Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:35:43 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: ./CaxSiRhx2.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S 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 82 49 14 1816 844 133 Max 84 50 15 1817 866 134 Sum 2977 1789 517 65389 30769 4801 bravais-lattice index = 14 lattice parameter (alat) = 10.8887 a.u. unit-cell volume = 557.9015 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 55.0000 Ry charge density cutoff = 364.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.888656 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.750597 celldm(5)= -0.750597 celldm(6)= 0.501195 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.501195 0.865335 0.000000 ) a(3) = ( -0.750597 -0.432667 0.499402 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.579192 1.001197 ) b(2) = ( 0.000000 1.155622 1.001197 ) b(3) = ( 0.000000 0.000000 2.002393 ) PseudoPot. # 1 for Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef 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 1169 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 Rh read from file: /users/gautes/Pseudo/Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 05b2c48bcc7a2cf2a48258d60087199c Pseudo is Ultrasoft + core correction, Zval = 17.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1233 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 Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ca 10.00 40.07800 Ca( 1.00) Rh 17.00 102.90550 Rh( 1.00) Si 4.00 28.08550 Si( 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= 357 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 2) = ( 0.0000000 0.0000000 0.0182036), wk = 0.0028011 k( 3) = ( 0.0000000 0.0000000 0.0364072), wk = 0.0028011 k( 4) = ( 0.0000000 0.0000000 0.0546107), wk = 0.0028011 k( 5) = ( 0.0000000 0.0000000 0.0728143), wk = 0.0028011 k( 6) = ( 0.0000000 0.0000000 0.0910179), wk = 0.0028011 k( 7) = ( 0.0000000 0.0000000 0.1092214), wk = 0.0028011 k( 8) = ( 0.0000000 0.0000000 0.1274250), wk = 0.0028011 k( 9) = ( 0.0000000 0.0000000 0.1456286), wk = 0.0028011 k( 10) = ( 0.0000000 0.0000000 0.1638322), wk = 0.0028011 k( 11) = ( 0.0000000 0.0000000 0.1820358), wk = 0.0028011 k( 12) = ( 0.0000000 0.0000000 0.2002393), wk = 0.0028011 k( 13) = ( 0.0000000 0.0000000 0.2184429), wk = 0.0028011 k( 14) = ( 0.0000000 0.0000000 0.2366465), wk = 0.0028011 k( 15) = ( 0.0000000 0.0000000 0.2548501), wk = 0.0028011 k( 16) = ( 0.0000000 0.0000000 0.2730536), wk = 0.0028011 k( 17) = ( 0.0000000 0.0000000 0.2912572), wk = 0.0028011 k( 18) = ( 0.0000000 0.0000000 0.3094608), wk = 0.0028011 k( 19) = ( 0.0000000 0.0000000 0.3276644), wk = 0.0028011 k( 20) = ( 0.0000000 0.0000000 0.3458679), wk = 0.0028011 k( 21) = ( 0.0000000 0.0000000 0.3640715), wk = 0.0028011 k( 22) = ( 0.0000000 0.0000000 0.3822751), wk = 0.0028011 k( 23) = ( 0.0000000 0.0000000 0.4004787), wk = 0.0028011 k( 24) = ( 0.0000000 0.0000000 0.4186822), wk = 0.0028011 k( 25) = ( 0.0000000 0.0000000 0.4368858), wk = 0.0028011 k( 26) = ( 0.0000000 0.0000000 0.4550894), wk = 0.0028011 k( 27) = ( 0.0000000 0.0000000 0.4732930), wk = 0.0028011 k( 28) = ( 0.0000000 0.0000000 0.4914965), wk = 0.0028011 k( 29) = ( 0.0000000 0.0000000 0.5097001), wk = 0.0028011 k( 30) = ( 0.0000000 0.0000000 0.5279037), wk = 0.0028011 k( 31) = ( 0.0000000 0.0000000 0.5461073), wk = 0.0028011 k( 32) = ( 0.0000000 0.0000000 0.5643108), wk = 0.0028011 k( 33) = ( 0.0000000 0.0000000 0.5825144), wk = 0.0028011 k( 34) = ( 0.0000000 0.0000000 0.6007180), wk = 0.0028011 k( 35) = ( 0.0000000 0.0000000 0.6189216), wk = 0.0028011 k( 36) = ( 0.0000000 0.0000000 0.6371251), wk = 0.0028011 k( 37) = ( 0.0000000 0.0000000 0.6553287), wk = 0.0028011 k( 38) = ( 0.0000000 0.0000000 0.6735323), wk = 0.0028011 k( 