 1.5948 1.7361 1.7361 8.6770 8.6770 8.8313 8.8313 9.4269 9.4269 9.4419 9.4419 9.8115 9.8115 9.8850 9.8850 k =-0.0402 0.0897 1.2220 ( 9800 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4904 -11.4904 -11.4763 -11.4763 -10.8072 -10.8072 -10.7840 -10.7840 -9.6824 -9.6824 -9.6340 -9.6340 -9.4285 -9.4285 -9.4142 -9.4142 -9.3789 -9.3789 -9.3644 -9.3644 -2.3700 -2.3700 -0.6897 -0.6897 -0.0716 -0.0716 0.0009 0.0009 0.3720 0.3720 0.5556 0.5556 0.8445 0.8445 0.9466 0.9466 1.1357 1.1357 1.4620 1.4620 1.5862 1.5862 1.7344 1.7344 8.6953 8.6953 8.8137 8.8137 9.4250 9.4250 9.4422 9.4422 9.8368 9.8368 9.8983 9.8983 k =-0.0503 0.1121 1.2220 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4958 -11.4958 -11.4737 -11.4737 -10.8051 -10.8051 -10.7852 -10.7852 -9.6818 -9.6818 -9.6342 -9.6342 -9.4276 -9.4276 -9.4146 -9.4146 -9.3783 -9.3783 -9.3638 -9.3638 -2.3589 -2.3589 -0.6816 -0.6816 -0.0757 -0.0757 0.0049 0.0049 0.3708 0.3708 0.5331 0.5331 0.8559 0.8559 0.9362 0.9362 1.1431 1.1431 1.4646 1.4646 1.5756 1.5756 1.7323 1.7323 8.7184 8.7184 8.7925 8.7925 9.4039 9.4039 9.4616 9.4616 9.8675 9.8675 9.9137 9.9137 k =-0.0503 0.1121 1.2220 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4958 -11.4958 -11.4737 -11.4737 -10.8051 -10.8051 -10.7852 -10.7852 -9.6818 -9.6818 -9.6342 -9.6342 -9.4276 -9.4276 -9.4146 -9.4146 -9.3783 -9.3783 -9.3638 -9.3638 -2.3589 -2.3589 -0.6816 -0.6816 -0.0757 -0.0757 0.0049 0.0049 0.3708 0.3708 0.5331 0.5331 0.8559 0.8559 0.9362 0.9362 1.1431 1.1431 1.4646 1.4646 1.5756 1.5756 1.7323 1.7323 8.7184 8.7184 8.7925 8.7925 9.4039 9.4039 9.4616 9.4616 9.8675 9.8675 9.9137 9.9137 k =-0.0580 0.1294 1.2031 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.5006 -11.5006 -11.4716 -11.4716 -10.8031 -10.8031 -10.7864 -10.7864 -9.6811 -9.6811 -9.6344 -9.6344 -9.4268 -9.4268 -9.4148 -9.4148 -9.3777 -9.3777 -9.3631 -9.3631 -2.3481 -2.3481 -0.6736 -0.6736 -0.0794 -0.0794 0.0074 0.0074 0.3709 0.3709 0.5123 0.5123 0.8646 0.8646 0.9279 0.9279 1.1495 1.1495 1.4668 1.4668 1.5654 1.5654 1.7300 1.7300 8.7398 8.7398 8.7756 8.7756 9.3868 9.3868 9.4795 9.4795 9.8948 9.8948 9.9222 9.9222 k =-0.0658 0.1467 1.1841 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5057 -11.5057 -11.4697 -11.4697 -10.8009 -10.8009 -10.7878 -10.7878 -9.6803 -9.6803 -9.6346 -9.6346 -9.4258 -9.4258 -9.4149 -9.4149 -9.3771 -9.3771 -9.3624 -9.3624 -2.3346 -2.3346 -0.6633 -0.6633 -0.0830 -0.0830 0.0080 0.0080 0.3735 0.3735 0.4877 0.4877 0.8715 0.8715 0.9210 0.9210 1.1565 1.1565 1.4686 1.4686 1.5529 1.5529 1.7267 1.7267 8.7598 8.7598 8.7647 8.7647 9.3710 9.3710 9.5001 9.5001 9.9224 9.9224 9.9258 9.9258 k =-0.0735 0.1640 1.1652 ( 9787 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5112 -11.5112 -11.4680 -11.4680 -10.7984 -10.7984 -10.7893 -10.7893 -9.6793 -9.6793 -9.6348 -9.6348 -9.4247 -9.4247 -9.4149 -9.4149 -9.3764 -9.3764 -9.3616 -9.3616 -2.3183 -2.3183 -0.6509 -0.6509 -0.0867 -0.0867 0.0067 0.0067 0.3784 0.3784 0.4595 0.4595 0.8740 0.8740 0.9182 0.9182 1.1639 1.1639 1.4698 1.4698 1.5385 1.5385 1.7226 1.7226 8.7457 8.7457 8.7923 8.7923 9.3559 9.3559 9.5237 9.5237 9.9166 9.9166 9.9582 9.9582 k =-0.0813 0.1813 1.1462 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5169 -11.5169 -11.4665 -11.4665 -10.7957 -10.7957 -10.7911 -10.7911 -9.6782 -9.6782 -9.6349 -9.6349 -9.4234 -9.4234 -9.4149 -9.4149 -9.3756 -9.3756 -9.3607 -9.3607 -2.2994 -2.2994 -0.6362 -0.6362 -0.0905 -0.0905 0.0035 0.0035 0.3855 0.3855 0.4284 0.4284 0.8703 0.8703 0.9213 0.9213 1.1714 1.1714 1.4693 1.4693 1.5231 1.5231 1.7175 1.7175 8.7331 8.7331 8.8229 8.8229 9.3408 9.3408 9.5505 9.5505 9.9047 9.9047 9.9934 9.9934 k =-0.0890 0.1986 1.1273 ( 9794 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0015 -26.0015 -11.5229 -11.5229 -11.4652 -11.4652 -10.7935 -10.7935 -10.7924 -10.7924 -9.6770 -9.6770 -9.6350 -9.6350 -9.4221 -9.4221 -9.4147 -9.4147 -9.3747 -9.3747 -9.3597 -9.3597 -2.2778 -2.2778 -0.6195 -0.6195 -0.0943 -0.0943 -0.0014 -0.0014 0.3865 0.3865 0.4025 0.4025 0.8623 0.8623 0.9286 0.9286 1.1788 1.1788 1.4648 1.4648 1.5092 1.5092 1.7116 1.7116 8.7220 8.7220 8.8561 8.8561 9.3252 9.3252 9.5807 9.5807 9.8891 9.8891 10.0303 10.0303 k =-0.0968 0.2159 1.1083 ( 9802 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0015 -26.0015 -11.5291 -11.5291 -11.4640 -11.4640 -10.7953 -10.7953 -10.7897 -10.7897 -9.6756 -9.6756 -9.6351 -9.6351 -9.4206 -9.4206 -9.4144 -9.4144 -9.3737 -9.3737 -9.3587 -9.3587 -2.2536 -2.2536 -0.6006 -0.6006 -0.0982 -0.0982 -0.0078 -0.0078 0.3528 0.3528 0.4107 0.4107 0.8524 0.8524 0.9377 0.9377 1.1859 1.1859 1.4527 1.4527 1.5003 1.5003 1.7049 1.7049 8.7127 8.7127 8.8912 8.8912 9.3083 9.3083 9.6144 9.6144 9.8721 9.8721 10.0687 10.0687 k =-0.1045 0.2331 1.0894 ( 9801 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0015 -26.0015 -11.5356 -11.5356 -11.4630 -11.4630 -10.7975 -10.7975 -10.7865 -10.7865 -9.6741 -9.6741 -9.6352 -9.6352 -9.4192 -9.4192 -9.4139 -9.4139 -9.3726 -9.3726 -9.3576 -9.3576 -2.2268 -2.2268 -0.5797 -0.5797 -0.1021 -0.1021 -0.0156 -0.0156 0.3124 0.3124 0.4251 0.4251 0.8416 0.8416 0.9474 0.9474 1.1927 1.1927 1.4330 1.4330 1.4965 1.4965 1.6976 1.6976 8.7052 8.7052 8.9276 8.9276 9.2897 9.2897 9.6516 9.6516 9.8558 9.8558 10.1083 10.1083 k =-0.1123 0.2504 1.0704 ( 9799 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0016 -26.0016 -11.5421 -11.5421 -11.4622 -11.4622 -10.7999 -10.7999 -10.7833 -10.7833 -9.6725 -9.6725 -9.6353 -9.6353 -9.4177 -9.4177 -9.4133 -9.4133 -9.3715 -9.3715 -9.3564 -9.3564 -2.1975 -2.1975 -0.5568 -0.5568 -0.1061 -0.1061 -0.0246 -0.0246 0.2689 0.2689 0.4419 0.4419 0.8305 0.8305 0.9573 0.9573 1.1988 1.1988 1.4085 1.4085 1.4949 1.4949 1.6899 1.6899 8.6996 8.6996 8.9642 8.9642 9.2694 9.2694 9.6923 9.6923 9.8420 9.8420 10.1489 10.1489 k =-0.1201 0.2677 1.0515 ( 9799 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0016 -26.0016 -11.5487 -11.5487 -11.4614 -11.4614 -10.8024 -10.8024 -10.7801 -10.7801 -9.6708 -9.6708 -9.6353 -9.6353 -9.4164 -9.4164 -9.4125 -9.4125 -9.3703 -9.3703 -9.3552 -9.3552 -2.1658 -2.1658 -0.5319 -0.5319 -0.1102 -0.1102 -0.0344 -0.0344 0.2228 0.2228 0.4608 0.4608 0.8193 0.8193 0.9670 0.9670 1.2041 1.2041 1.3815 1.3815 1.4936 1.4936 1.6818 1.6818 8.6958 8.6958 8.9993 8.9993 9.2485 9.2485 9.7366 9.7366 9.8321 9.8321 10.1903 10.1903 k =-0.1278 0.2850 1.0325 ( 9804 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0016 -26.0016 -11.5554 -11.5554 -11.4608 -11.4608 -10.8049 -10.8049 -10.7768 -10.7768 -9.6691 -9.6691 -9.6353 -9.6353 -9.4151 -9.4151 -9.4115 -9.4115 -9.3690 -9.3690 -9.3540 -9.3540 -2.1317 -2.1317 -0.5051 -0.5051 -0.1143 -0.1143 -0.0450 -0.0450 0.1745 0.1745 0.4815 0.4815 0.8082 0.8082 0.9765 0.9765 1.2079 1.2079 1.3533 1.3533 1.4916 1.4916 1.6737 1.6737 8.6940 8.6940 9.0290 9.0290 9.2300 9.2300 9.7842 9.7842 9.8267 9.8267 10.2323 10.2323 k =-0.1356 0.3023 1.0136 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0017 -26.0017 -11.5621 -11.5621 -11.4603 -11.4603 -10.8075 -10.8075 -10.7736 -10.7736 -9.6673 -9.6673 -9.6353 -9.6353 -9.4141 -9.4141 -9.4103 -9.4103 -9.3677 -9.3677 -9.3527 -9.3527 -2.0953 -2.0953 -0.4765 -0.4765 -0.1185 -0.1185 -0.0562 -0.0562 0.1241 0.1241 0.5039 0.5039 0.7971 0.7971 0.9855 0.9855 1.2089 1.2089 1.3257 1.3257 1.4883 1.4883 1.6658 1.6658 8.6941 8.6941 9.0467 9.0467 9.2207 9.2207 9.8255 9.8255 9.8355 9.8355 10.2747 10.2747 k =-0.1433 0.3196 0.9946 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0017 -26.0017 -11.5687 -11.5687 -11.4598 -11.4598 -10.8102 -10.8102 -10.7704 -10.7704 -9.6654 -9.6654 -9.6353 -9.6353 -9.4132 -9.4132 -9.4090 -9.4090 -9.3663 -9.3663 -9.3515 -9.3515 -2.0567 -2.0567 -0.4463 -0.4463 -0.1227 -0.1227 -0.0679 -0.0679 0.0723 0.0723 0.5278 0.5278 0.7859 0.7859 0.9940 0.9940 1.2045 1.2045 1.3017 1.3017 1.4832 1.4832 1.6586 1.6586 8.6962 8.6962 9.0451 9.0451 9.2277 9.2277 9.8293 9.8293 9.8893 9.8893 10.3174 10.3174 k =-0.1511 0.3369 0.9757 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0031 -26.0031 -26.0018 -26.0018 -11.5752 -11.5752 -11.4594 -11.4594 -10.8128 -10.8128 -10.7673 -10.7673 -9.6636 -9.6636 -9.6352 -9.6352 -9.4123 -9.4123 -9.4075 -9.4075 -9.3649 -9.3649 -9.3502 -9.3502 -2.0159 -2.0159 -0.4145 -0.4145 -0.1271 -0.1271 -0.0804 -0.0804 0.0196 0.0196 0.5530 0.5530 0.7747 0.7747 1.0019 1.0019 1.1910 1.1910 1.2855 1.2855 1.4759 1.4759 1.6522 1.6522 8.7001 8.7001 9.0253 9.0253 9.2498 9.2498 9.8366 9.8366 9.9465 9.9465 10.3599 10.3599 k =-0.1588 0.3542 0.9567 ( 9800 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0031 -26.0031 -26.0018 -26.0018 -11.5816 -11.5816 -11.4591 -11.4591 -10.8154 -10.8154 -10.7642 -10.7642 -9.6617 -9.6617 -9.6352 -9.6352 -9.4115 -9.4115 -9.4060 -9.4060 -9.3635 -9.3635 -9.3490 -9.3490 -1.9731 -1.9731 -0.3816 -0.3816 -0.1320 -0.1320 -0.0945 -0.0945 -0.0319 -0.0319 0.5794 0.5794 0.7633 0.7633 1.0091 1.0091 1.1673 1.1673 1.2784 1.2784 1.4662 1.4662 1.6469 1.6469 8.7059 8.7059 8.9948 8.9948 9.2798 9.2798 9.8468 9.8468 10.0064 10.0064 10.3547 10.3547 k =-0.1666 0.3715 0.9378 ( 9806 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0031 -26.0031 -26.0018 -26.0018 -11.5877 -11.5877 -11.4589 -11.4589 -10.8180 -10.8180 -10.7613 -10.7613 -9.6599 -9.6599 -9.6351 -9.6351 -9.4108 -9.4108 -9.4045 -9.4045 -9.3621 -9.3621 -9.3477 -9.3477 -1.9284 -1.9284 -0.3481 -0.3481 -0.1398 -0.1398 -0.1145 -0.1145 -0.0749 -0.0749 0.6067 0.6067 0.7518 0.7518 1.0154 1.0154 1.1370 1.1370 1.2775 1.2775 1.4538 1.4538 1.6428 1.6428 8.7133 8.7133 8.9592 8.9592 9.3117 9.3117 9.8590 9.8590 10.0690 10.0690 10.3339 10.3339 k =-0.1743 0.3888 0.9188 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6222 -38.6222 -26.0032 -26.0032 -26.0019 -26.0019 -11.5937 -11.5937 -11.4587 -11.4587 -10.8205 -10.8205 -10.7586 -10.7586 -9.6580 -9.6580 -9.6350 -9.6350 -9.4101 -9.4101 -9.4031 -9.4031 -9.3607 -9.3607 -9.3465 -9.3465 -1.8820 -1.8820 -0.3159 -0.3159 -0.1668 -0.1668 -0.1325 -0.1325 -0.0986 -0.0986 0.6345 0.6345 0.7400 0.7400 1.0204 1.0204 1.1039 1.1039 1.2797 1.2797 1.4388 1.4388 1.6399 1.6399 8.7223 8.7223 8.9214 8.9214 9.3426 9.3426 9.8723 9.8723 10.1340 10.1340 10.3186 10.3186 k =-0.1821 0.4061 0.8999 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0032 -26.0032 -26.0019 -26.0019 -11.5993 -11.5993 -11.4585 -11.4585 -10.8229 -10.8229 -10.7560 -10.7560 -9.6563 -9.6563 -9.6350 -9.6350 -9.4094 -9.4094 -9.4017 -9.4017 -9.3593 -9.3593 -9.3454 -9.3454 -1.8339 -1.8339 -0.2942 -0.2942 -0.2043 -0.2043 -0.1389 -0.1389 -0.1120 -0.1120 0.6617 0.6617 0.7289 0.7289 1.0221 1.0221 1.0721 1.0721 1.2833 1.2833 1.4214 1.4214 1.6381 1.6381 8.7326 8.7326 8.8834 8.8834 9.3704 9.3704 9.8858 9.8858 10.2011 10.2011 10.3098 10.3098 k =-0.1898 0.4234 0.8809 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0032 -26.0032 -26.0020 -26.0020 -11.6047 -11.6047 -11.4584 -11.4584 -10.8252 -10.8252 -10.7535 -10.7535 -9.6545 -9.6545 -9.6349 -9.6349 -9.4088 -9.4088 -9.4005 -9.4005 -9.3579 -9.3579 -9.3443 -9.3443 -1.7843 -1.7843 -0.3129 -0.3129 -0.2059 -0.2059 -0.1431 -0.1431 -0.1219 -0.1219 0.6820 0.6820 0.7240 0.7240 1.0123 1.0123 1.0513 1.0513 1.2874 1.2874 1.4018 1.4018 1.6371 1.6371 8.7441 8.7441 8.8461 8.8461 9.3942 9.3942 9.8982 9.8982 10.2699 10.2699 10.3081 10.3081 k =-0.1976 0.4407 0.8620 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0032 -26.0032 -26.0020 -26.0020 -11.6097 -11.6097 -11.4583 -11.4583 -10.8273 -10.8273 -10.7513 -10.7513 -9.6529 -9.6529 -9.6348 -9.6348 -9.4082 -9.4082 -9.3992 -9.3992 -9.3566 -9.3566 -9.3433 -9.3433 -1.7335 -1.7335 -0.3632 -0.3632 -0.1797 -0.1797 -0.1459 -0.1459 -0.1280 -0.1280 0.6802 0.6802 0.7398 0.7398 0.9862 0.9862 1.0475 1.0475 1.2915 1.2915 1.3804 1.3804 1.6368 1.6368 8.7564 8.7564 8.8103 8.8103 9.4134 9.4134 9.9088 9.9088 10.3137 10.3137 10.3403 10.3403 k =-0.2053 0.4579 0.8430 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0020 -26.0020 -11.6144 -11.6144 -11.4583 -11.4583 -10.8293 -10.8293 -10.7492 -10.7492 -9.6513 -9.6513 -9.6348 -9.6348 -9.4076 -9.4076 -9.3981 -9.3981 -9.3553 -9.3553 -9.3423 -9.3423 -1.6817 -1.6817 -0.4209 -0.4209 -0.1624 -0.1624 -0.1457 -0.1457 -0.1188 -0.1188 0.6641 0.6641 0.7679 0.7679 0.9564 0.9564 1.0492 1.0492 1.2949 1.2949 1.3579 1.3579 1.6370 1.6370 8.7691 8.7691 8.7768 8.7768 9.4281 9.4281 9.9168 9.9168 10.3266 10.3266 10.4115 10.4115 k =-0.2131 0.4752 0.8240 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0020 -26.0020 -11.6186 -11.6186 -11.4582 -11.4582 -10.8312 -10.8312 -10.7474 -10.7474 -9.6498 -9.6498 -9.6348 -9.6348 -9.4071 -9.4071 -9.3971 -9.3971 -9.3542 -9.3542 -9.3414 -9.3414 -1.6292 -1.6292 -0.4804 -0.4804 -0.1633 -0.1633 -0.1483 -0.1483 -0.0851 -0.0851 0.6422 0.6422 0.7988 0.7988 0.9285 0.9285 1.0518 1.0518 1.2957 1.2957 1.3361 1.3361 1.6375 1.6375 8.7455 8.7455 8.7824 8.7824 9.4385 9.4385 9.9220 9.9220 10.3454 10.3454 10.4830 10.4830 k =-0.2209 0.4925 0.8051 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0021 -26.0021 -11.6224 -11.6224 -11.4582 -11.4582 -10.8329 -10.8329 -10.7457 -10.7457 -9.6484 -9.6484 -9.6348 -9.6348 -9.4067 -9.4067 -9.3962 -9.3962 -9.3531 -9.3531 -9.3406 -9.3406 -1.5766 -1.5766 -0.5401 -0.5401 -0.1678 -0.1678 -0.1516 -0.1516 -0.0443 -0.0443 0.6160 0.6160 0.8301 0.8301 0.9048 0.9048 1.0545 1.0545 1.2875 1.2875 1.3216 1.3216 1.6382 1.6382 8.7173 8.7173 8.7953 8.7953 9.4454 9.4454 9.9245 9.9245 10.3676 10.3676 10.5536 10.5536 k =-0.2286 0.5098 0.7861 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0021 -26.0021 -11.6257 -11.6257 -11.4582 -11.4582 -10.8343 -10.8343 -10.7443 -10.7443 -9.6472 -9.6472 -9.6348 -9.6348 -9.4063 -9.4063 -9.3954 -9.3954 -9.3522 -9.3522 -9.3398 -9.3398 -1.5243 -1.5243 -0.5989 -0.5989 -0.1727 -0.1727 -0.1544 -0.1544 -0.0018 -0.0018 0.5860 0.5860 0.8572 0.8572 0.8900 0.8900 1.0569 1.0569 1.2660 1.2660 1.3188 1.3188 1.6390 1.6390 8.6924 8.6924 8.8077 8.8077 9.4494 9.4494 9.9250 9.9250 10.3903 10.3903 10.5794 10.5794 k =-0.2364 0.5271 0.7672 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6286 -11.6286 -11.4582 -11.4582 -10.8356 -10.8356 -10.7430 -10.7430 -9.6461 -9.6461 -9.6349 -9.6349 -9.4060 -9.4060 -9.3947 -9.3947 -9.3514 -9.3514 -9.3392 -9.3392 -1.4732 -1.4732 -0.6556 -0.6556 -0.1773 -0.1773 -0.1567 -0.1567 0.0411 0.0411 0.5530 0.5530 0.8584 0.8584 0.9053 0.9053 1.0590 1.0590 1.2388 1.2388 1.3201 1.3201 1.6398 1.6398 8.6709 8.6709 8.8191 8.8191 9.4514 9.4514 9.9241 9.9241 10.4102 10.4102 10.6025 10.6025 k =-0.2441 0.5444 0.7482 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6309 -11.6309 -11.4582 -11.4582 -10.8367 -10.8367 -10.7420 -10.7420 -9.6451 -9.6451 -9.6349 -9.6349 -9.4057 -9.4057 -9.3941 -9.3941 -9.3507 -9.3507 -9.3387 -9.3387 -1.4248 -1.4248 -0.7088 -0.7088 -0.1813 -0.1813 -0.1586 -0.1586 0.0833 0.0833 0.5181 0.5181 0.8479 0.8479 0.9361 0.9361 1.0609 1.0609 1.2094 1.2094 1.3221 1.3221 1.6405 1.6405 8.6530 8.6530 8.8291 8.8291 9.4521 9.4521 9.9224 9.9224 10.4255 10.4255 10.6314 10.6314 k =-0.2519 0.5617 0.7293 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6328 -11.6328 -11.4582 -11.4582 -10.8375 -10.8375 -10.7412 -10.7412 -9.6444 -9.6444 -9.6350 -9.6350 -9.4055 -9.4055 -9.3937 -9.3937 -9.3501 -9.3501 -9.3382 -9.3382 -1.3809 -1.3809 -0.7565 -0.7565 -0.1845 -0.1845 -0.1600 -0.1600 0.1235 0.1235 0.4831 0.4831 0.8390 0.8390 0.9682 0.9682 1.0628 1.0628 1.1790 1.1790 1.3240 1.3240 1.6412 1.6412 8.6390 8.6390 8.8373 8.8373 9.4520 9.4520 9.9206 9.9206 10.4359 10.4359 10.6633 10.6633 k =-0.2596 0.5790 0.7103 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6341 -11.6341 -11.4582 -11.4582 -10.8381 -10.8381 -10.7407 -10.7407 -9.6438 -9.6438 -9.6351 -9.6351 -9.4053 -9.4053 -9.3934 -9.3934 -9.3498 -9.3498 -9.3379 -9.3379 -1.3446 -1.3446 -0.7955 -0.7955 -0.1868 -0.1868 -0.1610 -0.1610 0.1591 0.1591 0.4508 0.4508 0.8327 0.8327 0.9991 0.9991 1.0654 1.0654 1.1483 1.1483 1.3255 1.3255 1.6416 1.6416 8.6289 8.6289 8.8434 8.8434 9.4516 9.4516 9.9190 9.9190 10.4424 10.4424 10.6936 10.6936 k =-0.2674 0.5963 0.6914 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6349 -11.6349 -11.4582 -11.4582 -10.8384 -10.8384 -10.7403 -10.7403 -9.6434 -9.6434 -9.6351 -9.6351 -9.4052 -9.4052 -9.3932 -9.3932 -9.3495 -9.3495 -9.3377 -9.3377 -1.3199 -1.3199 -0.8218 -0.8218 -0.1883 -0.1883 -0.1616 -0.1616 0.1855 0.1855 0.4263 0.4263 0.8291 0.8291 1.0248 1.0248 1.0709 1.0709 1.1187 1.1187 1.3264 1.3264 1.6419 1.6419 8.6228 8.6228 8.8472 8.8472 9.4512 9.4512 9.9179 9.9179 10.4459 10.4459 10.7161 10.7161 k =-0.2751 0.6136 0.6724 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6352 -11.6352 -11.4582 -11.4582 -10.8386 -10.8386 -10.7402 -10.7402 -9.6433 -9.6433 -9.6351 -9.6351 -9.4052 -9.4052 -9.3931 -9.3931 -9.3494 -9.3494 -9.3377 -9.3377 -1.3111 -1.3111 -0.8312 -0.8312 -0.1887 -0.1887 -0.1618 -0.1618 0.1957 0.1957 0.4167 0.4167 0.8278 0.8278 1.0355 1.0355 1.0806 1.0806 1.0989 1.0989 1.3267 1.3267 1.6420 1.6420 8.6207 8.6207 8.8485 8.8485 9.4511 9.4511 9.9175 9.9175 10.4470 10.4470 10.7245 10.7245 k =-0.2751 0.6136 0.6724 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6352 -11.6352 -11.4582 -11.4582 -10.8386 -10.8386 -10.7402 -10.7402 -9.6433 -9.6433 -9.6351 -9.6351 -9.4052 -9.4052 -9.3931 -9.3931 -9.3494 -9.3494 -9.3377 -9.3377 -1.3111 -1.3111 -0.8312 -0.8312 -0.1887 -0.1887 -0.1618 -0.1618 0.1957 0.1957 0.4167 0.4167 0.8278 0.8278 1.0355 1.0355 1.0806 1.0806 1.0989 1.0989 1.3267 1.3267 1.6420 1.6420 8.6207 8.6207 8.8485 8.8485 9.4511 9.4511 9.9175 9.9175 10.4470 10.4470 10.7245 10.7245 k =-0.2673 0.5960 0.6532 ( 9819 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6221 -11.6221 -11.4711 -11.4711 -10.8376 -10.8376 -10.7434 -10.7434 -9.6431 -9.6431 -9.6343 -9.6343 -9.4049 -9.4049 -9.3924 -9.3924 -9.3492 -9.3492 -9.3373 -9.3373 -1.3158 -1.3158 -0.8253 -0.8253 -0.2139 -0.2139 -0.1408 -0.1408 0.2014 0.2014 0.4082 0.4082 0.8262 0.8262 1.0290 1.0290 1.0767 1.0767 1.1034 1.1034 1.3302 1.3302 1.6361 1.6361 8.6285 8.6285 8.9071 8.9071 9.4728 9.4728 9.9680 9.9680 10.4664 10.4664 10.7167 10.7167 k =-0.2594 0.5785 0.6340 ( 9819 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6117 -11.6117 -11.4811 -11.4811 -10.8365 -10.8365 -10.7466 -10.7466 -9.6429 -9.6429 -9.6336 -9.6336 -9.4045 -9.4045 -9.3917 -9.3917 -9.3492 -9.3492 -9.3372 -9.3372 -1.3201 -1.3201 -0.8216 -0.8216 -0.2380 -0.2380 -0.1189 -0.1189 0.2090 0.2090 0.4029 0.4029 0.8248 0.8248 1.0222 1.0222 1.0704 1.0704 1.1110 1.1110 1.3340 1.3340 1.6292 1.6292 8.6262 8.6262 8.9635 8.9635 9.4829 9.4829 10.0101 10.0101 10.4736 10.4736 10.6901 10.6901 k =-0.2516 0.5610 0.6148 ( 9829 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6055 -11.6055 -11.4869 -11.4869 -10.8353 -10.8353 -10.7498 -10.7498 -9.6428 -9.6428 -9.6329 -9.6329 -9.4042 -9.4042 -9.3910 -9.3910 -9.3492 -9.3492 -9.3372 -9.3372 -1.3240 -1.3240 -0.8201 -0.8201 -0.2607 -0.2607 -0.0964 -0.0964 0.2181 0.2181 0.4010 0.4010 0.8234 0.8234 1.0155 1.0155 1.0641 1.0641 1.1194 1.1194 1.3381 1.3381 1.6216 1.6216 8.6138 8.6138 9.0167 9.0167 9.4790 9.4790 10.0431 10.0431 10.4709 10.4709 10.6256 10.6256 k =-0.2437 0.5435 0.5956 ( 9835 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0036 -26.0036 -26.0019 -26.0019 -11.6049 -11.6049 -11.4871 -11.4871 -10.8339 -10.8339 -10.7529 -10.7529 -9.6426 -9.6426 -9.6323 -9.6323 -9.4038 -9.4038 -9.3902 -9.3902 -9.3493 -9.3493 -9.3374 -9.3374 -1.3273 -1.3273 -0.8209 -0.8209 -0.2822 -0.2822 -0.0733 -0.0733 0.2289 0.2289 0.4026 0.4026 0.8218 0.8218 1.0094 1.0094 1.0581 1.0581 1.1280 1.1280 1.3425 1.3425 1.6132 1.6132 8.5914 8.5914 9.0659 9.0659 9.4594 9.4594 10.0664 10.0664 10.4618 10.4618 10.5621 10.5621 k =-0.2358 0.5259 0.5764 ( 9827 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0037 -26.0037 -26.0019 -26.0019 -11.6099 -11.6099 -11.4814 -11.4814 -10.8324 -10.8324 -10.7560 -10.7560 -9.6425 -9.6425 -9.6318 -9.6318 -9.4035 -9.4035 -9.3895 -9.3895 -9.3495 -9.3495 -9.3378 -9.3378 -1.3301 -1.3301 -0.8240 -0.8240 -0.3023 -0.3023 -0.0495 -0.0495 0.2410 0.2410 0.4075 0.4075 0.8197 0.8197 1.0043 1.0043 1.0527 1.0527 1.1365 1.1365 1.3472 1.3472 1.6043 1.6043 8.5592 8.5592 9.1099 9.1099 9.4241 9.4241 10.0796 10.0796 10.4486 10.4486 10.4997 10.4997 k =-0.2280 0.5084 0.5572 ( 9827 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0037 -26.0037 -26.0018 -26.0018 -11.6193 -11.6193 -11.4713 -11.4713 -10.8307 -10.8307 -10.7591 -10.7591 -9.6424 -9.6424 -9.6314 -9.6314 -9.4033 -9.4033 -9.3887 -9.3887 -9.3497 -9.3497 -9.3385 -9.3385 -1.3323 -1.3323 -0.8292 -0.8292 -0.3212 -0.3212 -0.0252 -0.0252 0.2543 0.2543 0.4159 0.4159 0.8171 0.8171 1.0006 1.0006 1.0479 1.0479 1.1447 1.1447 1.3521 1.3521 1.5948 1.5948 8.5178 8.5178 9.1477 9.1477 9.3745 9.3745 10.0817 10.0817 10.4324 10.4324 10.4390 10.4390 k =-0.2201 0.4909 0.5380 ( 9841 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0038 -26.0038 -26.0018 -26.0018 -11.6315 -11.6315 -11.4582 -11.4582 -10.8289 -10.8289 -10.7621 -10.7621 -9.6424 -9.6424 -9.6311 -9.6311 -9.4030 -9.4030 -9.3879 -9.3879 -9.3500 -9.3500 -9.3393 -9.3393 -1.3338 -1.3338 -0.8365 -0.8365 -0.3388 -0.3388 -0.0002 -0.0002 0.2684 0.2684 0.4274 0.4274 0.8137 0.8137 0.9988 0.9988 1.0436 1.0436 1.1526 1.1526 1.3573 1.3573 1.5849 1.5849 8.4675 8.4675 9.1781 9.1781 9.3129 9.3129 10.0720 10.0720 10.3790 10.3790 10.4150 10.4150 k =-0.2122 0.4733 0.5187 ( 9845 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0039 -26.0039 -26.0018 -26.0018 -11.6454 -11.6454 -11.4433 -11.4433 -10.8270 -10.8270 -10.7650 -10.7650 -9.6424 -9.6424 -9.6308 -9.6308 -9.4028 -9.4028 -9.3872 -9.3872 -9.3504 -9.3504 -9.3402 -9.3402 -1.3345 -1.3345 -0.8456 -0.8456 -0.3553 -0.3553 0.0254 0.0254 0.2830 0.2830 0.4418 0.4418 0.8095 0.8095 0.9993 0.9993 1.0398 1.0398 1.1600 1.1600 1.3627 1.3627 1.5747 1.5747 8.4092 8.4092 9.2001 9.2001 9.2425 9.2425 10.0505 10.0505 10.3211 10.3211 10.3952 10.3952 k =-0.2044 0.4558 0.4995 ( 9853 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0039 -26.0039 -26.0017 -26.0017 -11.6602 -11.6602 -11.4275 -11.4275 -10.8250 -10.8250 -10.7678 -10.7678 -9.6424 -9.6424 -9.6307 -9.6307 -9.4026 -9.4026 -9.3865 -9.3865 -9.3507 -9.3507 -9.3414 -9.3414 -1.3345 -1.3345 -0.8564 -0.8564 -0.3707 -0.3707 0.0515 0.0515 0.2977 0.2977 0.4590 0.4590 0.8048 0.8048 1.0021 1.0021 1.0367 1.0367 1.1669 1.1669 1.3683 1.3683 1.5642 1.5642 8.3437 8.3437 9.1637 9.1637 9.2155 9.2155 10.0183 10.0183 10.2649 10.2649 10.3728 10.3728 k =-0.1965 0.4383 0.4803 ( 9843 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0040 -26.0040 -26.0017 -26.0017 -11.6755 -11.6755 -11.4111 -11.4111 -10.8228 -10.8228 -10.7706 -10.7706 -9.6425 -9.6425 -9.6306 -9.6306 -9.4025 -9.4025 -9.3859 -9.3859 -9.3511 -9.3511 -9.3427 -9.3427 -1.3337 -1.3337 -0.8687 -0.8687 -0.3850 -0.3850 0.0783 0.0783 0.3118 0.3118 0.4786 0.4786 0.7999 0.7999 1.0073 1.0073 1.0341 1.0341 1.1733 1.1733 1.3740 1.3740 1.5536 1.5536 8.2718 8.2718 9.0822 9.0822 9.2212 9.2212 9.9770 9.9770 10.2105 10.2105 10.3471 10.3471 k =-0.1887 0.4207 0.4611 ( 9847 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0041 -26.0041 -26.0017 -26.0017 -11.6909 -11.6909 -11.3945 -11.3945 -10.8206 -10.8206 -10.7732 -10.7732 -9.6426 -9.6426 -9.6306 -9.6306 -9.4024 -9.4024 -9.3854 -9.3854 -9.3514 -9.3514 -9.3441 -9.3441 -1.3320 -1.3320 -0.8822 -0.8822 -0.3982 -0.3982 0.1056 0.1056 0.3248 0.3248 0.5003 0.5003 0.7955 0.7955 1.0145 1.0145 1.0325 1.0325 1.1790 1.1790 1.3798 1.3798 1.5429 1.5429 8.1945 8.1945 8.9977 8.9977 9.2198 9.2198 9.9287 9.9287 10.1580 10.1580 10.3174 10.3174 k =-0.1808 0.4032 0.4419 ( 9847 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0042 -26.0042 -26.0016 -26.0016 -11.7063 -11.7063 -11.3778 -11.3778 -10.8183 -10.8183 -10.7756 -10.7756 -9.6428 -9.6428 -9.6308 -9.6308 -9.4023 -9.4023 -9.3849 -9.3849 -9.3516 -9.3516 -9.3457 -9.3457 -1.3294 -1.3294 -0.8968 -0.8968 -0.4106 -0.4106 0.1335 0.1335 0.3360 0.3360 0.5238 0.5238 0.7921 0.7921 1.0214 1.0214 1.0338 1.0338 1.1840 1.1840 1.3857 1.3857 1.5323 1.5323 8.1128 8.1128 8.9120 8.9120 9.2122 9.2122 9.8752 9.8752 10.1073 10.1073 10.2837 10.2837 k =-0.1729 0.3857 0.4227 ( 9829 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0042 -26.0042 -26.0016 -26.0016 -11.7215 -11.7215 -11.3613 -11.3613 -10.8159 -10.8159 -10.7780 -10.7780 -9.6430 -9.6430 -9.6310 -9.6310 -9.4023 -9.4023 -9.3847 -9.3847 -9.3518 -9.3518 -9.3474 -9.3474 -1.3259 -1.3259 -0.9120 -0.9120 -0.4220 -0.4220 0.1618 0.1618 0.3448 0.3448 0.5488 0.5488 0.7906 0.7906 1.0237 1.0237 1.0424 1.0424 1.1883 1.1883 1.3916 1.3916 1.5217 1.5217 8.0275 8.0275 8.8261 8.8261 9.1999 9.1999 9.8179 9.8179 10.0587 10.0587 10.2462 10.2462 k =-0.1651 0.3681 0.4035 ( 9823 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0043 -26.0043 -26.0016 -26.0016 -11.7365 -11.7365 -11.3450 -11.3450 -10.8135 -10.8135 -10.7801 -10.7801 -9.6433 -9.6433 -9.6313 -9.6313 -9.4023 -9.4023 -9.3845 -9.3845 -9.3518 -9.3518 -9.3491 -9.3491 -1.3214 -1.3214 -0.9279 -0.9279 -0.4325 -0.4325 0.1905 0.1905 0.3506 0.3506 0.5749 0.5749 0.7914 0.7914 1.0233 1.0233 1.0559 1.0559 1.1918 1.1918 1.3974 1.3974 1.5113 1.5113 7.9396 7.9396 8.7409 8.7409 9.1841 9.1841 9.7581 9.7581 10.0120 10.0120 10.2055 10.2055 k =-0.1572 0.3506 0.3843 ( 9811 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0044 -26.0044 -26.0016 -26.0016 -11.7512 -11.7512 -11.3290 -11.3290 -10.8110 -10.8110 -10.7821 -10.7821 -9.6436 -9.6436 -9.6317 -9.6317 -9.4024 -9.4024 -9.3846 -9.3846 -9.3518 -9.3518 -9.3508 -9.3508 -1.3160 -1.3160 -0.9441 -0.9441 -0.4422 -0.4422 0.2195 0.2195 0.3531 0.3531 0.6019 0.6019 0.7951 0.7951 1.0225 1.0225 1.0719 1.0719 1.1945 1.1945 1.4031 1.4031 1.5013 1.5013 7.8501 7.8501 8.6570 8.6570 9.1664 9.1664 9.6968 9.6968 9.9674 9.9674 10.1621 10.1621 k =-0.1494 0.3331 0.3650 ( 9819 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0045 -26.0045 -26.0016 -26.0016 -11.7654 -11.7654 -11.3135 -11.3135 -10.8085 -10.8085 -10.7839 -10.7839 -9.6439 -9.6439 -9.6322 -9.6322 -9.4025 -9.4025 -9.3849 -9.3849 -9.3529 -9.3529 -9.3513 -9.3513 -1.3098 -1.3098 -0.9604 -0.9604 -0.4512 -0.4512 0.2483 0.2483 0.3523 0.3523 0.6295 0.6295 0.8018 0.8018 1.0218 1.0218 1.0896 1.0896 1.1965 1.1965 1.4085 1.4085 1.4916 1.4916 7.7596 7.7596 8.5751 8.5751 9.1479 9.1479 9.6347 9.6347 9.9248 9.9248 10.1169 10.1169 k =-0.1415 0.3156 0.3458 ( 9813 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0046 -26.0046 -26.0016 -26.0016 -11.7792 -11.7792 -11.2985 -11.2985 -10.8060 -10.8060 -10.7855 -10.7855 -9.6444 -9.6444 -9.6328 -9.6328 -9.4026 -9.4026 -9.3853 -9.3853 -9.3548 -9.3548 -9.3510 -9.3510 -1.3026 -1.3026 -0.9767 -0.9767 -0.4595 -0.4595 0.2758 0.2758 0.3496 0.3496 0.6574 0.6574 0.8114 0.8114 1.0211 1.0211 1.1086 1.1086 1.1978 1.1978 1.4136 1.4136 1.4826 1.4826 7.6689 7.6689 8.4955 8.4955 9.1295 9.1295 9.5725 9.5725 9.8844 9.8844 10.0704 10.0704 k =-0.1336 0.2980 0.3266 ( 9823 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0047 -26.0047 -26.0016 -26.0016 -11.7924 -11.7924 -11.2840 -11.2840 -10.8035 -10.8035 -10.7869 -10.7869 -9.6448 -9.6448 -9.6335 -9.6335 -9.4028 -9.4028 -9.3860 -9.3860 -9.3566 -9.3566 -9.3505 -9.3505 -1.2946 -1.2946 -0.9928 -0.9928 -0.4671 -0.4671 0.2978 0.2978 0.3492 0.3492 0.6854 0.6854 0.8234 0.8234 1.0206 1.0206 1.1281 1.1281 1.1991 1.1991 1.4180 1.4180 1.4746 1.4746 7.5789 7.5789 8.4186 8.4186 9.1121 9.1121 9.5108 9.5108 9.8461 9.8461 10.0234 10.0234 k =-0.1258 0.2805 0.3074 ( 9829 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0047 -26.0047 -26.0016 -26.0016 -11.8052 -11.8052 -11.2701 -11.2701 -10.8010 -10.8010 -10.7881 -10.7881 -9.6453 -9.6453 -9.6342 -9.6342 -9.4030 -9.4030 -9.3868 -9.3868 -9.3584 -9.3584 -9.3499 -9.3499 -1.2859 -1.2859 -1.0086 -1.0086 -0.4741 -0.4741 0.3039 0.3039 0.3621 0.3621 0.7131 0.7131 0.8375 0.8375 1.0202 1.0202 1.1465 1.1465 1.2015 1.2015 1.4214 1.4214 1.4679 1.4679 7.4900 7.4900 8.3447 8.3447 9.0965 9.0965 9.4503 9.4503 9.8099 9.8099 9.9764 9.9764 k =-0.1179 0.2630 0.2882 ( 9819 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0048 -26.0048 -26.0016 -26.0016 -11.8173 -11.8173 -11.2570 -11.2570 -10.7986 -10.7986 -10.7890 -10.7890 -9.6458 -9.6458 -9.6349 -9.6349 -9.4032 -9.4032 -9.3878 -9.3878 -9.3602 -9.3602 -9.3491 -9.3491 -1.2765 -1.2765 -1.0240 -1.0240 -0.4805 -0.4805 0.2953 0.2953 0.3874 0.3874 0.7404 0.7404 0.8531 0.8531 1.0200 1.0200 1.1604 1.1604 1.2081 1.2081 1.4232 1.4232 1.4634 1.4634 7.4031 7.4031 8.2741 8.2741 9.0830 9.0830 9.3912 9.3912 9.7759 9.7759 9.9300 9.9300 k =-0.1101 0.2454 0.2690 ( 9827 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0049 -26.0049 -26.0016 -26.0016 -11.8287 -11.8287 -11.2445 -11.2445 -10.7963 -10.7963 -10.7897 -10.7897 -9.6464 -9.6464 -9.6357 -9.6357 -9.4035 -9.4035 -9.3889 -9.3889 -9.3619 -9.3619 -9.3483 -9.3483 -1.2665 -1.2665 -1.0387 -1.0387 -0.4863 -0.4863 0.2807 0.2807 0.4170 0.4170 0.7670 0.7670 0.8696 0.8696 1.0198 1.0198 1.1662 1.1662 1.2220 1.2220 1.4228 1.4228 1.4615 1.4615 7.3185 7.3185 8.2070 8.2070 9.0722 9.0722 9.3341 9.3341 9.7440 9.7440 9.8848 9.8848 k =-0.1022 0.2279 0.2498 ( 9843 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0050 -26.0050 -26.0016 -26.0016 -11.8396 -11.8396 -11.2328 -11.2328 -10.7941 -10.7941 -10.7901 -10.7901 -9.6470 -9.6470 -9.6365 -9.6365 -9.4038 -9.4038 -9.3900 -9.3900 -9.3635 -9.3635 -9.3474 -9.3474 -1.2561 -1.2561 -1.0527 -1.0527 -0.4917 -0.4917 0.2634 0.2634 0.4480 0.4480 0.7925 0.7925 0.8866 0.8866 1.0197 1.0197 1.1652 1.1652 1.2416 1.2416 1.4206 1.4206 1.4621 1.4621 7.2370 7.2370 8.1437 8.1437 9.0644 9.0644 9.2793 9.2793 9.7143 9.7143 9.8410 9.8410 k =-0.0943 0.2104 0.2306 ( 9841 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0051 -26.0051 -26.0016 -26.0016 -11.8497 -11.8497 -11.2219 -11.2219 -10.7923 -10.7923 -10.7901 -10.7901 -9.6476 -9.6476 -9.6373 -9.6373 -9.4041 -9.4041 -9.3913 -9.3913 -9.3650 -9.3650 -9.3465 -9.3465 -1.2454 -1.2454 -1.0660 -1.0660 -0.4965 -0.4965 0.2447 0.2447 0.4795 0.4795 0.8169 0.8169 0.9037 0.9037 1.0196 1.0196 1.1605 1.1605 1.2631 1.2631 1.4176 1.4176 1.4646 1.4646 7.1590 7.1590 8.0843 8.0843 9.0599 9.0599 9.2273 9.2273 9.6868 9.6868 9.7991 9.7991 k =-0.0865 0.1928 0.2113 ( 9841 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0051 -26.0051 -26.0016 -26.0016 -11.8591 -11.8591 -11.2118 -11.2118 -10.7915 -10.7915 -10.7889 -10.7889 -9.6483 -9.6483 -9.6381 -9.6381 -9.4045 -9.4045 -9.3926 -9.3926 -9.3663 -9.3663 -9.3456 -9.3456 -1.2346 -1.2346 -1.0783 -1.0783 -0.5009 -0.5009 0.2253 0.2253 0.5112 0.5112 0.8399 0.8399 0.9204 0.9204 1.0194 1.0194 1.1535 1.1535 1.2845 1.2845 1.4151 1.4151 1.4681 1.4681 7.0850 7.0850 8.0291 8.0291 9.0587 9.0587 9.1782 9.1782 9.6615 9.6615 9.7375 9.7375 k =-0.0786 0.1753 0.1921 ( 9837 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0052 -26.0052 -26.0016 -26.0016 -11.8678 -11.8678 -11.2026 -11.2026 -10.7912 -10.7912 -10.7872 -10.7872 -9.6489 -9.6489 -9.6389 -9.6389 -9.4048 -9.4048 -9.3939 -9.3939 -9.3676 -9.3676 -9.3447 -9.3447 -1.2239 -1.2239 -1.0896 -1.0896 -0.5048 -0.5048 0.2059 0.2059 0.5428 0.5428 0.8612 0.8612 0.9367 0.9367 1.0192 1.0192 1.1448 1.1448 1.3041 1.3041 1.4141 1.4141 1.4721 1.4721 7.0156 7.0156 7.9781 7.9781 9.0610 9.0610 9.1324 9.1324 9.6384 9.6384 9.6788 9.6788 k =-0.0707 0.1578 0.1729 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0052 -26.0052 -26.0016 -26.0016 -11.8757 -11.8757 -11.1943 -11.1943 -10.7910 -10.7910 -10.7854 -10.7854 -9.6496 -9.6496 -9.6396 -9.6396 -9.4052 -9.4052 -9.3952 -9.3952 -9.3687 -9.3687 -9.3439 -9.3439 -1.2135 -1.2135 -1.0999 -1.0999 -0.5084 -0.5084 0.1867 0.1867 0.5740 0.5740 0.8807 0.8807 0.9521 0.9521 1.0187 1.0187 1.1348 1.1348 1.3204 1.3204 1.4158 1.4158 1.4764 1.4764 6.9511 6.9511 7.9315 7.9315 9.0668 9.0668 9.0903 9.0903 9.6175 9.6175 9.6251 9.6251 k =-0.0629 0.1402 0.1537 ( 9833 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0016 -26.0016 -11.8828 -11.8828 -11.1868 -11.1868 -10.7907 -10.7907 -10.7837 -10.7837 -9.6502 -9.6502 -9.6403 -9.6403 -9.4055 -9.4055 -9.3964 -9.3964 -9.3697 -9.3697 -9.3431 -9.3431 -1.2036 -1.2036 -1.1088 -1.1088 -0.5115 -0.5115 0.1684 0.1684 0.6045 0.6045 0.8983 0.8983 0.9665 0.9665 1.0181 1.0181 1.1238 1.1238 1.3322 1.3322 1.4209 1.4209 1.4809 1.4809 6.8921 6.8921 7.8895 7.8895 9.0519 9.0519 9.0760 9.0760 9.5764 9.5764 9.5989 9.5989 k =-0.0550 0.1227 0.1345 ( 9843 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0016 -26.0016 -11.8892 -11.8892 -11.1803 -11.1803 -10.7904 -10.7904 -10.7822 -10.7822 -9.6508 -9.6508 -9.6409 -9.6409 -9.4058 -9.4058 -9.3976 -9.3976 -9.3705 -9.3705 -9.3423 -9.3423 -1.1947 -1.1947 -1.1165 -1.1165 -0.5142 -0.5142 0.1512 0.1512 0.6342 0.6342 0.9139 0.9139 0.9795 0.9795 1.0172 1.0172 1.1122 1.1122 1.3394 1.3394 1.4291 1.4291 1.4856 1.4856 6.8389 6.8389 7.8522 7.8522 9.0175 9.0175 9.0885 9.0885 9.5330 9.5330 9.5823 9.5823 k =-0.0472 0.1052 0.1153 ( 9845 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0016 -26.0016 -11.8947 -11.8947 -11.1746 -11.1746 -10.7900 -10.7900 -10.7809 -10.7809 -9.6514 -9.6514 -9.6414 -9.6414 -9.4061 -9.4061 -9.3986 -9.3986 -9.3712 -9.3712 -9.3416 -9.3416 -1.1870 -1.1870 -1.1225 -1.1225 -0.5165 -0.5165 0.1355 0.1355 0.6625 0.6625 0.9274 0.9274 0.9907 0.9907 1.0161 1.0161 1.1006 1.1006 1.3428 1.3428 1.4390 1.4390 1.4907 1.4907 6.7919 6.7919 7.8196 7.8196 8.9874 8.9874 9.1038 9.1038 9.4951 9.4951 9.5680 9.5680 k =-0.0393 0.0877 0.0961 ( 9845 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0016 -26.0016 -11.8994 -11.8994 -11.1698 -11.1698 -10.7896 -10.7896 -10.7797 -10.7797 -9.6519 -9.6519 -9.6419 -9.6419 -9.4064 -9.4064 -9.3995 -9.3995 -9.3718 -9.3718 -9.3410 -9.3410 -1.1809 -1.1809 -1.1269 -1.1269 -0.5185 -0.5185 0.1216 0.1216 0.6890 0.6890 0.9389 0.9389 0.9988 0.9988 1.0158 1.0158 1.0895 1.0895 1.3440 1.3440 1.4486 1.4486 1.4961 1.4961 6.7516 6.7516 7.7919 7.7919 8.9616 8.9616 9.1215 9.1215 9.4628 9.4628 9.5559 9.5559 k =-0.0314 0.0701 0.0769 ( 9845 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9032 -11.9032 -11.1659 -11.1659 -10.7892 -10.7892 -10.7787 -10.7787 -9.6523 -9.6523 -9.6423 -9.6423 -9.4066 -9.4066 -9.4003 -9.4003 -9.3723 -9.3723 -9.3405 -9.3405 -1.1765 -1.1765 -1.1295 -1.1295 -0.5201 -0.5201 0.1098 0.1098 0.7131 0.7131 0.9482 0.9482 1.0012 1.0012 1.0185 1.0185 1.0797 1.0797 1.3441 1.3441 1.4568 1.4568 1.5017 1.5017 6.7181 6.7181 7.7691 7.7691 8.9403 8.9403 9.1406 9.1406 9.4362 9.4362 9.5460 9.5460 k =-0.0236 0.0526 0.0576 ( 9847 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9063 -11.9063 -11.1628 -11.1628 -10.7889 -10.7889 -10.7780 -10.7780 -9.6527 -9.6527 -9.6426 -9.6426 -9.4068 -9.4068 -9.4010 -9.4010 -9.3727 -9.3727 -9.3401 -9.3401 -1.1739 -1.1739 -1.1306 -1.1306 -0.5213 -0.5213 0.1004 0.1004 0.7338 0.7338 0.9555 0.9555 0.9985 0.9985 1.0234 1.0234 1.0719 1.0719 1.3437 1.3437 1.4629 1.4629 1.5071 1.5071 6.6917 6.6917 7.7513 7.7513 8.9236 8.9236 9.1598 9.1598 9.4154 9.4154 9.5383 9.5383 k =-0.0157 0.0351 0.0384 ( 9853 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9084 -11.9084 -11.1607 -11.1607 -10.7887 -10.7887 -10.7774 -10.7774 -9.6530 -9.6530 -9.6428 -9.6428 -9.4069 -9.4069 -9.4014 -9.4014 -9.3730 -9.3730 -9.3399 -9.3399 -1.1726 -1.1726 -1.1307 -1.1307 -0.5222 -0.5222 0.0935 0.0935 0.7501 0.7501 0.9607 0.9607 0.9943 0.9943 1.0278 1.0278 1.0663 1.0663 1.3432 1.3432 1.4670 1.4670 1.5116 1.5116 6.6728 6.6728 7.7386 7.7386 8.9116 8.9116 9.1768 9.1768 9.4004 9.4004 9.5328 9.5328 k =-0.0079 0.0175 0.0192 ( 9851 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9097 -11.9097 -11.1594 -11.1594 -10.7885 -10.7885 -10.7771 -10.7771 -9.6531 -9.6531 -9.6430 -9.6430 -9.4070 -9.4070 -9.4017 -9.4017 -9.3732 -9.3732 -9.3397 -9.3397 -1.1721 -1.1721 -1.1305 -1.1305 -0.5227 -0.5227 0.0893 0.0893 0.7606 0.7606 0.9638 0.9638 0.9907 0.9907 1.0307 1.0307 1.0631 1.0631 1.3428 1.3428 1.4693 1.4693 1.5146 1.5146 6.6613 6.6613 7.7309 7.7309 8.9044 8.9044 9.1888 9.1888 9.3914 9.3914 9.5294 9.5295 k = 0.0000 0.0000 0.0000 ( 9863 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9101 -11.9101 -11.1589 -11.1589 -10.7885 -10.7885 -10.7770 -10.7770 -9.6532 -9.6532 -9.6430 -9.6430 -9.4070 -9.4070 -9.4018 -9.4018 -9.3732 -9.3732 -9.3396 -9.3396 -1.1720 -1.1720 -1.1303 -1.1303 -0.5229 -0.5229 0.0879 0.0879 0.7643 0.7643 0.9649 0.9649 0.9893 0.9893 1.0317 1.0317 1.0620 1.0620 1.3427 1.3427 1.4701 1.4701 1.5156 1.5156 6.6575 6.6575 7.7284 7.7284 8.9020 8.9020 9.1933 9.1933 9.3884 9.3884 9.5278 9.5281 k = 0.0000 0.0000 0.0000 ( 9863 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9101 -11.9101 -11.1589 -11.1589 -10.7885 -10.7885 -10.7770 -10.7770 -9.6532 -9.6532 -9.6430 -9.6430 -9.4070 -9.4070 -9.4018 -9.4018 -9.3732 -9.3732 -9.3396 -9.3396 -1.1720 -1.1720 -1.1303 -1.1303 -0.5229 -0.5229 0.0879 0.0879 0.7643 0.7643 0.9649 0.9649 0.9893 0.9893 1.0317 1.0317 1.0620 1.0620 1.3427 1.3427 1.4701 1.4701 1.5156 1.5156 6.6575 6.6575 7.7284 7.7284 8.9020 8.9020 9.1933 9.1933 9.3884 9.3884 9.5278 9.5280 k = 0.0238 0.0107 0.0000 ( 9864 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0016 -26.0016 -11.9102 -11.9102 -11.1589 -11.1589 -10.7908 -10.7908 -10.7744 -10.7744 -9.6533 -9.6533 -9.6430 -9.6430 -9.4071 -9.4071 -9.4017 -9.4017 -9.3733 -9.3733 -9.3398 -9.3398 -1.1719 -1.1719 -1.1303 -1.1303 -0.5226 -0.5226 0.0889 0.0889 0.7643 0.7643 0.9637 0.9637 0.9910 0.9910 1.0305 1.0305 1.0636 1.0636 1.3413 1.3413 1.4692 1.4692 1.5150 1.5150 6.6607 6.6607 7.7275 7.7275 8.8996 8.8996 9.1805 9.1805 9.3891 9.3891 9.5303 9.5303 k = 0.0476 0.0214 0.0000 ( 9856 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0017 -26.0017 -11.9106 -11.9106 -11.1589 -11.1589 -10.7950 -10.7950 -10.7691 -10.7691 -9.6535 -9.6535 -9.6430 -9.6430 -9.4074 -9.4074 -9.4014 -9.4014 -9.3735 -9.3735 -9.3402 -9.3402 -1.1719 -1.1719 -1.1303 -1.1303 -0.5220 -0.5220 0.0918 0.0918 0.7644 0.7644 0.9608 0.9608 0.9953 0.9953 1.0276 1.0276 1.0679 1.0679 1.3372 1.3372 1.4666 1.4666 1.5133 1.5133 6.6705 6.6705 7.7250 7.7250 8.8925 8.8925 9.1474 9.1474 9.3911 9.3911 9.5379 9.5380 k = 0.0714 0.0320 0.0000 ( 9864 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0055 -26.0055 -26.0017 -26.0017 -11.9111 -11.9111 -11.1589 -11.1589 -10.7995 -10.7995 -10.7628 -10.7628 -9.6539 -9.6539 -9.6429 -9.6429 -9.4079 -9.4079 -9.4009 -9.4009 -9.3739 -9.3739 -9.3409 -9.3409 -1.1719 -1.1719 -1.1302 -1.1302 -0.5209 -0.5209 0.0966 0.0966 0.7645 0.7645 0.9571 0.9571 1.0011 1.0011 1.0238 1.0238 1.0739 1.0739 1.3303 1.3303 1.4624 1.4624 1.5105 1.5105 6.6866 6.6866 7.7207 7.7207 8.8812 8.8812 9.1030 9.1030 9.3944 9.3944 9.5503 9.5505 k = 0.0952 0.0427 0.0000 ( 9856 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0017 -26.0017 -11.9118 -11.9118 -11.1589 -11.1589 -10.8038 -10.8038 -10.7562 -10.7562 -9.6544 -9.6544 -9.6429 -9.6429 -9.4085 -9.4085 -9.4003 -9.4003 -9.3745 -9.3745 -9.3418 -9.3418 -1.1718 -1.1718 -1.1302 -1.1302 -0.5193 -0.5193 0.1032 0.1032 0.7646 0.7646 0.9534 0.9534 1.0080 1.0080 1.0198 1.0198 1.0810 1.0810 1.3207 1.3207 1.4567 1.4567 1.5066 1.5066 6.7089 6.7089 7.7148 7.7148 8.8662 8.8662 9.0535 9.0535 9.3989 9.3989 9.5329 9.5329 k = 0.1190 0.0534 0.0000 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0054 -26.0054 -26.0018 -26.0018 -11.9127 -11.9127 -11.1589 -11.1589 -10.8079 -10.8079 -10.7492 -10.7492 -9.6551 -9.6551 -9.6429 -9.6429 -9.4091 -9.4091 -9.3997 -9.3997 -9.3752 -9.3752 -9.3430 -9.3430 -1.1717 -1.1717 -1.1301 -1.1301 -0.5174 -0.5174 0.1117 0.1117 0.7648 0.7648 0.9498 0.9498 1.0156 1.0156 1.0158 1.0158 1.0889 1.0889 1.3084 1.3084 1.4498 1.4498 1.5017 1.5017 6.7372 6.7372 7.7073 7.7073 8.8482 8.8482 9.0026 9.0026 9.4047 9.4047 9.5059 9.5059 k = 0.1429 0.0641 0.0000 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0018 -26.0018 -11.9138 -11.9138 -11.1589 -11.1589 -10.8115 -10.8115 -10.7421 -10.7421 -9.6558 -9.6558 -9.6429 -9.6429 -9.4097 -9.4097 -9.3991 -9.3991 -9.3761 -9.3761 -9.3443 -9.3443 -1.1715 -1.1715 -1.1300 -1.1300 -0.5152 -0.5152 0.1219 0.1219 0.7650 0.7650 0.9464 0.9464 1.0120 1.0120 1.0238 1.0238 1.0974 1.0974 1.2935 1.2935 1.4417 1.4417 1.4957 1.4957 6.7712 6.7712 7.6982 7.6982 8.8277 8.8277 8.9519 8.9519 9.4116 9.4116 9.4733 9.4733 k = 0.1667 0.0747 0.0000 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0053 -26.0053 -26.0019 -26.0019 -11.9150 -11.9150 -11.1589 -11.1589 -10.8149 -10.8149 -10.7348 -10.7348 -9.6567 -9.6567 -9.6429 -9.6429 -9.4103 -9.4103 -9.3985 -9.3985 -9.3771 -9.3771 -9.3458 -9.3458 -1.1714 -1.1714 -1.1298 -1.1298 -0.5127 -0.5127 0.1337 0.1337 0.7652 0.7652 0.9432 0.9432 1.0085 1.0085 1.0326 1.0326 1.1065 1.1065 1.2763 1.2763 1.4326 1.4326 1.4888 1.4888 6.8106 6.8106 7.6877 7.6877 8.8050 8.8050 8.9027 8.9027 9.4196 9.4196 9.4361 9.4361 k = 0.1905 0.0854 0.0000 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0052 -26.0052 -26.0020 -26.0020 -11.9163 -11.9163 -11.1589 -11.1589 -10.8179 -10.8179 -10.7275 -10.7275 -9.6576 -9.6576 -9.6429 -9.6429 -9.4109 -9.4109 -9.3978 -9.3978 -9.3783 -9.3783 -9.3473 -9.3473 -1.1713 -1.1713 -1.1297 -1.1297 -0.5099 -0.5099 0.1469 0.1469 0.7654 0.7654 0.9404 0.9404 1.0052 1.0052 1.0418 1.0418 1.1160 1.1160 1.2568 1.2568 1.4228 1.4228 1.4810 1.4810 6.8549 6.8549 7.6761 7.6761 8.7800 8.7800 8.8556 8.8556 9.3955 9.3955 9.4285 9.4285 k = 0.2143 0.0961 0.0000 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0051 -26.0051 -26.0020 -26.0020 -11.9176 -11.9176 -11.1589 -11.1589 -10.8206 -10.8206 -10.7203 -10.7203 -9.6586 -9.6586 -9.6429 -9.6429 -9.4115 -9.4115 -9.3972 -9.3972 -9.3795 -9.3795 -9.3489 -9.3489 -1.1711 -1.1711 -1.1296 -1.1296 -0.5070 -0.5070 0.1615 0.1615 0.7657 0.7657 0.9378 0.9378 1.0023 1.0023 1.0514 1.0514 1.1259 1.1259 1.2355 1.2355 1.4123 1.4123 1.4725 1.4725 6.9037 6.9037 7.6637 7.6637 8.7523 8.7523 8.8110 8.8110 9.3532 9.3532 9.4382 9.4382 k = 0.2381 0.1068 0.0000 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0050 -26.0050 -26.0021 -26.0021 -11.9190 -11.9190 -11.1589 -11.1589 -10.8230 -10.8230 -10.7132 -10.7132 -9.6596 -9.6596 -9.6430 -9.6430 -9.4121 -9.4121 -9.3967 -9.3967 -9.3809 -9.3809 -9.3505 -9.3505 -1.1710 -1.1710 -1.1295 -1.1295 -0.5039 -0.5039 0.1772 0.1772 0.7659 0.7659 0.9355 0.9355 0.9996 0.9996 1.0613 1.0613 1.1362 1.1362 1.2127 1.2127 1.4012 1.4012 1.4632 1.4632 6.9563 6.9563 7.6511 7.6511 8.7211 8.7211 8.7692 8.7692 9.3111 9.3111 9.4486 9.4486 k = 0.2619 0.1174 0.0000 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0049 -26.0049 -26.0022 -26.0022 -11.9205 -11.9205 -11.1589 -11.1589 -10.8250 -10.8250 -10.7064 -10.7064 -9.6607 -9.6607 -9.6430 -9.6430 -9.4126 -9.4126 -9.3961 -9.3961 -9.3824 -9.3824 -9.3521 -9.3521 -1.1708 -1.1708 -1.1293 -1.1293 -0.5009 -0.5009 0.1938 0.1938 0.7662 0.7662 0.9335 0.9335 0.9972 0.9972 1.0715 1.0715 1.1468 1.1468 1.1889 1.1889 1.3898 1.3898 1.4534 1.4534 7.0119 7.0119 7.6388 7.6388 8.6855 8.6855 8.7305 8.7305 9.2714 9.2714 9.4594 9.4594 k = 0.2857 0.1281 0.0000 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0048 -26.0048 -26.0023 -26.0023 -11.9219 -11.9219 -11.1589 -11.1589 -10.8269 -10.8269 -10.6998 -10.6998 -9.6617 -9.6617 -9.6431 -9.6431 -9.4131 -9.4131 -9.3956 -9.3956 -9.3839 -9.3839 -9.3535 -9.3535 -1.1706 -1.1706 -1.1292 -1.1292 -0.4979 -0.4979 0.2110 0.2110 0.7665 0.7665 0.9317 0.9317 0.9951 0.9951 1.0818 1.0818 1.1575 1.1575 1.1646 1.1646 1.3781 1.3781 1.4430 1.4430 7.0697 7.0697 7.6278 7.6278 8.6444 8.6444 8.6950 8.6950 9.2358 9.2358 9.4706 9.4706 k = 0.3095 0.1388 0.0000 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0047 -26.0047 -26.0025 -26.0025 -11.9232 -11.9232 -11.1589 -11.1589 -10.8284 -10.8284 -10.6936 -10.6936 -9.6627 -9.6627 -9.6432 -9.6432 -9.4136 -9.4136 -9.3952 -9.3952 -9.3854 -9.3854 -9.3549 -9.3549 -1.1705 -1.1705 -1.1291 -1.1291 -0.4949 -0.4949 0.2284 0.2284 0.7667 0.7667 0.9302 0.9302 0.9933 0.9933 1.0916 1.0916 1.1408 1.1408 1.1684 1.1684 1.3662 1.3662 1.4324 1.4324 7.1282 7.1282 7.6191 7.6191 8.5974 8.5974 8.6630 8.6630 9.2056 9.2056 9.4817 9.4817 k = 0.3333 0.1495 0.0000 ( 9840 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0046 -26.0046 -26.0026 -26.0026 -11.9245 -11.9245 -11.1589 -11.1589 -10.8297 -10.8297 -10.6880 -10.6880 -9.6637 -9.6637 -9.6433 -9.6433 -9.4140 -9.4140 -9.3948 -9.3948 -9.3869 -9.3869 -9.3561 -9.3561 -1.1703 -1.1703 -1.1290 -1.1290 -0.4922 -0.4922 0.2457 0.2457 0.7669 0.7669 0.9288 0.9288 0.9917 0.9917 1.0984 1.0984 1.1206 1.1206 1.1792 1.1792 1.3544 1.3544 1.4217 1.4217 7.1857 7.1857 7.6141 7.6141 8.5445 8.5445 8.6345 8.6345 9.1816 9.1816 9.4926 9.4926 k = 0.3571 0.1601 0.0000 ( 9840 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0044 -26.0044 -26.0027 -26.0027 -11.9256 -11.9256 -11.1589 -11.1589 -10.8308 -10.8308 -10.6829 -10.6829 -9.6646 -9.6646 -9.6434 -9.6434 -9.4144 -9.4144 -9.3944 -9.3944 -9.3883 -9.3883 -9.3572 -9.3572 -1.1702 -1.1702 -1.1288 -1.1288 -0.4896 -0.4896 0.2625 0.2625 0.7672 0.7672 0.9277 0.9277 0.9904 0.9904 1.0879 1.0879 1.1187 1.1187 1.1899 1.1899 1.3428 1.3428 1.4110 1.4110 7.2398 7.2398 7.6149 7.6149 8.4868 8.4868 8.6096 8.6096 9.1636 9.1636 9.5030 9.5030 k = 0.3810 0.1708 0.0000 ( 9840 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0043 -26.0043 -26.0028 -26.0028 -11.9266 -11.9266 -11.1589 -11.1589 -10.8318 -10.8318 -10.6784 -10.6784 -9.6654 -9.6654 -9.6435 -9.6435 -9.4147 -9.4147 -9.3941 -9.3941 -9.3896 -9.3896 -9.3582 -9.3582 -1.1701 -1.1701 -1.1287 -1.1287 -0.4874 -0.4874 0.2781 0.2781 0.7674 0.7674 0.9267 0.9267 0.9893 0.9893 1.0686 1.0686 1.1271 1.1271 1.2001 1.2001 1.3317 1.3317 1.4007 1.4007 7.2873 7.2873 7.6236 7.6236 8.4258 8.4258 8.5885 8.5885 9.1508 9.1508 9.5125 9.5125 k = 0.4048 0.1815 0.0000 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0042 -26.0042 -26.0029 -26.0029 -11.9275 -11.9275 -11.1589 -11.1589 -10.8325 -10.8325 -10.6746 -10.6746 -9.6661 -9.6661 -9.6435 -9.6435 -9.4149 -9.4149 -9.3939 -9.3939 -9.3907 -9.3907 -9.3589 -9.3589 -1.1700 -1.1700 -1.1287 -1.1287 -0.4855 -0.4855 0.2920 0.2920 0.7675 0.7675 0.9259 0.9259 0.9884 0.9884 1.0505 1.0505 1.1360 1.1360 1.2096 1.2096 1.3214 1.3214 1.3910 1.3910 7.3251 7.3251 7.6419 7.6419 8.3641 8.3641 8.5711 8.5711 9.1423 9.1423 9.5209 9.5209 k = 0.4286 0.1922 0.0000 ( 9836 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0041 -26.0041 -26.0031 -26.0031 -11.9282 -11.9282 -11.1589 -11.1589 -10.8330 -10.8330 -10.6717 -10.6717 -9.6666 -9.6666 -9.6436 -9.6436 -9.4151 -9.4151 -9.3937 -9.3937 -9.3916 -9.3916 -9.3595 -9.3595 -1.1699 -1.1699 -1.1286 -1.1286 -0.4839 -0.4839 0.3037 0.3037 0.7677 0.7677 0.9252 0.9252 0.9878 0.9878 1.0353 1.0353 1.1441 1.1441 1.2179 1.2179 1.3124 1.3124 1.3826 1.3826 7.3518 7.3518 7.6686 7.6686 8.3052 8.3052 8.5575 8.5575 9.1370 9.1370 9.5277 9.5277 k = 0.4524 0.2029 0.0000 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0040 -26.0040 -26.0032 -26.0032 -11.9287 -11.9287 -11.1589 -11.1589 -10.8334 -10.8334 -10.6695 -10.6695 -9.6670 -9.6670 -9.6437 -9.6437 -9.4153 -9.4153 -9.3935 -9.3935 -9.3922 -9.3922 -9.3599 -9.3599 -1.1699 -1.1699 -1.1286 -1.1286 -0.4828 -0.4828 0.3126 0.3126 0.7678 0.7678 0.9247 0.9247 0.9873 0.9873 1.0238 1.0238 1.1507 1.1507 1.2245 1.2245 1.3052 1.3052 1.3758 1.3758 7.3682 7.3682 7.6986 7.6986 8.2542 8.2542 8.5477 8.5477 9.1339 9.1339 9.5329 9.5329 k = 0.4762 0.2135 0.0000 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0039 -26.0039 -26.0033 -26.0033 -11.9290 -11.9290 -11.1589 -11.1589 -10.8336 -10.8336 -10.6682 -10.6682 -9.6673 -9.6673 -9.6437 -9.6437 -9.4154 -9.4154 -9.3934 -9.3934 -9.3927 -9.3927 -9.3602 -9.3602 -1.1698 -1.1698 -1.1285 -1.1285 -0.4821 -0.4821 0.3181 0.3181 0.7678 0.7678 0.9244 0.9244 0.9870 0.9870 1.0167 1.0167 1.1550 1.1550 1.2288 1.2288 1.3006 1.3006 1.3714 1.3714 7.3768 7.3768 7.7232 7.7232 8.2181 8.2181 8.5419 8.5419 9.1324 9.1324 9.5361 9.5361 k = 0.5000 0.2242 0.0000 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9291 -11.9291 -11.1589 -11.1589 -10.8337 -10.8337 -10.6677 -10.6677 -9.6674 -9.6674 -9.6437 -9.6437 -9.4154 -9.4154 -9.3934 -9.3934 -9.3928 -9.3928 -9.3603 -9.3603 -1.1698 -1.1698 -1.1285 -1.1285 -0.4819 -0.4819 0.3200 0.3200 0.7678 0.7678 0.9243 0.9243 0.9869 0.9869 1.0143 1.0143 1.1565 1.1565 1.2303 1.2303 1.2990 1.2990 1.3699 1.3699 7.3794 7.3794 7.7329 7.7329 8.2047 8.2047 8.5399 8.5399 9.1319 9.1319 9.5371 9.5371 k = 0.5000 0.2242 0.0000 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9291 -11.9291 -11.1589 -11.1589 -10.8337 -10.8337 -10.6677 -10.6677 -9.6674 -9.6674 -9.6437 -9.6437 -9.4154 -9.4154 -9.3934 -9.3934 -9.3928 -9.3928 -9.3603 -9.3603 -1.1698 -1.1698 -1.1285 -1.1285 -0.4819 -0.4819 0.3200 0.3200 0.7678 0.7678 0.9243 0.9243 0.9869 0.9869 1.0143 1.0143 1.1565 1.1565 1.2303 1.2303 1.2990 1.2990 1.3699 1.3699 7.3794 7.3794 7.7329 7.7329 8.2047 8.2047 8.5399 8.5399 9.1319 9.1319 9.5371 9.5371 k = 0.4922 0.2415 0.0190 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9287 -11.9287 -11.1594 -11.1594 -10.8337 -10.8337 -10.6679 -10.6679 -9.6673 -9.6673 -9.6437 -9.6437 -9.4153 -9.4153 -9.3944 -9.3944 -9.3916 -9.3916 -9.3603 -9.3603 -1.1697 -1.1697 -1.1284 -1.1284 -0.4815 -0.4815 0.3197 0.3197 0.7654 0.7654 0.9235 0.9235 0.9861 0.9861 1.0089 1.0089 1.1605 1.1605 1.2331 1.2331 1.2990 1.2990 1.3694 1.3694 7.3819 7.3819 7.7344 7.7344 8.2077 8.2077 8.5420 8.5420 9.1340 9.1340 9.5400 9.5400 k = 0.4845 0.2588 0.0379 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9274 -11.9274 -11.1606 -11.1606 -10.8339 -10.8339 -10.6684 -10.6684 -9.6671 -9.6671 -9.6437 -9.6437 -9.4151 -9.4151 -9.3957 -9.3957 -9.3901 -9.3901 -9.3602 -9.3602 -1.1695 -1.1695 -1.1281 -1.1281 -0.4802 -0.4802 0.3190 0.3190 0.7578 0.7578 0.9211 0.9211 0.9834 0.9834 0.9958 0.9958 1.1688 1.1688 1.2420 1.2420 1.2992 1.2992 1.3681 1.3681 7.3893 7.3893 7.7391 7.7391 8.2166 8.2166 8.5480 8.5480 9.1404 9.1404 9.5485 9.5485 k = 0.4767 0.2761 0.0569 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9253 -11.9253 -11.1627 -11.1627 -10.8340 -10.8340 -10.6691 -10.6691 -9.6667 -9.6667 -9.6437 -9.6437 -9.4149 -9.4149 -9.3968 -9.3968 -9.3886 -9.3886 -9.3600 -9.3600 -1.1693 -1.1693 -1.1273 -1.1273 -0.4782 -0.4782 0.3177 0.3177 0.7446 0.7446 0.9172 0.9172 0.9754 0.9754 0.9839 0.9839 1.1757 1.1757 1.2564 1.2564 1.3010 1.3010 1.3659 1.3659 7.4017 7.4017 7.7468 7.7468 8.2314 8.2314 8.5581 8.5581 9.1509 9.1509 9.5626 9.5626 k = 0.4690 0.2934 0.0758 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9224 -11.9224 -11.1657 -11.1657 -10.8343 -10.8343 -10.6702 -10.6702 -9.6662 -9.6662 -9.6437 -9.6437 -9.4145 -9.4145 -9.3978 -9.3978 -9.3869 -9.3869 -9.3598 -9.3598 -1.1695 -1.1695 -1.1258 -1.1258 -0.4753 -0.4753 0.3159 0.3159 0.7254 0.7254 0.9117 0.9117 0.9614 0.9614 0.9779 0.9779 1.1794 1.1794 1.2703 1.2703 1.3089 1.3089 1.3630 1.3630 7.4189 7.4189 7.7576 7.7576 8.2520 8.2520 8.5721 8.5721 9.1656 9.1656 9.5822 9.5822 k = 0.4612 0.3107 0.0948 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9186 -11.9186 -11.1695 -11.1695 -10.8346 -10.8346 -10.6716 -10.6716 -9.6655 -9.6655 -9.6437 -9.6437 -9.4140 -9.4140 -9.3987 -9.3987 -9.3851 -9.3851 -9.3596 -9.3596 -1.1705 -1.1705 -1.1231 -1.1231 -0.4716 -0.4716 0.3135 0.3135 0.7002 0.7002 0.9048 0.9048 0.9488 0.9488 0.9723 0.9723 1.1803 1.1803 1.2758 1.2758 1.3279 1.3279 1.3596 1.3596 7.4409 7.4409 7.7715 7.7715 8.2783 8.2783 8.5898 8.5898 9.1846 9.1846 9.6074 9.6074 k = 0.4535 0.3280 0.1137 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0037 -26.0037 -26.0033 -26.0033 -11.9140 -11.9140 -11.1741 -11.1741 -10.8349 -10.8349 -10.6732 -10.6732 -9.6648 -9.6648 -9.6438 -9.6438 -9.4135 -9.4135 -9.3995 -9.3995 -9.3833 -9.3833 -9.3593 -9.3593 -1.1724 -1.1724 -1.1190 -1.1190 -0.4672 -0.4672 0.3105 0.3105 0.6698 0.6698 0.8965 0.8965 0.9390 0.9390 0.9664 0.9664 1.1795 1.1795 1.2753 1.2753 1.3506 1.3506 1.3590 1.3590 7.4676 7.4676 7.7885 7.7885 8.3101 8.3101 8.6112 8.6112 9.2077 9.2077 9.6379 9.6379 k = 0.4457 0.3453 0.1327 ( 9802 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0037 -26.0037 -26.0033 -26.0033 -11.9086 -11.9086 -11.1795 -11.1795 -10.8353 -10.8353 -10.6751 -10.6751 -9.6639 -9.6639 -9.6438 -9.6438 -9.4129 -9.4129 -9.4002 -9.4002 -9.3814 -9.3814 -9.3589 -9.3589 -1.1753 -1.1753 -1.1134 -1.1134 -0.4619 -0.4619 0.3069 0.3069 0.6352 0.6352 0.8863 0.8863 0.9319 0.9319 0.9603 0.9603 1.1775 1.1775 1.2722 1.2722 1.3499 1.3499 1.3836 1.3836 7.4988 7.4988 7.8084 7.8084 8.3472 8.3472 8.6360 8.6360 9.2351 9.2351 9.6737 9.6737 k = 0.4380 0.3625 0.1516 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0036 -26.0036 -26.0033 -26.0033 -11.9024 -11.9024 -11.1858 -11.1858 -10.8358 -10.8358 -10.6772 -10.6772 -9.6629 -9.6629 -9.6438 -9.6438 -9.4123 -9.4123 -9.4007 -9.4007 -9.3795 -9.3795 -9.3584 -9.3584 -1.1792 -1.1792 -1.1063 -1.1063 -0.4558 -0.4558 0.3025 0.3025 0.5975 0.5975 0.8739 0.8739 0.9272 0.9272 0.9544 0.9544 1.1746 1.1746 1.2677 1.2677 1.3455 1.3455 1.4120 1.4120 7.5345 7.5345 7.8314 7.8314 8.3893 8.3893 8.6641 8.6641 9.2667 9.2667 9.7145 9.7145 k = 0.4302 0.3798 0.1706 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0036 -26.0036 -26.0033 -26.0033 -11.8954 -11.8954 -11.1929 -11.1929 -10.8363 -10.8363 -10.6794 -10.6794 -9.6618 -9.6618 -9.6438 -9.6438 -9.4118 -9.4118 -9.4011 -9.4011 -9.3775 -9.3775 -9.3579 -9.3579 -1.1838 -1.1838 -1.0978 -1.0978 -0.4489 -0.4489 0.2974 0.2974 0.5576 0.5576 0.8592 0.8592 0.9239 0.9239 0.9495 0.9495 1.1710 1.1710 1.2622 1.2622 1.3409 1.3409 1.4399 1.4399 7.5744 7.5744 7.8574 7.8574 8.4362 8.4362 8.6953 8.6953 9.3023 9.3023 9.7602 9.7602 k = 0.4225 0.3971 0.1895 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0035 -26.0035 -26.0032 -26.0032 -11.8876 -11.8876 -11.2008 -11.2008 -10.8368 -10.8368 -10.6819 -10.6819 -9.6607 -9.6607 -9.6438 -9.6438 -9.4112 -9.4112 -9.4014 -9.4014 -9.3755 -9.3755 -9.3573 -9.3573 -1.1892 -1.1892 -1.0881 -1.0881 -0.4413 -0.4413 0.2916 0.2916 0.5163 0.5163 0.8421 0.8421 0.9207 0.9207 0.9462 0.9462 1.1669 1.1669 1.2560 1.2560 1.3364 1.3364 1.4667 1.4667 7.6184 7.6184 7.8862 7.8862 8.4875 8.4875 8.7294 8.7294 9.3421 9.3421 9.8107 9.8107 k = 0.4147 0.4144 0.2085 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0035 -26.0035 -26.0032 -26.0032 -11.8791 -11.8791 -11.2095 -11.2095 -10.8373 -10.8373 -10.6845 -10.6845 -9.6595 -9.6595 -9.6438 -9.6438 -9.4107 -9.4107 -9.4015 -9.4015 -9.3734 -9.3734 -9.3566 -9.3566 -1.1951 -1.1951 -1.0773 -1.0773 -0.4329 -0.4329 0.2851 0.2851 0.4741 0.4741 0.8230 0.8230 0.9167 0.9167 0.9453 0.9453 1.1622 1.1622 1.2492 1.2492 1.3321 1.3321 1.4921 1.4921 7.6662 7.6662 7.9180 7.9180 8.5428 8.5428 8.7662 8.7662 9.3859 9.3859 9.8657 9.8657 k = 0.4070 0.4317 0.2274 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0034 -26.0034 -26.0032 -26.0032 -11.8698 -11.8698 -11.2190 -11.2190 -10.8378 -10.8378 -10.6872 -10.6872 -9.6582 -9.6582 -9.6437 -9.6437 -9.4103 -9.4103 -9.4015 -9.4015 -9.3713 -9.3713 -9.3558 -9.3558 -1.2014 -1.2014 -1.0654 -1.0654 -0.4237 -0.4237 0.2778 0.2778 0.4316 0.4316 0.8021 0.8021 0.9115 0.9115 0.9468 0.9468 1.1572 1.1572 1.2418 1.2418 1.3281 1.3281 1.5159 1.5159 7.7176 7.7176 7.9526 7.9526 8.6015 8.6015 8.8058 8.8058 9.4336 9.4336 9.9249 9.9249 k = 0.3992 0.4490 0.2464 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0034 -26.0034 -26.0032 -26.0032 -11.8599 -11.8599 -11.2292 -11.2292 -10.8384 -10.8384 -10.6901 -10.6901 -9.6569 -9.6569 -9.6437 -9.6437 -9.4099 -9.4099 -9.4014 -9.4014 -9.3693 -9.3693 -9.3550 -9.3550 -1.2080 -1.2080 -1.0526 -1.0526 -0.4138 -0.4138 0.2697 0.2697 0.3892 0.3892 0.7796 0.7796 0.9056 0.9056 0.9501 0.9501 1.1517 1.1517 1.2340 1.2340 1.3246 1.3246 1.5378 1.5378 7.7723 7.7723 7.9899 7.9899 8.6630 8.6630 8.8481 8.8481 9.4850 9.4850 9.9882 9.9882 k = 0.3914 0.4663 0.2653 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0033 -26.0033 -26.0032 -26.0032 -11.8492 -11.8492 -11.2401 -11.2401 -10.8389 -10.8389 -10.6930 -10.6930 -9.6555 -9.6555 -9.6436 -9.6436 -9.4096 -9.4096 -9.4011 -9.4011 -9.3672 -9.3672 -9.3541 -9.3541 -1.2149 -1.2149 -1.0390 -1.0390 -0.4031 -0.4031 0.2607 0.2607 0.3474 0.3474 0.7557 0.7557 0.8992 0.8992 0.9548 0.9548 1.1459 1.1459 1.2257 1.2257 1.3215 1.3215 1.5580 1.5580 7.8300 7.8300 8.0298 8.0298 8.7263 8.7263 8.8936 8.8936 9.5399 9.5399 10.0553 10.0553 k = 0.3837 0.4836 0.2843 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0032 -26.0032 -11.8379 -11.8379 -11.2518 -11.2518 -10.8394 -10.8394 -10.6960 -10.6960 -9.6542 -9.6542 -9.6435 -9.6435 -9.4093 -9.4093 -9.4008 -9.4008 -9.3652 -9.3652 -9.3531 -9.3531 -1.2219 -1.2219 -1.0247 -1.0247 -0.3917 -0.3917 0.2501 0.2501 0.3072 0.3072 0.7308 0.7308 0.8927 0.8927 0.9605 0.9605 1.1399 1.1399 1.2173 1.2173 1.3189 1.3189 1.5761 1.5761 7.8902 7.8902 8.0723 8.0723 8.7902 8.7902 8.9427 8.9427 9.5981 9.5981 10.1259 10.1259 k = 0.3759 0.5009 0.3032 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0031 -26.0031 -11.8259 -11.8259 -11.2641 -11.2641 -10.8399 -10.8399 -10.6990 -10.6990 -9.6529 -9.6529 -9.6434 -9.6434 -9.4091 -9.4091 -9.4003 -9.4003 -9.3633 -9.3633 -9.3520 -9.3520 -1.2289 -1.2289 -1.0098 -1.0098 -0.3796 -0.3796 0.2352 0.2352 0.2717 0.2717 0.7049 0.7049 0.8861 0.8861 0.9669 0.9669 1.1336 1.1336 1.2085 1.2085 1.3167 1.3167 1.5924 1.5924 7.9526 7.9526 8.1173 8.1173 8.8531 8.8531 8.9964 8.9964 9.6592 9.6592 10.1996 10.1996 k = 0.3682 0.5182 0.3222 ( 9800 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0031 -26.0031 -11.8134 -11.8134 -11.2770 -11.2770 -10.8403 -10.8403 -10.7021 -10.7021 -9.6515 -9.6515 -9.6432 -9.6432 -9.4088 -9.4088 -9.3999 -9.3999 -9.3615 -9.3615 -9.3508 -9.3508 -1.2360 -1.2360 -0.9944 -0.9944 -0.3668 -0.3668 0.2086 0.2086 0.2485 0.2485 0.6785 0.6785 0.8796 0.8796 0.9740 0.9740 1.1271 1.1271 1.1997 1.1997 1.3150 1.3150 1.6066 1.6066 8.0167 8.0167 8.1646 8.1646 8.9134 8.9134 9.0557 9.0557 9.7230 9.7230 10.2761 10.2761 k = 0.3604 0.5355 0.3411 ( 9804 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0030 -26.0030 -11.8002 -11.8002 -11.2906 -11.2906 -10.8407 -10.8407 -10.7053 -10.7053 -9.6503 -9.6503 -9.6430 -9.6430 -9.4086 -9.4086 -9.3994 -9.3994 -9.3597 -9.3597 -9.3496 -9.3496 -1.2431 -1.2431 -0.9786 -0.9786 -0.3533 -0.3533 0.1730 0.1730 0.2353 0.2353 0.6518 0.6518 0.8733 0.8733 0.9815 0.9815 1.1205 1.1205 1.1907 1.1907 1.3137 1.3137 1.6189 1.6189 8.0819 8.0819 8.2142 8.2142 8.9701 8.9701 9.1210 9.1210 9.7890 9.7890 10.3550 10.3550 k = 0.3527 0.5528 0.3601 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0029 -26.0029 -11.7866 -11.7866 -11.3046 -11.3046 -10.8410 -10.8410 -10.7084 -10.7084 -9.6491 -9.6491 -9.6427 -9.6427 -9.4084 -9.4084 -9.3989 -9.3989 -9.3581 -9.3581 -9.3483 -9.3483 -1.2501 -1.2501 -0.9627 -0.9627 -0.3392 -0.3392 0.1354 0.1354 0.2253 0.2253 0.6249 0.6249 0.8672 0.8672 0.9895 0.9895 1.1138 1.1138 1.1816 1.1816 1.3129 1.3129 1.6293 1.6293 8.1474 8.1474 8.2658 8.2658 9.0233 9.0233 9.1917 9.1917 9.8567 9.8567 10.4358 10.4358 k = 0.3449 0.5700 0.3790 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0028 -26.0028 -11.7724 -11.7724 -11.3192 -11.3192 -10.8412 -10.8412 -10.7116 -10.7116 -9.6480 -9.6480 -9.6423 -9.6423 -9.4081 -9.4081 -9.3983 -9.3983 -9.3567 -9.3567 -9.3470 -9.3470 -1.2570 -1.2570 -0.9466 -0.9466 -0.3243 -0.3243 0.0980 0.0980 0.2166 0.2166 0.5983 0.5983 0.8613 0.8613 0.9978 0.9978 1.1070 1.1070 1.1724 1.1724 1.3125 1.3125 1.6378 1.6378 8.2127 8.2127 8.3193 8.3193 9.0736 9.0736 9.2664 9.2664 9.9255 9.9255 10.5180 10.5180 k = 0.3372 0.5873 0.3980 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0028 -26.0028 -11.7578 -11.7578 -11.3342 -11.3342 -10.8414 -10.8414 -10.7147 -10.7147 -9.6470 -9.6470 -9.6418 -9.6418 -9.4079 -9.4079 -9.3978 -9.3978 -9.3553 -9.3553 -9.3456 -9.3456 -1.2638 -1.2638 -0.9307 -0.9307 -0.3088 -0.3088 0.0614 0.0614 0.2090 0.2090 0.5722 0.5722 0.8559 0.8559 1.0064 1.0064 1.1003 1.1003 1.1631 1.1631 1.3125 1.3125 1.6444 1.6444 8.2767 8.2767 8.3745 8.3745 9.1218 9.1218 9.3437 9.3437 9.9949 9.9949 10.6006 10.6006 k = 0.3294 0.6046 0.4169 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0027 -26.0027 -11.7428 -11.7428 -11.3496 -11.3496 -10.8414 -10.8414 -10.7179 -10.7179 -9.6462 -9.6462 -9.6412 -9.6412 -9.4076 -9.4076 -9.3973 -9.3973 -9.3541 -9.3541 -9.3443 -9.3443 -1.2704 -1.2704 -0.9151 -0.9151 -0.2927 -0.2927 0.0258 0.0258 0.2025 0.2025 0.5469 0.5469 0.8507 0.8507 1.0150 1.0150 1.0936 1.0936 1.1538 1.1538 1.3129 1.3129 1.6494 1.6494 8.3386 8.3386 8.4313 8.4313 9.1686 9.1686 9.4224 9.4224 10.0642 10.0642 10.6821 10.6833 k = 0.3217 0.6219 0.4359 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0026 -26.0026 -11.7275 -11.7275 -11.3652 -11.3652 -10.8414 -10.8414 -10.7211 -10.7211 -9.6455 -9.6455 -9.6405 -9.6405 -9.4073 -9.4073 -9.3967 -9.3967 -9.3531 -9.3531 -9.3431 -9.3431 -1.2769 -1.2769 -0.8999 -0.8999 -0.2759 -0.2759 -0.0087 -0.0087 0.1971 0.1971 0.5226 0.5226 0.8461 0.8461 1.0236 1.0236 1.0872 1.0872 1.1445 1.1445 1.3138 1.3138 1.6526 1.6526 8.3972 8.3972 8.4893 8.4893 9.2143 9.2143 9.5012 9.5012 10.1324 10.1324 10.7017 10.7017 k = 0.3139 0.6392 0.4548 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0025 -26.0025 -11.7119 -11.7119 -11.3811 -11.3811 -10.8412 -10.8412 -10.7243 -10.7243 -9.6450 -9.6450 -9.6396 -9.6396 -9.4070 -9.4070 -9.3962 -9.3962 -9.3522 -9.3522 -9.3418 -9.3418 -1.2832 -1.2832 -0.8854 -0.8854 -0.2585 -0.2585 -0.0419 -0.0419 0.1930 0.1930 0.4998 0.4998 0.8418 0.8418 1.0319 1.0319 1.0812 1.0812 1.1352 1.1352 1.3150 1.3150 1.6543 1.6543 8.4515 8.4515 8.5485 8.5485 9.2592 9.2592 9.5790 9.5790 10.1987 10.1987 10.7115 10.7115 k = 0.3061 0.6565 0.4738 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0024 -26.0024 -11.6962 -11.6962 -11.3971 -11.3971 -10.8410 -10.8410 -10.7275 -10.7275 -9.6445 -9.6445 -9.6387 -9.6387 -9.4066 -9.4066 -9.3956 -9.3956 -9.3514 -9.3514 -9.3407 -9.3407 -1.2893 -1.2893 -0.8719 -0.8719 -0.2405 -0.2405 -0.0738 -0.0738 0.1903 0.1903 0.4786 0.4786 0.8381 0.8381 1.0392 1.0392 1.0762 1.0762 1.1260 1.1260 1.3166 1.3166 1.6544 1.6544 8.5003 8.5003 8.6084 8.6084 9.3030 9.3030 9.6550 9.6550 10.2618 10.2618 10.7198 10.7198 k = 0.2984 0.6738 0.4927 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0024 -26.0024 -11.6804 -11.6804 -11.4130 -11.4130 -10.8406 -10.8406 -10.7307 -10.7307 -9.6442 -9.6442 -9.6378 -9.6378 -9.4063 -9.4063 -9.3950 -9.3950 -9.3507 -9.3507 -9.3398 -9.3398 -1.2951 -1.2951 -0.8594 -0.8594 -0.2219 -0.2219 -0.1044 -0.1044 0.1891 0.1891 0.4595 0.4595 0.8348 0.8348 1.0440 1.0440 1.0735 1.0735 1.1170 1.1170 1.3186 1.3186 1.6532 1.6532 8.5426 8.5426 8.6687 8.6687 9.3453 9.3453 9.7279 9.7279 10.3203 10.3203 10.7258 10.7258 k = 0.2906 0.6911 0.5117 ( 9821 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0033 -26.0033 -26.0023 -26.0023 -11.6648 -11.6648 -11.4287 -11.4287 -10.8400 -10.8400 -10.7339 -10.7339 -9.6438 -9.6438 -9.6369 -9.6369 -9.4059 -9.4059 -9.3944 -9.3944 -9.3502 -9.3502 -9.3389 -9.3389 -1.3007 -1.3007 -0.8484 -0.8484 -0.2028 -0.2028 -0.1336 -0.1336 0.1896 0.1896 0.4426 0.4426 0.8321 0.8321 1.0445 1.0445 1.0748 1.0748 1.1085 1.1085 1.3209 1.3209 1.6506 1.6506 8.5773 8.5773 8.7292 8.7292 9.3852 9.3852 9.7967 9.7967 10.3721 10.3721 10.7288 10.7288 k = 0.2829 0.7084 0.5306 ( 9829 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6496 -11.6496 -11.4439 -11.4439 -10.8394 -10.8394 -10.7370 -10.7370 -9.6436 -9.6436 -9.6360 -9.6360 -9.4056 -9.4056 -9.3938 -9.3938 -9.3498 -9.3498 -9.3382 -9.3382 -1.3061 -1.3061 -0.8389 -0.8389 -0.1834 -0.1834 -0.1611 -0.1611 0.1917 0.1917 0.4282 0.4282 0.8298 0.8298 1.0410 1.0410 1.0788 1.0788 1.1014 1.1014 1.3236 1.3236 1.6469 1.6469 8.6035 8.6035 8.7893 8.7893 9.4211 9.4211 9.8603 9.8603 10.4151 10.4151 10.7284 10.7284 k = 0.2751 0.7257 0.5496 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6352 -11.6352 -11.4582 -11.4582 -10.8386 -10.8386 -10.7402 -10.7402 -9.6433 -9.6433 -9.6351 -9.6351 -9.4052 -9.4052 -9.3931 -9.3931 -9.3494 -9.3494 -9.3377 -9.3377 -1.3111 -1.3111 -0.8312 -0.8312 -0.1887 -0.1887 -0.1618 -0.1618 0.1957 0.1957 0.4167 0.4167 0.8278 0.8278 1.0355 1.0355 1.0806 1.0806 1.0989 1.0989 1.3267 1.3267 1.6420 1.6420 8.6207 8.6207 8.8485 8.8485 9.4511 9.4511 9.9175 9.9175 10.4470 10.4470 10.7245 10.7245 k = 0.2751 0.7257 0.5496 ( 9825 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0022 -26.0022 -11.6352 -11.6352 -11.4582 -11.4582 -10.8386 -10.8386 -10.7402 -10.7402 -9.6433 -9.6433 -9.6351 -9.6351 -9.4052 -9.4052 -9.3931 -9.3931 -9.3494 -9.3494 -9.3377 -9.3377 -1.3111 -1.3111 -0.8312 -0.8312 -0.1887 -0.1887 -0.1618 -0.1618 0.1957 0.1957 0.4167 0.4167 0.8278 0.8278 1.0355 1.0355 1.0806 1.0806 1.0989 1.0989 1.3267 1.3267 1.6420 1.6420 8.6207 8.6207 8.8485 8.8485 9.4511 9.4511 9.9175 9.9175 10.4470 10.4470 10.7245 10.7245 k = 0.2501 0.7206 0.5552 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6311 -11.6311 -11.4622 -11.4622 -10.8382 -10.8382 -10.7413 -10.7413 -9.6432 -9.6432 -9.6349 -9.6349 -9.4050 -9.4050 -9.3930 -9.3930 -9.3493 -9.3493 -9.3376 -9.3376 -1.3126 -1.3126 -0.8293 -0.8293 -0.1955 -0.1955 -0.1570 -0.1570 0.1980 0.1980 0.4139 0.4139 0.8280 0.8280 1.0317 1.0317 1.0776 1.0776 1.1031 1.1031 1.3278 1.3278 1.6401 1.6401 8.6250 8.6250 8.8646 8.8646 9.4584 9.4584 9.9343 9.9343 10.4508 10.4508 10.7169 10.7169 k = 0.2251 0.7155 0.5608 ( 9827 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6271 -11.6271 -11.4661 -11.4661 -10.8378 -10.8378 -10.7425 -10.7425 -9.6430 -9.6430 -9.6348 -9.6348 -9.4048 -9.4048 -9.3929 -9.3929 -9.3492 -9.3492 -9.3375 -9.3375 -1.3142 -1.3142 -0.8275 -0.8275 -0.2008 -0.2008 -0.1544 -0.1544 0.2021 0.2021 0.4114 0.4114 0.8294 0.8294 1.0245 1.0245 1.0726 1.0726 1.1112 1.1112 1.3292 1.3292 1.6378 1.6378 8.6305 8.6305 8.8782 8.8782 9.4649 9.4649 9.9525 9.9525 10.4475 10.4475 10.7016 10.7016 k = 0.2001 0.7104 0.5663 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0034 -26.0034 -26.0021 -26.0021 -11.6232 -11.6232 -11.4699 -11.4699 -10.8373 -10.8373 -10.7439 -10.7439 -9.6427 -9.6427 -9.6347 -9.6347 -9.4044 -9.4044 -9.3929 -9.3929 -9.3490 -9.3490 -9.3375 -9.3375 -1.3160 -1.3160 -0.8260 -0.8260 -0.2047 -0.2047 -0.1539 -0.1539 0.2075 0.2075 0.4091 0.4091 0.8321 0.8321 1.0145 1.0145 1.0681 1.0681 1.1202 1.1202 1.3308 1.3308 1.6350 1.6350 8.6371 8.6371 8.8891 8.8891 9.4705 9.4705 9.9716 9.9716 10.4379 10.4379 10.6872 10.6872 k = 0.1751 0.7053 0.5719 ( 9832 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0021 -26.0021 -11.6195 -11.6195 -11.4735 -11.4735 -10.8366 -10.8366 -10.7453 -10.7453 -9.6424 -9.6424 -9.6346 -9.6346 -9.4039 -9.4039 -9.3931 -9.3931 -9.3488 -9.3488 -9.3376 -9.3376 -1.3177 -1.3177 -0.8246 -0.8246 -0.2073 -0.2073 -0.1552 -0.1552 0.2139 0.2139 0.4071 0.4071 0.8362 0.8362 1.0025 1.0025 1.0643 1.0643 1.1289 1.1289 1.3325 1.3325 1.6321 1.6321 8.6448 8.6448 8.8972 8.8972 9.4754 9.4754 9.9906 9.9906 10.4237 10.4237 10.6782 10.6782 k = 0.1501 0.7002 0.5775 ( 9832 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6160 -11.6160 -11.4769 -11.4769 -10.8360 -10.8360 -10.7467 -10.7467 -9.6420 -9.6420 -9.6346 -9.6346 -9.4034 -9.4034 -9.3933 -9.3933 -9.3485 -9.3485 -9.3377 -9.3377 -1.3193 -1.3193 -0.8234 -0.8234 -0.2086 -0.2086 -0.1580 -0.1580 0.2208 0.2208 0.4054 0.4054 0.8416 0.8416 0.9893 0.9893 1.0613 1.0613 1.1370 1.1370 1.3342 1.3342 1.6291 1.6291 8.6530 8.6530 8.9029 8.9029 9.4795 9.4795 10.0086 10.0086 10.4074 10.4074 10.6755 10.6755 k = 0.1251 0.6951 0.5831 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6128 -11.6128 -11.4800 -11.4800 -10.8353 -10.8353 -10.7481 -10.7481 -9.6417 -9.6417 -9.6347 -9.6347 -9.4028 -9.4028 -9.3936 -9.3936 -9.3482 -9.3482 -9.3378 -9.3378 -1.3208 -1.3208 -0.8224 -0.8224 -0.2086 -0.2086 -0.1619 -0.1619 0.2276 0.2276 0.4040 0.4040 0.8483 0.8483 0.9753 0.9753 1.0588 1.0588 1.1442 1.1442 1.3358 1.3358 1.6262 1.6262 8.6615 8.6615 8.9064 8.9064 9.4828 9.4828 10.0246 10.0246 10.3912 10.3912 10.6783 10.6783 k = 0.1000 0.6900 0.5887 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6100 -11.6100 -11.4827 -11.4827 -10.8347 -10.8347 -10.7494 -10.7494 -9.6413 -9.6413 -9.6348 -9.6348 -9.4022 -9.4022 -9.3939 -9.3939 -9.3479 -9.3479 -9.3379 -9.3379 -1.3222 -1.3222 -0.8216 -0.8216 -0.2076 -0.2076 -0.1665 -0.1665 0.2339 0.2339 0.4028 0.4028 0.8562 0.8562 0.9610 0.9610 1.0568 1.0568 1.1503 1.1503 1.3372 1.3372 1.6236 1.6236 8.6697 8.6697 8.9082 8.9082 9.4855 9.4855 10.0379 10.0379 10.3770 10.3770 10.6849 10.6849 k = 0.0750 0.6849 0.5943 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6077 -11.6077 -11.4849 -11.4849 -10.8342 -10.8342 -10.7504 -10.7504 -9.6409 -9.6409 -9.6349 -9.6349 -9.4017 -9.4017 -9.3943 -9.3943 -9.3477 -9.3477 -9.3381 -9.3381 -1.3233 -1.3233 -0.8209 -0.8209 -0.2058 -0.2058 -0.1714 -0.1714 0.2393 0.2393 0.4019 0.4019 0.8653 0.8653 0.9468 0.9468 1.0553 1.0553 1.1552 1.1552 1.3384 1.3384 1.6214 1.6214 8.6769 8.6769 8.9088 8.9088 9.4875 9.4875 10.0482 10.0482 10.3657 10.3657 10.6935 10.6935 k = 0.0500 0.6798 0.5998 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6060 -11.6060 -11.4866 -11.4866 -10.8337 -10.8337 -10.7512 -10.7512 -9.6406 -9.6406 -9.6350 -9.6350 -9.4012 -9.4012 -9.3946 -9.3946 -9.3475 -9.3475 -9.3382 -9.3382 -1.3241 -1.3241 -0.8205 -0.8205 -0.2033 -0.2033 -0.1762 -0.1762 0.2434 0.2434 0.4012 0.4012 0.8751 0.8751 0.9331 0.9331 1.0542 1.0542 1.1587 1.1587 1.3393 1.3393 1.6197 1.6197 8.6827 8.6827 8.9086 8.9086 9.4889 9.4889 10.0552 10.0552 10.3578 10.3578 10.7018 10.7018 k = 0.0250 0.6747 0.6054 ( 9809 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6049 -11.6049 -11.4876 -11.4876 -10.8335 -10.8335 -10.7517 -10.7517 -9.6404 -9.6404 -9.6351 -9.6351 -9.4008 -9.4008 -9.3949 -9.3949 -9.3474 -9.3474 -9.3383 -9.3383 -1.3246 -1.3246 -0.8202 -0.8202 -0.2010 -0.2010 -0.1799 -0.1799 0.2460 0.2460 0.4008 0.4008 0.8847 0.8847 0.9212 0.9212 1.0536 1.0536 1.1609 1.1609 1.3399 1.3399 1.6187 1.6187 8.6863 8.6863 8.9083 8.9083 9.4897 9.4897 10.0592 10.0592 10.3532 10.3532 10.7077 10.7077 k = 0.0000 0.6696 0.6110 ( 9806 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6046 -11.6046 -11.4880 -11.4880 -10.8334 -10.8334 -10.7519 -10.7519 -9.6404 -9.6404 -9.6351 -9.6351 -9.4007 -9.4007 -9.3950 -9.3950 -9.3473 -9.3473 -9.3383 -9.3383 -1.3247 -1.3247 -0.8201 -0.8201 -0.1999 -0.1999 -0.1815 -0.1815 0.2468 0.2468 0.4007 0.4007 0.8899 0.8899 0.9152 0.9152 1.0533 1.0533 1.1616 1.1616 1.3401 1.3401 1.6183 1.6183 8.6876 8.6876 8.9082 8.9082 9.4900 9.4900 10.0605 10.0605 10.3517 10.3517 10.7097 10.7097 k = 0.0000 0.6696 0.6110 ( 9806 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6046 -11.6046 -11.4880 -11.4880 -10.8334 -10.8334 -10.7519 -10.7519 -9.6404 -9.6404 -9.6351 -9.6351 -9.4007 -9.4007 -9.3950 -9.3950 -9.3473 -9.3473 -9.3383 -9.3383 -1.3247 -1.3247 -0.8201 -0.8201 -0.1999 -0.1999 -0.1815 -0.1815 0.2468 0.2468 0.4007 0.4007 0.8899 0.8899 0.9152 0.9152 1.0533 1.0533 1.1616 1.1616 1.3401 1.3401 1.6183 1.6183 8.6876 8.6876 8.9082 8.9082 9.4900 9.4900 10.0605 10.0605 10.3517 10.3517 10.7097 10.7097 k = 0.0078 0.6522 0.6301 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6043 -11.6043 -11.4880 -11.4880 -10.8333 -10.8333 -10.7520 -10.7520 -9.6406 -9.6406 -9.6350 -9.6350 -9.4009 -9.4009 -9.3949 -9.3949 -9.3475 -9.3475 -9.3383 -9.3383 -1.3335 -1.3335 -0.8107 -0.8107 -0.1996 -0.1996 -0.1813 -0.1813 0.2318 0.2318 0.4158 0.4158 0.8893 0.8893 0.9139 0.9139 1.0503 1.0503 1.1669 1.1669 1.3393 1.3393 1.6185 1.6185 8.6894 8.6894 8.9079 8.9079 9.4898 9.4898 10.0576 10.0576 10.3526 10.3526 10.6955 10.6955 k = 0.0156 0.6348 0.6492 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6035 -11.6035 -11.4879 -11.4879 -10.8329 -10.8329 -10.7523 -10.7523 -9.6412 -9.6412 -9.6347 -9.6347 -9.4013 -9.4013 -9.3946 -9.3946 -9.3479 -9.3479 -9.3385 -9.3385 -1.3580 -1.3580 -0.7844 -0.7844 -0.1985 -0.1985 -0.1809 -0.1809 0.1972 0.1972 0.4506 0.4506 0.8867 0.8867 0.9105 0.9105 1.0432 1.0432 1.1810 1.1810 1.3372 1.3372 1.6190 1.6190 8.6948 8.6948 8.9069 8.9069 9.4890 9.4890 10.0492 10.0492 10.3554 10.3554 10.6618 10.6618 k = 0.0234 0.6174 0.6683 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0020 -26.0020 -11.6022 -11.6022 -11.4878 -11.4878 -10.8323 -10.8323 -10.7529 -10.7529 -9.6421 -9.6421 -9.6344 -9.6344 -9.4020 -9.4020 -9.3943 -9.3943 -9.3486 -9.3486 -9.3387 -9.3387 -1.3944 -1.3944 -0.7452 -0.7452 -0.1967 -0.1967 -0.1803 -0.1803 0.1554 0.1554 0.4926 0.4926 0.8808 0.8808 0.9067 0.9067 1.0356 1.0356 1.2001 1.2001 1.3337 1.3337 1.6198 1.6198 8.7038 8.7038 8.9052 8.9052 9.4875 9.4875 10.0361 10.0361 10.3600 10.3600 10.6218 10.6218 k = 0.0312 0.5999 0.6874 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0019 -26.0019 -11.6004 -11.6004 -11.4877 -11.4877 -10.8315 -10.8315 -10.7536 -10.7536 -9.6432 -9.6432 -9.6340 -9.6340 -9.4029 -9.4029 -9.3939 -9.3939 -9.3495 -9.3495 -9.3390 -9.3390 -1.4385 -1.4385 -0.6971 -0.6971 -0.1943 -0.1943 -0.1796 -0.1796 0.1114 0.1114 0.5366 0.5366 0.8704 0.8704 0.9042 0.9042 1.0299 1.0299 1.2217 1.2217 1.3291 1.3291 1.6209 1.6209 8.7161 8.7161 8.9030 8.9030 9.4850 9.4850 10.0192 10.0192 10.3664 10.3664 10.5808 10.5808 k = 0.0391 0.5825 0.7065 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0019 -26.0019 -11.5980 -11.5980 -11.4875 -11.4875 -10.8305 -10.8305 -10.7546 -10.7546 -9.6444 -9.6444 -9.6336 -9.6336 -9.4039 -9.4039 -9.3935 -9.3935 -9.3507 -9.3507 -9.3394 -9.3394 -1.4873 -1.4873 -0.6431 -0.6431 -0.1914 -0.1914 -0.1790 -0.1790 0.0674 0.0674 0.5797 0.5797 0.8565 0.8565 0.9031 0.9031 1.0269 1.0269 1.2439 1.2439 1.3240 1.3240 1.6222 1.6222 8.7317 8.7317 8.9001 8.9001 9.4811 9.4811 9.9994 9.9994 10.3743 10.3743 10.5406 10.5406 k = 0.0469 0.5651 0.7256 ( 9818 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0035 -26.0035 -26.0019 -26.0019 -11.5952 -11.5952 -11.4873 -11.4873 -10.8293 -10.8293 -10.7557 -10.7557 -9.6458 -9.6458 -9.6333 -9.6333 -9.4050 -9.4050 -9.3932 -9.3932 -9.3520 -9.3520 -9.3400 -9.3400 -1.5388 -1.5388 -0.5854 -0.5854 -0.1886 -0.1886 -0.1786 -0.1786 0.0250 0.0250 0.6198 0.6198 0.8417 0.8417 0.9029 0.9029 1.0270 1.0270 1.2642 1.2642 1.3200 1.3200 1.6237 1.6237 8.7504 8.7504 8.8967 8.8967 9.4756 9.4756 9.9776 9.9776 10.3833 10.3833 10.5013 10.5013 k = 0.0547 0.5477 0.7447 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0035 -26.0035 -26.0019 -26.0019 -11.5919 -11.5919 -11.4871 -11.4871 -10.8279 -10.8279 -10.7571 -10.7571 -9.6473 -9.6473 -9.6331 -9.6331 -9.4062 -9.4062 -9.3929 -9.3929 -9.3536 -9.3536 -9.3406 -9.3406 -1.5917 -1.5917 -0.5256 -0.5256 -0.1877 -0.1877 -0.1775 -0.1775 -0.0144 -0.0144 0.6535 0.6535 0.8296 0.8296 0.9033 0.9033 1.0303 1.0303 1.2776 1.2776 1.3219 1.3219 1.6253 1.6253 8.7719 8.7719 8.8928 8.8928 9.4678 9.4678 9.9542 9.9542 10.3925 10.3925 10.4618 10.4618 k = 0.0625 0.5302 0.7638 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0034 -26.0034 -26.0019 -26.0019 -11.5882 -11.5882 -11.4869 -11.4869 -10.8263 -10.8263 -10.7586 -10.7586 -9.6489 -9.6489 -9.6329 -9.6329 -9.4075 -9.4075 -9.3927 -9.3927 -9.3552 -9.3552 -9.3414 -9.3414 -1.6450 -1.6450 -0.4646 -0.4646 -0.1923 -0.1923 -0.1740 -0.1740 -0.0485 -0.0485 0.6758 0.6758 0.8251 0.8251 0.9040 0.9040 1.0370 1.0370 1.2783 1.2783 1.3352 1.3352 1.6269 1.6269 8.7959 8.7959 8.8886 8.8886 9.4575 9.4575 9.9291 9.9291 10.4006 10.4006 10.4190 10.4190 k = 0.0703 0.5128 0.7829 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0034 -26.0034 -26.0018 -26.0018 -11.5840 -11.5840 -11.4866 -11.4866 -10.8245 -10.8245 -10.7604 -10.7604 -9.6506 -9.6506 -9.6327 -9.6327 -9.4088 -9.4088 -9.3926 -9.3926 -9.3571 -9.3571 -9.3423 -9.3423 -1.6981 -1.6981 -0.4036 -0.4036 -0.2041 -0.2041 -0.1688 -0.1688 -0.0743 -0.0743 0.6822 0.6822 0.8320 0.8320 0.9051 0.9051 1.0476 1.0476 1.2711 1.2711 1.3549 1.3549 1.6285 1.6285 8.8219 8.8219 8.8841 8.8841 9.4441 9.4441 9.9023 9.9023 10.3690 10.3690 10.4071 10.4071 k = 0.0781 0.4954 0.8020 ( 9832 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6223 -38.6223 -26.0034 -26.0034 -26.0018 -26.0018 -11.5795 -11.5795 -11.4863 -11.4863 -10.8225 -10.8225 -10.7623 -10.7623 -9.6523 -9.6523 -9.6327 -9.6327 -9.4102 -9.4102 -9.3925 -9.3925 -9.3590 -9.3590 -9.3433 -9.3433 -1.7506 -1.7506 -0.3448 -0.3448 -0.2224 -0.2224 -0.1628 -0.1628 -0.0899 -0.0899 0.6746 0.6746 0.8479 0.8479 0.9064 0.9064 1.0629 1.0629 1.2607 1.2607 1.3764 1.3764 1.6300 1.6300 8.8496 8.8496 8.8795 8.8795 9.4276 9.4276 9.8734 9.8734 10.3143 10.3143 10.4091 10.4091 k = 0.0859 0.4780 0.8210 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0033 -26.0033 -26.0018 -26.0018 -11.5746 -11.5746 -11.4860 -11.4860 -10.8205 -10.8205 -10.7644 -10.7644 -9.6542 -9.6542 -9.6326 -9.6326 -9.4115 -9.4115 -9.3925 -9.3925 -9.3609 -9.3609 -9.3444 -9.3444 -1.8020 -1.8020 -0.2993 -0.2993 -0.2353 -0.2353 -0.1561 -0.1561 -0.0964 -0.0964 0.6589 0.6589 0.8661 0.8661 0.9082 0.9082 1.0834 1.0834 1.2486 1.2486 1.3980 1.3980 1.6315 1.6315 8.8746 8.8746 8.8787 8.8787 9.4079 9.4079 9.8421 9.8421 10.2576 10.2576 10.4069 10.4069 k = 0.0938 0.4606 0.8401 ( 9836 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0033 -26.0033 -26.0018 -26.0018 -11.5694 -11.5694 -11.4857 -11.4857 -10.8183 -10.8183 -10.7667 -10.7667 -9.6560 -9.6560 -9.6326 -9.6326 -9.4130 -9.4130 -9.3927 -9.3927 -9.3629 -9.3629 -9.3456 -9.3456 -1.8521 -1.8521 -0.3039 -0.3039 -0.2044 -0.2044 -0.1486 -0.1486 -0.0959 -0.0959 0.6394 0.6394 0.8821 0.8821 0.9105 0.9105 1.1091 1.1091 1.2356 1.2356 1.4191 1.4191 1.6328 1.6328 8.8702 8.8702 8.9078 8.9078 9.3851 9.3851 9.8082 9.8082 10.2018 10.2018 10.4015 10.4015 k = 0.1016 0.4431 0.8592 ( 9844 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0033 -26.0033 -26.0017 -26.0017 -11.5640 -11.5640 -11.4853 -11.4853 -10.8160 -10.8160 -10.7691 -10.7691 -9.6580 -9.6580 -9.6327 -9.6327 -9.4144 -9.4144 -9.3930 -9.3930 -9.3649 -9.3649 -9.3468 -9.3468 -1.9008 -1.9008 -0.3332 -0.3332 -0.1578 -0.1578 -0.1388 -0.1388 -0.0873 -0.0873 0.6183 0.6183 0.8939 0.8939 0.9138 0.9138 1.1391 1.1391 1.2218 1.2218 1.4394 1.4394 1.6340 1.6340 8.8659 8.8659 8.9367 8.9367 9.3597 9.3597 9.7716 9.7716 10.1488 10.1488 10.3948 10.3948 k = 0.1094 0.4257 0.8783 ( 9840 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0032 -26.0032 -26.0017 -26.0017 -11.5583 -11.5583 -11.4850 -11.4850 -10.8136 -10.8136 -10.7717 -10.7717 -9.6599 -9.6599 -9.6327 -9.6327 -9.4158 -9.4158 -9.3934 -9.3934 -9.3669 -9.3669 -9.3481 -9.3481 -1.9477 -1.9477 -0.3662 -0.3662 -0.1371 -0.1371 -0.1174 -0.1174 -0.0598 -0.0598 0.5967 0.5967 0.9014 0.9014 0.9183 0.9183 1.1721 1.1721 1.2079 1.2079 1.4589 1.4589 1.6351 1.6351 8.8619 8.8619 8.9644 8.9644 9.3321 9.3321 9.7327 9.7327 10.1001 10.1001 10.3884 10.3884 k = 0.1172 0.4083 0.8974 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0032 -26.0032 -26.0017 -26.0017 -11.5524 -11.5524 -11.4846 -11.4846 -10.8112 -10.8112 -10.7744 -10.7744 -9.6618 -9.6618 -9.6328 -9.6328 -9.4172 -9.4172 -9.3940 -9.3940 -9.3687 -9.3687 -9.3495 -9.3495 -1.9929 -1.9929 -0.3996 -0.3996 -0.1283 -0.1283 -0.1039 -0.1039 -0.0113 -0.0113 0.5752 0.5752 0.9058 0.9058 0.9233 0.9233 1.1904 1.1904 1.2102 1.2102 1.4773 1.4773 1.6361 1.6361 8.8585 8.8585 8.9898 8.9898 9.3031 9.3031 9.6917 9.6917 10.0570 10.0570 10.3830 10.3830 k = 0.1250 0.3909 0.9165 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0032 -26.0032 -26.0016 -26.0016 -11.5464 -11.5464 -11.4843 -11.4843 -10.8087 -10.8087 -10.7772 -10.7772 -9.6638 -9.6638 -9.6329 -9.6329 -9.4186 -9.4186 -9.3948 -9.3948 -9.3704 -9.3704 -9.3509 -9.3509 -2.0360 -2.0360 -0.4323 -0.4323 -0.1203 -0.1203 -0.0958 -0.0958 0.0430 0.0430 0.5543 0.5543 0.9088 0.9088 0.9278 0.9278 1.1765 1.1765 1.2452 1.2452 1.4947 1.4947 1.6369 1.6369 8.8556 8.8556 9.0116 9.0116 9.2734 9.2734 9.6493 9.6493 10.0204 10.0204 10.3781 10.3781 k = 0.1328 0.3734 0.9356 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0031 -26.0031 -26.0016 -26.0016 -11.5404 -11.5404 -11.4839 -11.4839 -10.8062 -10.8062 -10.7800 -10.7800 -9.6657 -9.6657 -9.6330 -9.6330 -9.4199 -9.4199 -9.3958 -9.3958 -9.3720 -9.3720 -9.3524 -9.3524 -2.0770 -2.0770 -0.4638 -0.4638 -0.1124 -0.1124 -0.0889 -0.0889 0.0977 0.0977 0.5341 0.5341 0.9111 0.9111 0.9314 0.9314 1.1613 1.1613 1.2814 1.2814 1.5110 1.5110 1.6376 1.6376 8.8533 8.8533 9.0286 9.0286 9.2442 9.2442 9.6063 9.6063 9.9912 9.9912 10.3725 10.3725 k = 0.1406 0.3560 0.9547 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0031 -26.0031 -26.0015 -26.0015 -11.5343 -11.5343 -11.4836 -11.4836 -10.8037 -10.8037 -10.7829 -10.7829 -9.6676 -9.6676 -9.6331 -9.6331 -9.4211 -9.4211 -9.3970 -9.3970 -9.3733 -9.3733 -9.3539 -9.3539 -2.1159 -2.1159 -0.4939 -0.4939 -0.1047 -0.1047 -0.0824 -0.0824 0.1515 0.1515 0.5150 0.5150 0.9130 0.9130 0.9342 0.9342 1.1458 1.1458 1.3171 1.3171 1.5261 1.5261 1.6382 1.6382 8.8517 8.8517 9.0392 9.0392 9.2166 9.2166 9.5631 9.5631 9.9702 9.9702 10.3640 10.3640 k = 0.1484 0.3386 0.9738 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0015 -26.0015 -11.5283 -11.5283 -11.4832 -11.4832 -10.8013 -10.8013 -10.7858 -10.7858 -9.6694 -9.6694 -9.6333 -9.6333 -9.4223 -9.4223 -9.3984 -9.3984 -9.3744 -9.3744 -9.3554 -9.3554 -2.1524 -2.1524 -0.5223 -0.5223 -0.0973 -0.0973 -0.0762 -0.0762 0.2036 0.2036 0.4970 0.4970 0.9147 0.9147 0.9364 0.9364 1.1302 1.1302 1.3517 1.3517 1.5400 1.5400 1.6388 1.6388 8.8508 8.8508 9.0421 9.0421 9.1919 9.1919 9.5206 9.5206 9.9576 9.9576 10.3504 10.3504 k = 0.1562 0.3212 0.9929 ( 9800 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0015 -26.0015 -11.5224 -11.5224 -11.4829 -11.4829 -10.7989 -10.7989 -10.7887 -10.7887 -9.6712 -9.6712 -9.6334 -9.6334 -9.4234 -9.4234 -9.3999 -9.3999 -9.3753 -9.3753 -9.3568 -9.3568 -2.1866 -2.1866 -0.5490 -0.5490 -0.0902 -0.0902 -0.0701 -0.0701 0.2537 0.2537 0.4802 0.4802 0.9163 0.9163 0.9380 0.9380 1.1146 1.1146 1.3848 1.3848 1.5528 1.5528 1.6393 1.6393 8.8505 8.8505 9.0368 9.0368 9.1709 9.1709 9.4792 9.4792 9.9535 9.9535 10.3312 10.3312 k = 0.1641 0.3038 1.0120 ( 9794 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0030 -26.0030 -26.0015 -26.0015 -11.5166 -11.5166 -11.4826 -11.4826 -10.7967 -10.7967 -10.7916 -10.7916 -9.6729 -9.6729 -9.6335 -9.6335 -9.4244 -9.4244 -9.4015 -9.4015 -9.3760 -9.3760 -9.3583 -9.3583 -2.2182 -2.2182 -0.5738 -0.5738 -0.0834 -0.0834 -0.0642 -0.0642 0.3016 0.3016 0.4647 0.4647 0.9176 0.9176 0.9394 0.9394 1.0991 1.0991 1.4160 1.4160 1.5643 1.5643 1.6399 1.6399 8.8509 8.8509 9.0242 9.0242 9.1535 9.1535 9.4395 9.4395 9.9571 9.9571 10.3078 10.3078 k = 0.1719 0.2863 1.0311 ( 9786 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0014 -26.0014 -11.5111 -11.5111 -11.4823 -11.4823 -10.7946 -10.7946 -10.7943 -10.7943 -9.6745 -9.6745 -9.6336 -9.6336 -9.4253 -9.4253 -9.4033 -9.4033 -9.3766 -9.3766 -9.3597 -9.3597 -2.2474 -2.2474 -0.5967 -0.5967 -0.0770 -0.0770 -0.0586 -0.0586 0.3470 0.3470 0.4507 0.4507 0.9186 0.9186 0.9405 0.9405 1.0838 1.0838 1.4451 1.4451 1.5748 1.5748 1.6406 1.6406 8.8519 8.8519 9.0064 9.0064 9.1385 9.1385 9.4018 9.4018 9.9676 9.9676 10.2824 10.2824 k = 0.1797 0.2689 1.0502 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0014 -26.0014 -11.5059 -11.5059 -11.4820 -11.4820 -10.7971 -10.7971 -10.7924 -10.7924 -9.6760 -9.6760 -9.6337 -9.6337 -9.4261 -9.4261 -9.4050 -9.4050 -9.3770 -9.3770 -9.3611 -9.3611 -2.2740 -2.2740 -0.6175 -0.6175 -0.0712 -0.0712 -0.0533 -0.0533 0.3894 0.3894 0.4382 0.4382 0.9194 0.9194 0.9416 0.9416 1.0687 1.0687 1.4717 1.4717 1.5840 1.5840 1.6414 1.6414 8.8533 8.8533 8.9859 8.9859 9.1247 9.1247 9.3666 9.3666 9.9834 9.9834 10.2568 10.2568 k = 0.1875 0.2515 1.0693 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0014 -26.0014 -11.5010 -11.5010 -11.4817 -11.4817 -10.7996 -10.7996 -10.7905 -10.7905 -9.6774 -9.6774 -9.6338 -9.6338 -9.4268 -9.4268 -9.4068 -9.4068 -9.3772 -9.3772 -9.3624 -9.3624 -2.2979 -2.2979 -0.6363 -0.6363 -0.0659 -0.0659 -0.0484 -0.0484 0.4226 0.4226 0.4334 0.4334 0.9197 0.9197 0.9428 0.9428 1.0540 1.0540 1.4957 1.4957 1.5922 1.5922 1.6423 1.6423 8.8551 8.8551 8.9647 8.9647 9.1114 9.1114 9.3342 9.3342 10.0032 10.0032 10.2324 10.2324 k = 0.1953 0.2341 1.0884 ( 9776 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4966 -11.4966 -11.4815 -11.4815 -10.8019 -10.8019 -10.7888 -10.7888 -9.6786 -9.6786 -9.6339 -9.6339 -9.4273 -9.4273 -9.4084 -9.4084 -9.3774 -9.3774 -9.3637 -9.3637 -2.3191 -2.3191 -0.6530 -0.6530 -0.0612 -0.0612 -0.0439 -0.0439 0.4158 0.4158 0.4668 0.4668 0.9196 0.9196 0.9442 0.9442 1.0398 1.0398 1.5167 1.5167 1.5995 1.5995 1.6434 1.6434 8.8572 8.8572 8.9443 8.9443 9.0985 9.0985 9.3048 9.3048 10.0253 10.0253 10.2099 10.2099 k = 0.2031 0.2166 1.1075 ( 9776 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4926 -11.4926 -11.4813 -11.4813 -10.8040 -10.8040 -10.7873 -10.7873 -9.6797 -9.6797 -9.6340 -9.6340 -9.4278 -9.4278 -9.4100 -9.4100 -9.3774 -9.3774 -9.3648 -9.3648 -2.3376 -2.3376 -0.6675 -0.6675 -0.0572 -0.0572 -0.0398 -0.0398 0.4075 0.4075 0.4996 0.4996 0.9191 0.9191 0.9459 0.9459 1.0263 1.0263 1.5346 1.5346 1.6061 1.6061 1.6447 1.6447 8.8595 8.8595 8.9253 8.9253 9.0863 9.0863 9.2788 9.2788 10.0481 10.0481 10.1897 10.1897 k = 0.2109 0.1992 1.1266 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4892 -11.4892 -11.4810 -11.4810 -10.8058 -10.8058 -10.7859 -10.7859 -9.6807 -9.6807 -9.6341 -9.6341 -9.4281 -9.4281 -9.4114 -9.4114 -9.3774 -9.3774 -9.3659 -9.3659 -2.3533 -2.3533 -0.6798 -0.6798 -0.0538 -0.0538 -0.0363 -0.0363 0.4004 0.4004 0.5287 0.5287 0.9182 0.9182 0.9478 0.9478 1.0136 1.0136 1.5492 1.5492 1.6120 1.6120 1.6459 1.6459 8.8617 8.8617 8.9086 8.9086 9.0752 9.0752 9.2563 9.2563 10.0702 10.0702 10.1723 10.1723 k = 0.2188 0.1818 1.1456 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4863 -11.4863 -11.4808 -11.4808 -10.8074 -10.8074 -10.7848 -10.7848 -9.6815 -9.6815 -9.6341 -9.6341 -9.4284 -9.4284 -9.4126 -9.4126 -9.3773 -9.3773 -9.3668 -9.3668 -2.3661 -2.3661 -0.6900 -0.6900 -0.0510 -0.0510 -0.0333 -0.0333 0.3946 0.3946 0.5536 0.5536 0.9170 0.9170 0.9502 0.9502 1.0019 1.0019 1.5605 1.5605 1.6175 1.6175 1.6471 1.6471 8.8639 8.8639 8.8944 8.8944 9.0656 9.0656 9.2376 9.2376 10.0903 10.0903 10.1580 10.1580 k = 0.2266 0.1644 1.1647 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4842 -11.4842 -11.4806 -11.4806 -10.8086 -10.8086 -10.7839 -10.7839 -9.6821 -9.6821 -9.6342 -9.6342 -9.4285 -9.4285 -9.4137 -9.4137 -9.3772 -9.3772 -9.3675 -9.3675 -2.3762 -2.3762 -0.6979 -0.6979 -0.0488 -0.0488 -0.0310 -0.0310 0.3902 0.3902 0.5738 0.5738 0.9157 0.9157 0.9529 0.9529 0.9916 0.9916 1.5686 1.5686 1.6225 1.6225 1.6481 1.6481 8.8657 8.8657 8.8832 8.8832 9.0577 9.0577 9.2229 9.2229 10.1070 10.1070 10.1468 10.1468 k = 0.2344 0.1469 1.1838 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4828 -11.4828 -11.4802 -11.4802 -10.8095 -10.8095 -10.7833 -10.7833 -9.6826 -9.6826 -9.6342 -9.6342 -9.4286 -9.4286 -9.4144 -9.4144 -9.3771 -9.3771 -9.3681 -9.3681 -2.3834 -2.3834 -0.7035 -0.7035 -0.0473 -0.0473 -0.0293 -0.0293 0.3870 0.3870 0.5887 0.5887 0.9145 0.9145 0.9562 0.9562 0.9827 0.9827 1.5739 1.5739 1.6266 1.6266 1.6487 1.6487 8.8671 8.8671 8.8750 8.8750 9.0519 9.0519 9.2122 9.2122 10.1193 10.1193 10.1393 10.1393 k = 0.2422 0.1295 1.2029 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4821 -11.4821 -11.4799 -11.4799 -10.8101 -10.8101 -10.7829 -10.7829 -9.6829 -9.6829 -9.6342 -9.6342 -9.4286 -9.4286 -9.4149 -9.4149 -9.3771 -9.3771 -9.3685 -9.3685 -2.3877 -2.3877 -0.7069 -0.7069 -0.0464 -0.0464 -0.0282 -0.0282 0.3851 0.3851 0.5979 0.5979 0.9137 0.9137 0.9596 0.9596 0.9758 0.9758 1.5768 1.5768 1.6293 1.6293 1.6490 1.6490 8.8680 8.8680 8.8701 8.8701 9.0484 9.0484 9.2057 9.2057 10.1254 10.1254 10.1362 10.1362 k = 0.2500 0.1121 1.2220 ( 9788 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8103 -10.8103 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4150 -9.4150 -9.3770 -9.3770 -9.3686 -9.3686 -2.3891 -2.3891 -0.7080 -0.7080 -0.0461 -0.0461 -0.0279 -0.0279 0.3845 0.3845 0.6010 0.6010 0.9133 0.9133 0.9617 0.9617 0.9726 0.9726 1.5778 1.5778 1.6302 1.6302 1.6491 1.6491 8.8680 8.8680 8.8688 8.8688 9.0472 9.0472 9.2036 9.2036 10.1264 10.1264 10.1363 10.1363 k = 0.2500 0.1121 1.2220 ( 9788 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8103 -10.8103 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4150 -9.4150 -9.3770 -9.3770 -9.3686 -9.3686 -2.3891 -2.3891 -0.7080 -0.7080 -0.0461 -0.0461 -0.0279 -0.0279 0.3845 0.3845 0.6010 0.6010 0.9133 0.9133 0.9617 0.9617 0.9726 0.9726 1.5778 1.5778 1.6302 1.6302 1.6491 1.6491 8.8680 8.8680 8.8688 8.8688 9.0472 9.0472 9.2036 9.2036 10.1264 10.1264 10.1363 10.1363 k = 0.2708 0.1214 1.2118 ( 9776 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8103 -10.8103 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4150 -9.4150 -9.3771 -9.3771 -9.3685 -9.3685 -2.3889 -2.3889 -0.7078 -0.7078 -0.0468 -0.0468 -0.0272 -0.0272 0.3844 0.3844 0.6006 0.6006 0.9089 0.9089 0.9614 0.9614 0.9783 0.9783 1.5755 1.5755 1.6252 1.6252 1.6554 1.6554 8.8354 8.8354 8.9039 8.9039 9.0382 9.0382 9.2162 9.2162 10.0770 10.0770 10.1834 10.1834 k = 0.2917 0.1308 1.2015 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4820 -11.4820 -11.4798 -11.4798 -10.8102 -10.8102 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4148 -9.4148 -9.3773 -9.3773 -9.3682 -9.3682 -2.3883 -2.3883 -0.7071 -0.7071 -0.0488 -0.0488 -0.0252 -0.0252 0.3840 0.3840 0.5991 0.5991 0.8990 0.8990 0.9606 0.9606 0.9921 0.9921 1.5686 1.5686 1.6177 1.6177 1.6668 1.6668 8.8058 8.8058 8.9397 8.9397 9.0183 9.0183 9.2485 9.2485 10.0210 10.0210 10.2329 10.2329 k = 0.3125 0.1401 1.1913 ( 9781 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4823 -11.4823 -11.4798 -11.4798 -10.8101 -10.8101 -10.7828 -10.7828 -9.6829 -9.6829 -9.6341 -9.6341 -9.4288 -9.4288 -9.4147 -9.4147 -9.3776 -9.3776 -9.3679 -9.3679 -2.3873 -2.3873 -0.7060 -0.7060 -0.0516 -0.0516 -0.0223 -0.0223 0.3833 0.3833 0.5967 0.5967 0.8878 0.8878 0.9597 0.9597 1.0094 1.0094 1.5577 1.5577 1.6118 1.6118 1.6786 1.6786 8.7799 8.7799 8.9624 8.9624 9.0087 9.0087 9.2923 9.2923 9.9632 9.9632 10.2798 10.2798 k = 0.3333 0.1495 1.1811 ( 9778 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4828 -11.4828 -11.4796 -11.4796 -10.8100 -10.8100 -10.7829 -10.7829 -9.6829 -9.6829 -9.6341 -9.6341 -9.4289 -9.4289 -9.4144 -9.4144 -9.3779 -9.3779 -9.3674 -9.3674 -2.3859 -2.3859 -0.7045 -0.7045 -0.0547 -0.0547 -0.0191 -0.0191 0.3823 0.3823 0.5933 0.5933 0.8772 0.8772 0.9585 0.9585 1.0283 1.0283 1.5442 1.5442 1.6073 1.6073 1.6899 1.6899 8.7576 8.7576 8.9471 8.9471 9.0382 9.0382 9.3434 9.3434 9.9044 9.9044 10.3232 10.3232 k = 0.3542 0.1588 1.1708 ( 9778 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4836 -11.4836 -11.4794 -11.4794 -10.8097 -10.8097 -10.7830 -10.7830 -9.6829 -9.6829 -9.6340 -9.6340 -9.4290 -9.4290 -9.4142 -9.4142 -9.3782 -9.3782 -9.3669 -9.3669 -2.3841 -2.3841 -0.7026 -0.7026 -0.0579 -0.0579 -0.0156 -0.0156 0.3810 0.3810 0.5888 0.5888 0.8679 0.8679 0.9571 0.9571 1.0476 1.0476 1.5294 1.5294 1.6036 1.6036 1.7002 1.7002 8.7391 8.7391 8.9217 8.9217 9.0808 9.0808 9.3996 9.3996 9.8448 9.8448 10.3110 10.3110 k = 0.3750 0.1682 1.1606 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4846 -11.4846 -11.4789 -11.4789 -10.8094 -10.8094 -10.7831 -10.7831 -9.6828 -9.6828 -9.6340 -9.6340 -9.4290 -9.4290 -9.4141 -9.4141 -9.3785 -9.3785 -9.3664 -9.3664 -2.3818 -2.3818 -0.7003 -0.7003 -0.0610 -0.0610 -0.0120 -0.0120 0.3794 0.3794 0.5833 0.5833 0.8603 0.8603 0.9554 0.9554 1.0668 1.0668 1.5146 1.5146 1.6001 1.6001 1.7093 1.7093 8.7244 8.7244 8.8964 8.8964 9.1268 9.1268 9.4600 9.4600 9.7851 9.7851 10.2515 10.2515 k = 0.3958 0.1775 1.1504 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4859 -11.4859 -11.4783 -11.4783 -10.8089 -10.8089 -10.7833 -10.7833 -9.6828 -9.6828 -9.6340 -9.6340 -9.4290 -9.4290 -9.4140 -9.4140 -9.3787 -9.3787 -9.3658 -9.3658 -2.3791 -2.3791 -0.6978 -0.6978 -0.0640 -0.0640 -0.0086 -0.0086 0.3777 0.3777 0.5768 0.5768 0.8546 0.8546 0.9534 0.9534 1.0852 1.0852 1.5005 1.5005 1.5966 1.5966 1.7170 1.7170 8.7136 8.7136 8.8728 8.8728 9.1749 9.1749 9.5233 9.5233 9.7260 9.7260 10.1905 10.1905 k = 0.4167 0.1868 1.1401 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4875 -11.4875 -11.4776 -11.4776 -10.8083 -10.8083 -10.7835 -10.7835 -9.6826 -9.6826 -9.6340 -9.6340 -9.4289 -9.4289 -9.4140 -9.4140 -9.3788 -9.3788 -9.3653 -9.3653 -2.3759 -2.3759 -0.6950 -0.6950 -0.0667 -0.0667 -0.0053 -0.0053 0.3760 0.3760 0.5694 0.5694 0.8510 0.8510 0.9509 0.9509 1.1022 1.1022 1.4878 1.4878 1.5929 1.5929 1.7233 1.7233 8.7068 8.7068 8.8516 8.8516 9.2246 9.2246 9.5860 9.5860 9.6709 9.6709 10.1292 10.1292 k = 0.4375 0.1962 1.1299 ( 9787 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4893 -11.4893 -11.4768 -11.4768 -10.8077 -10.8077 -10.7839 -10.7839 -9.6825 -9.6825 -9.6340 -9.6340 -9.4287 -9.4287 -9.4141 -9.4141 -9.3788 -9.3788 -9.3649 -9.3649 -2.3723 -2.3723 -0.6919 -0.6919 -0.0693 -0.0693 -0.0023 -0.0023 0.3743 0.3743 0.5613 0.5613 0.8493 0.8493 0.9479 0.9479 1.1170 1.1170 1.4773 1.4773 1.5890 1.5890 1.7279 1.7279 8.7039 8.7039 8.8328 8.8328 9.2754 9.2754 9.5952 9.5952 9.6727 9.6727 10.0684 10.0684 k = 0.4583 0.2055 1.1196 ( 9803 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4912 -11.4912 -11.4759 -11.4759 -10.8069 -10.8069 -10.7843 -10.7843 -9.6823 -9.6823 -9.6340 -9.6340 -9.4284 -9.4284 -9.4142 -9.4142 -9.3787 -9.3787 -9.3645 -9.3645 -2.3683 -2.3683 -0.6887 -0.6887 -0.0716 -0.0716 0.0004 0.0004 0.3728 0.3728 0.5524 0.5524 0.8497 0.8497 0.9445 0.9445 1.1292 1.1292 1.4696 1.4696 1.5848 1.5848 1.7310 1.7310 8.7049 8.7049 8.8167 8.8167 9.3267 9.3267 9.5433 9.5433 9.7390 9.7390 10.0089 10.0089 k = 0.4792 0.2149 1.1094 ( 9802 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4934 -11.4934 -11.4748 -11.4748 -10.8060 -10.8060 -10.7847 -10.7847 -9.6821 -9.6821 -9.6341 -9.6341 -9.4280 -9.4280 -9.4144 -9.4144 -9.3785 -9.3785 -9.3641 -9.3641 -2.3638 -2.3638 -0.6852 -0.6852 -0.0738 -0.0738 0.0028 0.0028 0.3716 0.3716 0.5430 0.5430 0.8519 0.8519 0.9406 0.9406 1.1380 1.1380 1.4653 1.4653 1.5803 1.5803 1.7325 1.7325 8.7097 8.7097 8.8033 8.8033 9.3763 9.3763 9.4907 9.4907 9.8103 9.8103 9.9522 9.9522 k = 0.5000 0.2242 1.0992 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4958 -11.4958 -11.4737 -11.4737 -10.8051 -10.8051 -10.7852 -10.7852 -9.6818 -9.6818 -9.6342 -9.6342 -9.4276 -9.4276 -9.4146 -9.4146 -9.3783 -9.3783 -9.3638 -9.3638 -2.3589 -2.3589 -0.6816 -0.6816 -0.0757 -0.0757 0.0049 0.0049 0.3708 0.3708 0.5331 0.5331 0.8559 0.8559 0.9362 0.9362 1.1431 1.1431 1.4646 1.4646 1.5756 1.5756 1.7323 1.7323 8.7184 8.7184 8.7925 8.7925 9.4039 9.4039 9.4616 9.4616 9.8675 9.8675 9.9137 9.9137 k = 0.5000 0.2242 1.0992 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4958 -11.4958 -11.4737 -11.4737 -10.8051 -10.8051 -10.7852 -10.7852 -9.6818 -9.6818 -9.6342 -9.6342 -9.4276 -9.4276 -9.4146 -9.4146 -9.3783 -9.3783 -9.3638 -9.3638 -2.3589 -2.3589 -0.6816 -0.6816 -0.0757 -0.0757 0.0049 0.0049 0.3708 0.3708 0.5331 0.5331 0.8559 0.8559 0.9362 0.9362 1.1431 1.1431 1.4646 1.4646 1.5756 1.5756 1.7323 1.7323 8.7184 8.7184 8.7925 8.7925 9.4039 9.4039 9.4616 9.4616 9.8675 9.8675 9.9137 9.9137 k = 0.5000 0.2242 1.0724 ( 9792 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5029 -11.5029 -11.4702 -11.4702 -10.8023 -10.8023 -10.7868 -10.7868 -9.6809 -9.6809 -9.6345 -9.6345 -9.4265 -9.4265 -9.4150 -9.4150 -9.3776 -9.3776 -9.3629 -9.3629 -2.3442 -2.3442 -0.6707 -0.6707 -0.0814 -0.0814 0.0102 0.0102 0.3693 0.3693 0.5048 0.5048 0.8687 0.8687 0.9240 0.9240 1.1518 1.1518 1.4678 1.4678 1.5620 1.5620 1.7295 1.7295 8.7487 8.7487 8.7662 8.7662 9.3762 9.3762 9.4876 9.4876 9.9062 9.9062 9.9314 9.9314 k = 0.5000 0.2242 1.0455 ( 9790 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5113 -11.5113 -11.4660 -11.4660 -10.7990 -10.7990 -10.7887 -10.7887 -9.6799 -9.6799 -9.6349 -9.6349 -9.4252 -9.4252 -9.4153 -9.4153 -9.3768 -9.3768 -9.3618 -9.3618 -2.3268 -2.3268 -0.6578 -0.6578 -0.0881 -0.0881 0.0166 0.0166 0.3677 0.3677 0.4733 0.4733 0.8800 0.8800 0.9129 0.9129 1.1608 1.1608 1.4708 1.4708 1.5469 1.5469 1.7261 1.7261 8.7373 8.7373 8.7840 8.7840 9.3438 9.3438 9.5184 9.5184 9.9476 9.9476 9.9496 9.9496 k = 0.5000 0.2242 1.0187 ( 9798 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0014 -26.0014 -11.5207 -11.5207 -11.4612 -11.4612 -10.7955 -10.7955 -10.7907 -10.7907 -9.6788 -9.6788 -9.6353 -9.6353 -9.4238 -9.4238 -9.4157 -9.4157 -9.3761 -9.3761 -9.3606 -9.3606 -2.3067 -2.3067 -0.6426 -0.6426 -0.0958 -0.0958 0.0241 0.0241 0.3661 0.3661 0.4389 0.4389 0.8823 0.8823 0.9101 0.9101 1.1698 1.1698 1.4728 1.4728 1.5314 1.5314 1.7221 1.7221 8.7068 8.7068 8.8234 8.8234 9.3067 9.3067 9.5539 9.5539 9.9616 9.9616 9.9951 9.9951 k = 0.5000 0.2242 0.9919 ( 9806 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0015 -26.0015 -11.5312 -11.5312 -11.4558 -11.4558 -10.7932 -10.7932 -10.7914 -10.7914 -9.6775 -9.6775 -9.6357 -9.6357 -9.4223 -9.4223 -9.4159 -9.4159 -9.3753 -9.3753 -9.3593 -9.3593 -2.2841 -2.2841 -0.6254 -0.6254 -0.1045 -0.1045 0.0327 0.0327 0.3641 0.3641 0.4023 0.4023 0.8721 0.8721 0.9194 0.9194 1.1786 1.1786 1.4715 1.4715 1.5180 1.5180 1.7176 1.7176 8.6753 8.6753 8.8664 8.8664 9.2653 9.2653 9.5936 9.5936 9.9694 9.9694 10.0433 10.0433 k = 0.5000 0.2242 0.9651 ( 9804 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0015 -26.0015 -11.5426 -11.5426 -11.4498 -11.4498 -10.7956 -10.7956 -10.7873 -10.7873 -9.6762 -9.6762 -9.6362 -9.6362 -9.4208 -9.4208 -9.4160 -9.4160 -9.3745 -9.3745 -9.3579 -9.3579 -2.2591 -2.2591 -0.6060 -0.6060 -0.1142 -0.1142 0.0422 0.0422 0.3539 0.3539 0.3717 0.3717 0.8581 0.8581 0.9323 0.9323 1.1872 1.1872 1.4633 1.4633 1.5105 1.5105 1.7126 1.7126 8.6432 8.6432 8.9124 8.9124 9.2198 9.2198 9.6374 9.6374 9.9691 9.9691 10.0928 10.0928 k = 0.5000 0.2242 0.9383 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0016 -26.0016 -11.5548 -11.5548 -11.4432 -11.4432 -10.7982 -10.7982 -10.7830 -10.7830 -9.6748 -9.6748 -9.6366 -9.6366 -9.4194 -9.4194 -9.4160 -9.4160 -9.3737 -9.3737 -9.3564 -9.3564 -2.2318 -2.2318 -0.5845 -0.5845 -0.1247 -0.1247 0.0527 0.0527 0.3160 0.3160 0.3668 0.3668 0.8431 0.8431 0.9458 0.9458 1.1955 1.1955 1.4478 1.4478 1.5096 1.5096 1.7070 1.7070 8.6110 8.6110 8.9605 8.9605 9.1702 9.1702 9.6848 9.6848 9.9592 9.9592 10.1430 10.1430 k = 0.5000 0.2242 0.9115 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0016 -26.0016 -11.5677 -11.5677 -11.4360 -11.4360 -10.8009 -10.8009 -10.7785 -10.7785 -9.6733 -9.6733 -9.6371 -9.6371 -9.4183 -9.4183 -9.4155 -9.4155 -9.3729 -9.3729 -9.3550 -9.3550 -2.2024 -2.2024 -0.5609 -0.5609 -0.1359 -0.1359 0.0640 0.0640 0.2717 0.2717 0.3668 0.3668 0.8279 0.8279 0.9593 0.9593 1.2033 1.2033 1.4284 1.4284 1.5121 1.5121 1.7008 1.7008 8.5788 8.5788 9.0100 9.0100 9.1169 9.1169 9.7353 9.7353 9.9394 9.9394 10.1933 10.1933 k = 0.5000 0.2242 0.8847 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0017 -26.0017 -11.5813 -11.5813 -11.4283 -11.4283 -10.8036 -10.8036 -10.7740 -10.7740 -9.6718 -9.6718 -9.6377 -9.6377 -9.4176 -9.4176 -9.4146 -9.4146 -9.3721 -9.3721 -9.3536 -9.3536 -2.1709 -2.1709 -0.5352 -0.5352 -0.1479 -0.1479 0.0759 0.0759 0.2253 0.2253 0.3679 0.3679 0.8129 0.8129 0.9726 0.9726 1.2107 1.2107 1.4074 1.4074 1.5158 1.5158 1.6940 1.6940 8.5470 8.5470 9.0576 9.0576 9.0625 9.0625 9.7884 9.7884 9.9103 9.9103 10.2433 10.2433 k = 0.5000 0.2242 0.8579 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0018 -26.0018 -11.5954 -11.5954 -11.4201 -11.4201 -10.8064 -10.8064 -10.7693 -10.7693 -9.6702 -9.6702 -9.6382 -9.6382 -9.4173 -9.4173 -9.4134 -9.4134 -9.3712 -9.3712 -9.3522 -9.3522 -2.1376 -2.1376 -0.5075 -0.5075 -0.1605 -0.1605 0.0871 0.0871 0.1783 0.1783 0.3701 0.3701 0.7982 0.7982 0.9856 0.9856 1.2176 1.2176 1.3860 1.3860 1.5198 1.5198 1.6867 1.6867 8.5156 8.5156 9.0003 9.0003 9.1096 9.1096 9.8434 9.8434 9.8733 9.8733 10.2924 10.2924 k = 0.5000 0.2242 0.8311 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0019 -26.0019 -11.6099 -11.6099 -11.4114 -11.4114 -10.8092 -10.8092 -10.7647 -10.7647 -9.6686 -9.6686 -9.6388 -9.6388 -9.4169 -9.4169 -9.4122 -9.4122 -9.3703 -9.3703 -9.3510 -9.3510 -2.1027 -2.1027 -0.4778 -0.4778 -0.1737 -0.1737 0.0904 0.0904 0.1383 0.1383 0.3734 0.3734 0.7839 0.7839 0.9982 0.9982 1.2240 1.2240 1.3647 1.3647 1.5236 1.5236 1.6787 1.6787 8.4846 8.4846 8.9377 8.9377 9.1577 9.1577 9.8296 9.8296 9.8996 9.8996 10.3204 10.3204 k = 0.5000 0.2242 0.8043 ( 9840 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0019 -26.0019 -11.6247 -11.6247 -11.4023 -11.4023 -10.8120 -10.8120 -10.7601 -10.7601 -9.6670 -9.6670 -9.6394 -9.6394 -9.4166 -9.4166 -9.4110 -9.4110 -9.3693 -9.3693 -9.3499 -9.3499 -2.0662 -2.0662 -0.4462 -0.4462 -0.1873 -0.1873 0.0587 0.0587 0.1326 0.1326 0.3779 0.3779 0.7703 0.7703 1.0102 1.0102 1.2298 1.2298 1.3440 1.3440 1.5271 1.5271 1.6701 1.6701 8.4541 8.4541 8.8728 8.8728 9.2031 9.2031 9.7806 9.7806 9.9560 9.9560 10.2745 10.2745 k = 0.5000 0.2242 0.7775 ( 9836 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0020 -26.0020 -11.6398 -11.6398 -11.3928 -11.3928 -10.8147 -10.8147 -10.7554 -10.7554 -9.6655 -9.6655 -9.6400 -9.6400 -9.4162 -9.4162 -9.4100 -9.4100 -9.3684 -9.3684 -9.3489 -9.3489 -2.0284 -2.0284 -0.4129 -0.4129 -0.2012 -0.2012 0.0081 0.0081 0.1453 0.1453 0.3837 0.3837 0.7574 0.7574 1.0217 1.0217 1.2350 1.2350 1.3244 1.3244 1.5299 1.5299 1.6609 1.6609 8.4241 8.4241 8.8060 8.8060 9.2445 9.2445 9.7272 9.7272 10.0118 10.0118 10.2277 10.2277 k = 0.5000 0.2242 0.7507 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0021 -26.0021 -11.6550 -11.6550 -11.3829 -11.3829 -10.8173 -10.8173 -10.7509 -10.7509 -9.6639 -9.6639 -9.6406 -9.6406 -9.4157 -9.4157 -9.4091 -9.4091 -9.3674 -9.3674 -9.3482 -9.3482 -1.9895 -1.9895 -0.3781 -0.3781 -0.2153 -0.2153 -0.0462 -0.0462 0.1617 0.1617 0.3909 0.3909 0.7454 0.7454 1.0325 1.0325 1.2392 1.2392 1.3064 1.3064 1.5320 1.5320 1.6510 1.6510 8.3945 8.3945 8.7376 8.7376 9.2803 9.2803 9.6701 9.6701 10.0658 10.0658 10.1676 10.1676 k = 0.5000 0.2242 0.7238 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0029 -26.0029 -26.0022 -26.0022 -11.6704 -11.6704 -11.3727 -11.3727 -10.8198 -10.8198 -10.7463 -10.7463 -9.6624 -9.6624 -9.6413 -9.6413 -9.4152 -9.4152 -9.4083 -9.4083 -9.3666 -9.3666 -9.3476 -9.3476 -1.9496 -1.9496 -0.3424 -0.3424 -0.2294 -0.2294 -0.1017 -0.1017 0.1797 0.1797 0.3994 0.3994 0.7342 0.7342 1.0424 1.0424 1.2420 1.2420 1.2908 1.2908 1.5332 1.5332 1.6406 1.6406 8.3651 8.3651 8.6681 8.6681 9.3085 9.3085 9.6099 9.6099 10.1013 10.1013 10.1168 10.1168 k = 0.5000 0.2242 0.6970 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0023 -26.0023 -11.6857 -11.6857 -11.3623 -11.3623 -10.8222 -10.8222 -10.7419 -10.7419 -9.6609 -9.6609 -9.6420 -9.6420 -9.4146 -9.4146 -9.4077 -9.4077 -9.3657 -9.3657 -9.3472 -9.3472 -1.9090 -1.9090 -0.3079 -0.3079 -0.2420 -0.2420 -0.1569 -0.1569 0.1989 0.1989 0.4094 0.4094 0.7241 0.7241 1.0511 1.0511 1.2422 1.2422 1.2791 1.2791 1.5334 1.5334 1.6296 1.6296 8.3360 8.3360 8.5979 8.5979 9.3272 9.3272 9.5469 9.5469 10.0369 10.0369 10.1134 10.1134 k = 0.5000 0.2242 0.6702 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0023 -26.0023 -11.7011 -11.7011 -11.3516 -11.3516 -10.8244 -10.8244 -10.7375 -10.7375 -9.6595 -9.6595 -9.6427 -9.6427 -9.4140 -9.4140 -9.4072 -9.4072 -9.3650 -9.3650 -9.3470 -9.3470 -1.8677 -1.8677 -0.2869 -0.2869 -0.2463 -0.2463 -0.2062 -0.2062 0.2191 0.2191 0.4210 0.4210 0.7151 0.7151 1.0584 1.0584 1.2383 1.2383 1.2732 1.2732 1.5323 1.5323 1.6180 1.6180 8.3070 8.3070 8.5273 8.5273 9.3345 9.3345 9.4815 9.4815 9.9747 9.9747 10.0921 10.0921 k = 0.5000 0.2242 0.6434 ( 9808 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0024 -26.0024 -11.7163 -11.7163 -11.3407 -11.3407 -10.8265 -10.8265 -10.7332 -10.7332 -9.6581 -9.6581 -9.6435 -9.6435 -9.4133 -9.4133 -9.4068 -9.4068 -9.3644 -9.3644 -9.3470 -9.3470 -1.8261 -1.8261 -0.3035 -0.3035 -0.2627 -0.2627 -0.2048 -0.2048 0.2402 0.2402 0.4341 0.4341 0.7074 0.7074 1.0640 1.0640 1.2315 1.2315 1.2724 1.2724 1.5300 1.5300 1.6060 1.6060 8.2780 8.2780 8.4566 8.4566 9.3296 9.3296 9.4141 9.4141 9.9149 9.9149 10.0822 10.0822 k = 0.5000 0.2242 0.6166 ( 9816 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0025 -26.0025 -11.7313 -11.7313 -11.3297 -11.3297 -10.8283 -10.8283 -10.7290 -10.7290 -9.6569 -9.6569 -9.6442 -9.6442 -9.4127 -9.4127 -9.4065 -9.4065 -9.3640 -9.3640 -9.3471 -9.3471 -1.7843 -1.7843 -0.3487 -0.3487 -0.2849 -0.2849 -0.1680 -0.1680 0.2622 0.2622 0.4487 0.4487 0.7010 0.7010 1.0674 1.0674 1.2245 1.2245 1.2741 1.2741 1.5262 1.5262 1.5935 1.5935 8.2490 8.2490 8.3863 8.3863 9.3124 9.3124 9.3452 9.3452 9.8576 9.8576 10.0840 10.0840 k = 0.5000 0.2242 0.5898 ( 9812 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0026 -26.0026 -11.7460 -11.7460 -11.3187 -11.3187 -10.8300 -10.8300 -10.7248 -10.7248 -9.6557 -9.6557 -9.6450 -9.6450 -9.4120 -9.4120 -9.4063 -9.4063 -9.3637 -9.3637 -9.3475 -9.3475 -1.7424 -1.7424 -0.4028 -0.4028 -0.3012 -0.3012 -0.1269 -0.1269 0.2850 0.2850 0.4649 0.4649 0.6961 0.6961 1.0684 1.0684 1.2193 1.2193 1.2769 1.2769 1.5209 1.5209 1.5807 1.5807 8.2199 8.2199 8.3165 8.3165 9.2741 9.2741 9.2854 9.2854 9.8027 9.8027 10.0964 10.0964 k = 0.5000 0.2242 0.5630 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0030 -26.0030 -26.0027 -26.0027 -11.7605 -11.7605 -11.3076 -11.3076 -10.8314 -10.8314 -10.7207 -10.7207 -9.6548 -9.6548 -9.6457 -9.6457 -9.4114 -9.4114 -9.4061 -9.4061 -9.3637 -9.3637 -9.3480 -9.3480 -1.7007 -1.7007 -0.4584 -0.4584 -0.3161 -0.3161 -0.0845 -0.0845 0.3085 0.3085 0.4826 0.4826 0.6927 0.6927 1.0670 1.0670 1.2164 1.2164 1.2802 1.2802 1.5137 1.5137 1.5678 1.5678 8.1906 8.1906 8.2476 8.2476 9.2034 9.2034 9.2485 9.2485 9.7503 9.7503 10.1176 10.1176 k = 0.5000 0.2242 0.5362 ( 9830 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0031 -26.0031 -26.0028 -26.0028 -11.7747 -11.7747 -11.2965 -11.2965 -10.8327 -10.8327 -10.7167 -10.7167 -9.6541 -9.6541 -9.6463 -9.6463 -9.4108 -9.4108 -9.4060 -9.4060 -9.3639 -9.3639 -9.3486 -9.3486 -1.6593 -1.6593 -0.5139 -0.5139 -0.3302 -0.3302 -0.0419 -0.0419 0.3327 0.3327 0.5018 0.5018 0.6912 0.6912 1.0634 1.0634 1.2158 1.2158 1.2838 1.2838 1.5046 1.5046 1.5548 1.5548 8.1611 8.1611 8.1798 8.1798 9.1318 9.1318 9.2057 9.2057 9.7002 9.7002 10.1456 10.1456 k = 0.5000 0.2242 0.5094 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6452 -38.6452 -38.6222 -38.6222 -26.0031 -26.0031 -26.0029 -26.0029 -11.7884 -11.7884 -11.2855 -11.2855 -10.8338 -10.8338 -10.7128 -10.7128 -9.6536 -9.6536 -9.6467 -9.6467 -9.4103 -9.4103 -9.4059 -9.4059 -9.3643 -9.3643 -9.3493 -9.3493 -1.6184 -1.6184 -0.5685 -0.5685 -0.3439 -0.3439 0.0002 0.0002 0.3575 0.3575 0.5224 0.5224 0.6917 0.6917 1.0580 1.0580 1.2173 1.2173 1.2876 1.2876 1.4935 1.4935 1.5418 1.5418 8.1134 8.1134 8.1315 8.1315 9.0603 9.0603 9.1588 9.1588 9.6524 9.6524 10.1785 10.1785 k = 0.5000 0.2242 0.4826 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0031 -26.0031 -26.0030 -26.0030 -11.8017 -11.8017 -11.2746 -11.2746 -10.8346 -10.8346 -10.7090 -10.7090 -9.6536 -9.6536 -9.6469 -9.6469 -9.4099 -9.4099 -9.4057 -9.4057 -9.3649 -9.3649 -9.3502 -9.3502 -1.5781 -1.5781 -0.6219 -0.6219 -0.3570 -0.3570 0.0413 0.0413 0.3830 0.3830 0.5445 0.5445 0.6944 0.6944 1.0512 1.0512 1.2203 1.2203 1.2917 1.2917 1.4805 1.4805 1.5287 1.5287 8.0486 8.0486 8.1016 8.1016 8.9891 8.9891 9.1093 9.1093 9.6068 9.6068 10.2148 10.2148 k = 0.5000 0.2242 0.4558 ( 9834 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0031 -26.0031 -26.0030 -26.0030 -11.8145 -11.8145 -11.2639 -11.2639 -10.8353 -10.8353 -10.7053 -10.7053 -9.6539 -9.6539 -9.6468 -9.6468 -9.4097 -9.4097 -9.4054 -9.4054 -9.3657 -9.3657 -9.3511 -9.3511 -1.5387 -1.5387 -0.6737 -0.6737 -0.3697 -0.3697 0.0808 0.0808 0.4089 0.4089 0.5678 0.5678 0.6994 0.6994 1.0437 1.0437 1.2243 1.2243 1.2961 1.2961 1.4657 1.4657 1.5155 1.5155 7.9856 7.9856 8.0717 8.0717 8.9188 8.9188 9.0586 9.0586 9.5633 9.5633 10.2534 10.2534 k = 0.5000 0.2242 0.4289 ( 9826 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0031 -26.0031 -26.0031 -26.0031 -11.8268 -11.8268 -11.2535 -11.2535 -10.8358 -10.8358 -10.7016 -10.7016 -9.6546 -9.6546 -9.6466 -9.6466 -9.4096 -9.4096 -9.4051 -9.4051 -9.3667 -9.3667 -9.3520 -9.3520 -1.5003 -1.5003 -0.7237 -0.7237 -0.3818 -0.3818 0.1180 0.1180 0.4353 0.4353 0.5924 0.5924 0.7072 0.7072 1.0358 1.0358 1.2289 1.2289 1.3007 1.3007 1.4493 1.4493 1.5019 1.5019 7.9245 7.9245 8.0418 8.0418 8.8497 8.8497 9.0078 9.0078 9.5218 9.5218 10.2932 10.2932 k = 0.5000 0.2242 0.4021 ( 9820 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0032 -26.0032 -26.0032 -26.0032 -11.8386 -11.8386 -11.2434 -11.2434 -10.8362 -10.8362 -10.6981 -10.6981 -9.6555 -9.6555 -9.6462 -9.6462 -9.4097 -9.4097 -9.4047 -9.4047 -9.3680 -9.3680 -9.3529 -9.3529 -1.4631 -1.4631 -0.7717 -0.7717 -0.3933 -0.3933 0.1523 0.1523 0.4620 0.4620 0.6182 0.6182 0.7177 0.7177 1.0277 1.0277 1.2338 1.2338 1.3056 1.3056 1.4317 1.4317 1.4877 1.4877 7.8657 7.8657 8.0121 8.0121 8.7823 8.7823 8.9577 8.9577 9.4821 9.4821 10.2375 10.2376 k = 0.5000 0.2242 0.3753 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0033 -26.0033 -26.0032 -26.0032 -11.8497 -11.8497 -11.2336 -11.2336 -10.8364 -10.8364 -10.6946 -10.6946 -9.6565 -9.6565 -9.6458 -9.6458 -9.4098 -9.4098 -9.4043 -9.4043 -9.3694 -9.3694 -9.3538 -9.3538 -1.4271 -1.4271 -0.8174 -0.8174 -0.4043 -0.4043 0.1834 0.1834 0.4889 0.4889 0.6449 0.6449 0.7311 0.7311 1.0198 1.0198 1.2388 1.2388 1.3107 1.3107 1.4131 1.4131 1.4727 1.4727 7.8092 7.8092 7.9827 7.9827 8.7169 8.7169 8.9090 8.9090 9.4442 9.4442 10.1484 10.1484 k = 0.5000 0.2242 0.3485 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0033 -26.0033 -26.0032 -26.0032 -11.8602 -11.8602 -11.2242 -11.2242 -10.8365 -10.8365 -10.6913 -10.6913 -9.6576 -9.6576 -9.6454 -9.6454 -9.4101 -9.4101 -9.4038 -9.4038 -9.3709 -9.3709 -9.3547 -9.3547 -1.3927 -1.3927 -0.8607 -0.8607 -0.4146 -0.4146 0.2108 0.2108 0.5159 0.5159 0.6726 0.6726 0.7472 0.7472 1.0122 1.0122 1.2437 1.2437 1.3159 1.3159 1.3936 1.3936 1.4568 1.4568 7.7553 7.7553 7.9539 7.9539 8.6538 8.6538 8.8620 8.8620 9.4080 9.4080 10.0639 10.0639 k = 0.5000 0.2242 0.3217 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0034 -26.0034 -26.0032 -26.0032 -11.8701 -11.8701 -11.2152 -11.2152 -10.8364 -10.8364 -10.6882 -10.6882 -9.6587 -9.6587 -9.6450 -9.6450 -9.4105 -9.4105 -9.4033 -9.4033 -9.3726 -9.3726 -9.3556 -9.3556 -1.3599 -1.3599 -0.9014 -0.9014 -0.4243 -0.4243 0.2345 0.2345 0.5428 0.5428 0.7011 0.7011 0.7659 0.7659 1.0051 1.0051 1.2485 1.2485 1.3212 1.3212 1.3737 1.3737 1.4401 1.4401 7.7041 7.7041 7.9258 7.9258 8.5935 8.5935 8.8174 8.8174 9.3734 9.3734 9.9847 9.9847 k = 0.5000 0.2242 0.2949 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0035 -26.0035 -26.0032 -26.0032 -11.8793 -11.8793 -11.2068 -11.2068 -10.8363 -10.8363 -10.6852 -10.6852 -9.6598 -9.6598 -9.6447 -9.6447 -9.4109 -9.4109 -9.4028 -9.4028 -9.3743 -9.3743 -9.3564 -9.3564 -1.3290 -1.3290 -0.9393 -0.9393 -0.4333 -0.4333 0.2544 0.2544 0.5696 0.5696 0.7302 0.7302 0.7865 0.7865 0.9985 0.9985 1.2530 1.2530 1.3259 1.3259 1.3538 1.3538 1.4225 1.4225 7.6559 7.6559 7.8987 7.8987 8.5364 8.5364 8.7753 8.7753 9.3404 9.3404 9.9112 9.9112 k = 0.5000 0.2242 0.2681 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0035 -26.0035 -26.0032 -26.0032 -11.8877 -11.8877 -11.1989 -11.1989 -10.8360 -10.8360 -10.6824 -10.6824 -9.6609 -9.6609 -9.6445 -9.6445 -9.4114 -9.4114 -9.4023 -9.4023 -9.3761 -9.3761 -9.3571 -9.3571 -1.3001 -1.3001 -0.9744 -0.9744 -0.4415 -0.4415 0.2707 0.2707 0.5959 0.5959 0.7599 0.7599 0.8084 0.8084 0.9926 0.9926 1.2571 1.2571 1.3253 1.3253 1.3391 1.3391 1.4042 1.4042 7.6108 7.6108 7.8728 7.8728 8.4826 8.4826 8.7361 8.7361 9.3090 9.3090 9.8441 9.8441 k = 0.5000 0.2242 0.2413 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0036 -26.0036 -26.0032 -26.0032 -11.8954 -11.8954 -11.1917 -11.1917 -10.8358 -10.8358 -10.6798 -10.6798 -9.6620 -9.6620 -9.6442 -9.6442 -9.4119 -9.4119 -9.4017 -9.4017 -9.3779 -9.3779 -9.3577 -9.3577 -1.2734 -1.2734 -1.0063 -1.0063 -0.4491 -0.4491 0.2838 0.2838 0.6217 0.6217 0.7897 0.7897 0.8310 0.8310 0.9875 0.9875 1.2606 1.2606 1.3086 1.3086 1.3403 1.3403 1.3853 1.3853 7.5691 7.5691 7.8484 7.8484 8.4328 8.4328 8.7000 8.7000 9.2794 9.2794 9.7836 9.7836 k = 0.5000 0.2242 0.2145 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0036 -26.0036 -26.0033 -26.0033 -11.9024 -11.9024 -11.1850 -11.1850 -10.8355 -10.8355 -10.6774 -10.6774 -9.6630 -9.6630 -9.6441 -9.6441 -9.4125 -9.4125 -9.4011 -9.4011 -9.3798 -9.3798 -9.3583 -9.3583 -1.2491 -1.2491 -1.0351 -1.0351 -0.4559 -0.4559 0.2940 0.2940 0.6467 0.6467 0.8192 0.8192 0.8536 0.8536 0.9833 0.9833 1.2626 1.2626 1.2894 1.2894 1.3447 1.3447 1.3663 1.3663 7.5310 7.5310 7.8257 7.8257 8.3870 8.3870 8.6672 8.6672 9.2516 9.2516 9.7299 9.7299 k = 0.5000 0.2242 0.1877 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0037 -26.0037 -26.0033 -26.0033 -11.9086 -11.9086 -11.1791 -11.1791 -10.8351 -10.8351 -10.6752 -10.6752 -9.6640 -9.6640 -9.6440 -9.6440 -9.4130 -9.4130 -9.4004 -9.4004 -9.3816 -9.3816 -9.3588 -9.3588 -1.2274 -1.2274 -1.0604 -1.0604 -0.4619 -0.4619 0.3019 0.3019 0.6706 0.6706 0.8475 0.8475 0.8759 0.8759 0.9801 0.9801 1.2581 1.2581 1.2756 1.2756 1.3442 1.3442 1.3525 1.3525 7.4967 7.4967 7.8051 7.8051 8.3458 8.3458 8.6379 8.6379 9.2259 9.2259 9.6832 9.6832 k = 0.5000 0.2242 0.1609 ( 9804 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0037 -26.0037 -26.0033 -26.0033 -11.9140 -11.9140 -11.1738 -11.1738 -10.8348 -10.8348 -10.6733 -10.6733 -9.6648 -9.6648 -9.6439 -9.6439 -9.4136 -9.4136 -9.3996 -9.3996 -9.3834 -9.3834 -9.3592 -9.3592 -1.2087 -1.2087 -1.0822 -1.0822 -0.4672 -0.4672 0.3079 0.3079 0.6930 0.6930 0.8728 0.8728 0.8986 0.8986 0.9783 0.9783 1.2420 1.2420 1.2722 1.2722 1.3279 1.3279 1.3554 1.3554 7.4664 7.4664 7.7866 7.7866 8.3093 8.3093 8.6123 8.6123 9.2026 9.2026 9.6433 9.6433 k = 0.5000 0.2242 0.1340 ( 9832 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9186 -11.9186 -11.1693 -11.1693 -10.8345 -10.8345 -10.6716 -10.6716 -9.6656 -9.6656 -9.6438 -9.6438 -9.4141 -9.4141 -9.3988 -9.3988 -9.3852 -9.3852 -9.3596 -9.3596 -1.1932 -1.1932 -1.1002 -1.1002 -0.4717 -0.4717 0.3123 0.3123 0.7136 0.7136 0.8927 0.8927 0.9229 0.9229 0.9779 0.9779 1.2230 1.2230 1.2693 1.2693 1.3132 1.3132 1.3594 1.3594 7.4403 7.4403 7.7706 7.7706 8.2779 8.2779 8.5904 8.5904 9.1820 9.1820 9.6101 9.6101 k = 0.5000 0.2242 0.1072 ( 9824 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9224 -11.9224 -11.1656 -11.1656 -10.8342 -10.8342 -10.6702 -10.6702 -9.6662 -9.6662 -9.6438 -9.6438 -9.4145 -9.4145 -9.3978 -9.3978 -9.3869 -9.3869 -9.3598 -9.3598 -1.1814 -1.1814 -1.1139 -1.1139 -0.4753 -0.4753 0.3154 0.3154 0.7317 0.7317 0.9066 0.9066 0.9482 0.9482 0.9790 0.9790 1.2043 1.2043 1.2621 1.2621 1.3040 1.3040 1.3629 1.3629 7.4186 7.4186 7.7573 7.7573 8.2519 8.2519 8.5723 8.5723 9.1646 9.1646 9.5834 9.5834 k = 0.5000 0.2242 0.0804 ( 9822 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9253 -11.9253 -11.1627 -11.1627 -10.8340 -10.8340 -10.6691 -10.6691 -9.6667 -9.6667 -9.6437 -9.6437 -9.4149 -9.4149 -9.3968 -9.3968 -9.3886 -9.3886 -9.3600 -9.3600 -1.1738 -1.1738 -1.1228 -1.1228 -0.4782 -0.4782 0.3176 0.3176 0.7468 0.7468 0.9155 0.9155 0.9725 0.9725 0.9813 0.9813 1.1869 1.1869 1.2513 1.2513 1.3002 1.3002 1.3659 1.3659 7.4016 7.4016 7.7467 7.7467 8.2314 8.2314 8.5582 8.5582 9.1505 9.1505 9.5629 9.5629 k = 0.5000 0.2242 0.0536 ( 9814 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9274 -11.9274 -11.1606 -11.1606 -10.8339 -10.8339 -10.6684 -10.6684 -9.6671 -9.6671 -9.6437 -9.6437 -9.4152 -9.4152 -9.3957 -9.3957 -9.3901 -9.3901 -9.3602 -9.3602 -1.1705 -1.1705 -1.1271 -1.1271 -0.4802 -0.4802 0.3190 0.3190 0.7583 0.7583 0.9208 0.9208 0.9840 0.9840 0.9936 0.9936 1.1717 1.1717 1.2406 1.2406 1.2991 1.2991 1.3681 1.3681 7.3893 7.3893 7.7390 7.7390 8.2166 8.2166 8.5481 8.5481 9.1403 9.1403 9.5485 9.5485 k = 0.5000 0.2242 0.0268 ( 9810 PWs) bands (ev): -71.9784 -71.9784 -38.9230 -38.9230 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9287 -11.9287 -11.1594 -11.1594 -10.8337 -10.8337 -10.6679 -10.6679 -9.6673 -9.6673 -9.6437 -9.6437 -9.4153 -9.4153 -9.3944 -9.3944 -9.3916 -9.3916 -9.3603 -9.3603 -1.1698 -1.1698 -1.1284 -1.1284 -0.4815 -0.4815 0.3197 0.3197 0.7654 0.7654 0.9235 0.9235 0.9861 0.9861 1.0087 1.0087 1.1607 1.1607 1.2330 1.2330 1.2990 1.2990 1.3694 1.3694 7.3819 7.3819 7.7344 7.7344 8.2077 8.2077 8.5420 8.5420 9.1340 9.1340 9.5400 9.5400 k = 0.5000 0.2242 0.0000 ( 9828 PWs) bands (ev): -71.9784 -71.9784 -38.9231 -38.9231 -38.6451 -38.6451 -38.6222 -38.6222 -26.0038 -26.0038 -26.0033 -26.0033 -11.9291 -11.9291 -11.1589 -11.1589 -10.8337 -10.8337 -10.6677 -10.6677 -9.6674 -9.6674 -9.6437 -9.6437 -9.4154 -9.4154 -9.3934 -9.3934 -9.3928 -9.3928 -9.3603 -9.3603 -1.1698 -1.1698 -1.1285 -1.1285 -0.4819 -0.4819 0.3200 0.3200 0.7678 0.7678 0.9243 0.9243 0.9869 0.9869 1.0143 1.0143 1.1565 1.1565 1.2303 1.2303 1.2990 1.2990 1.3699 1.3699 7.3794 7.3794 7.7329 7.7329 8.2047 8.2047 8.5399 8.5399 9.1319 9.1319 9.5371 9.5371 k = 0.0000 0.0000 1.2220 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8112 -10.8112 -10.7818 -10.7818 -9.6837 -9.6837 -9.6335 -9.6335 -9.4302 -9.4302 -9.4135 -9.4135 -9.3801 -9.3801 -9.3656 -9.3656 -2.3897 -2.3897 -0.7040 -0.7040 -0.0641 -0.0641 -0.0061 -0.0061 0.3745 0.3745 0.6011 0.6011 0.8186 0.8186 0.9687 0.9687 1.1194 1.1194 1.4568 1.4568 1.6061 1.6061 1.7383 1.7383 8.6530 8.6530 8.8557 8.8557 9.4075 9.4075 9.4640 9.4640 9.7769 9.7769 9.8662 9.8662 k = 0.0227 0.0102 1.2220 ( 9784 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8112 -10.8112 -10.7818 -10.7818 -9.6836 -9.6836 -9.6335 -9.6335 -9.4302 -9.4302 -9.4135 -9.4135 -9.3800 -9.3800 -9.3656 -9.3656 -2.3897 -2.3897 -0.7041 -0.7041 -0.0639 -0.0639 -0.0064 -0.0064 0.3747 0.3747 0.6011 0.6011 0.8197 0.8197 0.9686 0.9686 1.1169 1.1169 1.4592 1.4592 1.6061 1.6061 1.7374 1.7374 8.6548 8.6548 8.8578 8.8578 9.3683 9.3683 9.5044 9.5044 9.7356 9.7356 9.9088 9.9088 k = 0.0455 0.0204 1.2220 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8111 -10.8111 -10.7819 -10.7819 -9.6836 -9.6836 -9.6336 -9.6336 -9.4301 -9.4301 -9.4136 -9.4136 -9.3799 -9.3799 -9.3658 -9.3658 -2.3897 -2.3897 -0.7043 -0.7043 -0.0632 -0.0632 -0.0073 -0.0073 0.3753 0.3753 0.6011 0.6011 0.8230 0.8230 0.9682 0.9682 1.1097 1.1097 1.4661 1.4661 1.6063 1.6063 1.7345 1.7345 8.6603 8.6603 8.8642 8.8642 9.3114 9.3114 9.5649 9.5649 9.6696 9.6696 9.9786 9.9786 k = 0.0682 0.0306 1.2220 ( 9780 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8111 -10.8111 -10.7820 -10.7820 -9.6835 -9.6835 -9.6336 -9.6336 -9.4299 -9.4299 -9.4137 -9.4137 -9.3796 -9.3796 -9.3660 -9.3660 -2.3896 -2.3896 -0.7047 -0.7047 -0.0621 -0.0621 -0.0088 -0.0088 0.3762 0.3762 0.6010 0.6010 0.8284 0.8284 0.9676 0.9676 1.0984 1.0984 1.4768 1.4768 1.6065 1.6065 1.7299 1.7299 8.6695 8.6695 8.8747 8.8747 9.2542 9.2542 9.6018 9.6018 9.6281 9.6281 10.0524 10.0524 k = 0.0909 0.0408 1.2220 ( 9772 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8109 -10.8109 -10.7821 -10.7821 -9.6835 -9.6835 -9.6337 -9.6337 -9.4298 -9.4298 -9.4139 -9.4139 -9.3793 -9.3793 -9.3663 -9.3663 -2.3896 -2.3896 -0.7052 -0.7052 -0.0605 -0.0605 -0.0108 -0.0108 0.3774 0.3774 0.6010 0.6010 0.8358 0.8358 0.9668 0.9668 1.0838 1.0838 1.4904 1.4904 1.6068 1.6068 1.7234 1.7234 8.6823 8.6823 8.8894 8.8894 9.1983 9.1983 9.5354 9.5354 9.6923 9.6923 10.1269 10.1269 k = 0.1136 0.0510 1.2220 ( 9774 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8108 -10.8108 -10.7822 -10.7822 -9.6834 -9.6834 -9.6338 -9.6338 -9.4296 -9.4296 -9.4141 -9.4141 -9.3789 -9.3789 -9.3667 -9.3667 -2.3895 -2.3895 -0.7057 -0.7057 -0.0586 -0.0586 -0.0132 -0.0132 0.3788 0.3788 0.6010 0.6010 0.8451 0.8451 0.9659 0.9659 1.0670 1.0670 1.5060 1.5060 1.6073 1.6073 1.7153 1.7153 8.6987 8.6987 8.9079 8.9079 9.1442 9.1442 9.4713 9.4713 9.7569 9.7569 10.2008 10.2008 k = 0.1364 0.0611 1.2220 ( 9782 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8107 -10.8107 -10.7824 -10.7824 -9.6833 -9.6833 -9.6339 -9.6339 -9.4293 -9.4293 -9.4143 -9.4143 -9.3785 -9.3785 -9.3671 -9.3671 -2.3894 -2.3894 -0.7063 -0.7063 -0.0563 -0.0563 -0.0160 -0.0160 0.3802 0.3802 0.6010 0.6010 0.8562 0.8562 0.9649 0.9649 1.0487 1.0487 1.5226 1.5226 1.6082 1.6082 1.7055 1.7055 8.7186 8.7186 8.9302 8.9302 9.0920 9.0920 9.4101 9.4101 9.8215 9.8215 10.2726 10.2726 k = 0.1591 0.0713 1.2220 ( 9788 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8106 -10.8106 -10.7825 -10.7825 -9.6832 -9.6832 -9.6340 -9.6340 -9.4291 -9.4291 -9.4146 -9.4146 -9.3781 -9.3781 -9.3675 -9.3675 -2.3893 -2.3893 -0.7069 -0.7069 -0.0538 -0.0538 -0.0190 -0.0190 0.3816 0.3816 0.6010 0.6010 0.8687 0.8687 0.9640 0.9640 1.0296 1.0296 1.5393 1.5393 1.6098 1.6098 1.6944 1.6944 8.7420 8.7420 8.9557 8.9557 9.0422 9.0422 9.3525 9.3525 9.8858 9.8858 10.3327 10.3327 k = 0.1818 0.0815 1.2220 ( 9776 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8104 -10.8104 -10.7826 -10.7826 -9.6831 -9.6831 -9.6341 -9.6341 -9.4289 -9.4289 -9.4147 -9.4147 -9.3777 -9.3777 -9.3679 -9.3679 -2.3892 -2.3892 -0.7073 -0.7073 -0.0512 -0.0512 -0.0221 -0.0221 0.3828 0.3828 0.6010 0.6010 0.8822 0.8822 0.9632 0.9632 1.0107 1.0107 1.5547 1.5547 1.6125 1.6125 1.6821 1.6821 8.7687 8.7687 8.9834 8.9834 8.9949 8.9949 9.2996 9.2996 9.9493 9.9493 10.2905 10.2905 k = 0.2045 0.0917 1.2220 ( 9774 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8104 -10.8104 -10.7827 -10.7827 -9.6830 -9.6830 -9.6342 -9.6342 -9.4288 -9.4288 -9.4149 -9.4149 -9.3773 -9.3773 -9.3683 -9.3683 -2.3892 -2.3892 -0.7077 -0.7077 -0.0488 -0.0488 -0.0249 -0.0249 0.3837 0.3837 0.6010 0.6010 0.8960 0.8960 0.9625 0.9625 0.9930 0.9930 1.5672 1.5672 1.6173 1.6173 1.6691 1.6691 8.7988 8.7988 8.9498 8.9498 9.0120 9.0120 9.2531 9.2531 10.0116 10.0116 10.2409 10.2409 k = 0.2273 0.1019 1.2220 ( 9772 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6452 -38.6452 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8103 -10.8103 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4150 -9.4150 -9.3771 -9.3771 -9.3685 -9.3685 -2.3892 -2.3892 -0.7080 -0.7080 -0.0468 -0.0468 -0.0270 -0.0270 0.3843 0.3843 0.6010 0.6010 0.9080 0.9080 0.9620 0.9620 0.9786 0.9786 1.5752 1.5752 1.6247 1.6247 1.6564 1.6564 8.8320 8.8320 8.9077 8.9077 9.0365 9.0365 9.2179 9.2179 10.0724 10.0724 10.1878 10.1878 k = 0.2500 0.1121 1.2220 ( 9788 PWs) bands (ev): -71.9784 -71.9784 -38.9232 -38.9232 -38.6453 -38.6453 -38.6223 -38.6223 -26.0028 -26.0028 -26.0013 -26.0013 -11.4819 -11.4819 -11.4797 -11.4797 -10.8103 -10.8103 -10.7828 -10.7828 -9.6830 -9.6830 -9.6342 -9.6342 -9.4287 -9.4287 -9.4150 -9.4150 -9.3770 -9.3770 -9.3686 -9.3686 -2.3891 -2.3891 -0.7080 -0.7080 -0.0461 -0.0461 -0.0279 -0.0279 0.3845 0.3845 0.6010 0.6010 0.9133 0.9133 0.9617 0.9617 0.9726 0.9726 1.5778 1.5778 1.6302 1.6302 1.6491 1.6491 8.8680 8.8680 8.8688 8.8688 9.0472 9.0472 9.2036 9.2036 10.1264 10.1264 10.1363 10.1363 Writing output data file K2MgCl4.save init_run : 0.67s CPU 1.10s WALL ( 1 calls) electrons : 659.32s CPU 665.15s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.07s WALL ( 1 calls) potinit : 0.09s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 659.31s CPU 665.14s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.15s CPU 0.23s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.19s WALL ( 282 calls) cegterg : 609.76s CPU 613.96s WALL ( 608 calls) Called by sum_band: Called by *egterg: h_psi : 483.00s CPU 486.34s WALL ( 9527 calls) s_psi : 15.64s CPU 15.54s WALL ( 9527 calls) g_psi : 0.67s CPU 0.67s WALL ( 8637 calls) cdiaghg : 98.79s CPU 100.14s WALL ( 8919 calls) cegterg:over : 19.28s CPU 19.40s WALL ( 8637 calls) cegterg:upda : 19.00s CPU 18.69s WALL ( 8637 calls) cegterg:last : 7.78s CPU 7.87s WALL ( 1172 calls) cdiaghg:chol : 5.89s CPU 5.82s WALL ( 8919 calls) cdiaghg:inve : 4.12s CPU 4.19s WALL ( 8919 calls) cdiaghg:para : 6.87s CPU 6.93s WALL ( 17838 calls) Called by h_psi: h_psi:vloc : 448.22s CPU 451.35s WALL ( 9527 calls) h_psi:vnl : 33.92s CPU 34.11s WALL ( 9527 calls) add_vuspsi : 17.49s CPU 17.50s WALL ( 9527 calls) General routines calbec : 16.40s CPU 16.58s WALL ( 9527 calls) fft : 0.03s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 415.98s CPU 418.17s WALL ( 1002008 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.36s CPU 0.59s WALL ( 564 calls) Parallel routines fft_scatter : 98.94s CPU 99.79s WALL ( 1002031 calls) PWSCF : 11m30.43s CPU 11m59.15s WALL This run was terminated on: 17:19:29 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=