39) = ( 0.0000000 0.0000000 0.6917359), wk = 0.0028011 k( 40) = ( 0.0000000 0.0000000 0.7099394), wk = 0.0028011 k( 41) = ( 0.0000000 0.0000000 0.7281430), wk = 0.0028011 k( 42) = ( 0.0000000 0.0000000 0.7463466), wk = 0.0028011 k( 43) = ( 0.0000000 0.0000000 0.7645502), wk = 0.0028011 k( 44) = ( 0.0000000 0.0000000 0.7827537), wk = 0.0028011 k( 45) = ( 0.0000000 0.0000000 0.8009573), wk = 0.0028011 k( 46) = ( 0.0000000 0.0000000 0.8191609), wk = 0.0028011 k( 47) = ( 0.0000000 0.0000000 0.8373645), wk = 0.0028011 k( 48) = ( 0.0000000 0.0000000 0.8555681), wk = 0.0028011 k( 49) = ( 0.0000000 0.0000000 0.8737716), wk = 0.0028011 k( 50) = ( 0.0000000 0.0000000 0.8919752), wk = 0.0028011 k( 51) = ( 0.0000000 0.0000000 0.9101788), wk = 0.0028011 k( 52) = ( 0.0000000 0.0000000 0.9283823), wk = 0.0028011 k( 53) = ( 0.0000000 0.0000000 0.9465859), wk = 0.0028011 k( 54) = ( 0.0000000 0.0000000 0.9647895), wk = 0.0028011 k( 55) = ( 0.0000000 0.0000000 0.9829931), wk = 0.0028011 k( 56) = ( 0.0000000 0.0000000 1.0011967), wk = 0.0028011 k( 57) = ( 0.0000000 0.0000000 1.0011967), wk = 0.0028011 k( 58) = ( -0.0083068 0.0144108 1.0011967), wk = 0.0028011 k( 59) = ( -0.0166136 0.0288215 1.0011967), wk = 0.0028011 k( 60) = ( -0.0249204 0.0432323 1.0011967), wk = 0.0028011 k( 61) = ( -0.0332272 0.0576431 1.0011967), wk = 0.0028011 k( 62) = ( -0.0415341 0.0720538 1.0011967), wk = 0.0028011 k( 63) = ( -0.0498409 0.0864646 1.0011967), wk = 0.0028011 k( 64) = ( -0.0581477 0.1008754 1.0011967), wk = 0.0028011 k( 65) = ( -0.0664545 0.1152861 1.0011967), wk = 0.0028011 k( 66) = ( -0.0747613 0.1296969 1.0011967), wk = 0.0028011 k( 67) = ( -0.0830681 0.1441077 1.0011967), wk = 0.0028011 k( 68) = ( -0.0830681 0.1441077 1.0011967), wk = 0.0028011 k( 69) = ( -0.0893852 0.1550668 0.9885472), wk = 0.0028011 k( 70) = ( -0.0957024 0.1660258 0.9758978), wk = 0.0028011 k( 71) = ( -0.1020196 0.1769849 0.9632484), wk = 0.0028011 k( 72) = ( -0.1083367 0.1879440 0.9505990), wk = 0.0028011 k( 73) = ( -0.1146539 0.1989031 0.9379496), wk = 0.0028011 k( 74) = ( -0.1209710 0.2098622 0.9253001), wk = 0.0028011 k( 75) = ( -0.1272881 0.2208212 0.9126507), wk = 0.0028011 k( 76) = ( -0.1336053 0.2317803 0.9000013), wk = 0.0028011 k( 77) = ( -0.1399225 0.2427394 0.8873519), wk = 0.0028011 k( 78) = ( -0.1462396 0.2536985 0.8747025), wk = 0.0028011 k( 79) = ( -0.1525567 0.2646576 0.8620530), wk = 0.0028011 k( 80) = ( -0.1588739 0.2756166 0.8494036), wk = 0.0028011 k( 81) = ( -0.1651911 0.2865757 0.8367542), wk = 0.0028011 k( 82) = ( -0.1715082 0.2975348 0.8241048), wk = 0.0028011 k( 83) = ( -0.1778253 0.3084939 0.8114554), wk = 0.0028011 k( 84) = ( -0.1841425 0.3194530 0.7988060), wk = 0.0028011 k( 85) = ( -0.1904597 0.3304120 0.7861565), wk = 0.0028011 k( 86) = ( -0.1967768 0.3413711 0.7735071), wk = 0.0028011 k( 87) = ( -0.2030939 0.3523302 0.7608577), wk = 0.0028011 k( 88) = ( -0.2094111 0.3632893 0.7482083), wk = 0.0028011 k( 89) = ( -0.2157283 0.3742483 0.7355589), wk = 0.0028011 k( 90) = ( -0.2220454 0.3852074 0.7229094), wk = 0.0028011 k( 91) = ( -0.2283625 0.3961665 0.7102600), wk = 0.0028011 k( 92) = ( -0.2346797 0.4071256 0.6976106), wk = 0.0028011 k( 93) = ( -0.2409969 0.4180847 0.6849612), wk = 0.0028011 k( 94) = ( -0.2473140 0.4290437 0.6723118), wk = 0.0028011 k( 95) = ( -0.2536312 0.4400028 0.6596623), wk = 0.0028011 k( 96) = ( -0.2599483 0.4509619 0.6470129), wk = 0.0028011 k( 97) = ( -0.2662655 0.4619210 0.6343635), wk = 0.0028011 k( 98) = ( -0.2725826 0.4728801 0.6217141), wk = 0.0028011 k( 99) = ( -0.2788998 0.4838391 0.6090647), wk = 0.0028011 k( 100) = ( -0.2852169 0.4947982 0.5964153), wk = 0.0028011 k( 101) = ( -0.2915340 0.5057573 0.5837658), wk = 0.0028011 k( 102) = ( -0.2915340 0.5057573 0.5837658), wk = 0.0028011 k( 103) = ( -0.2851963 0.4947626 0.5710753), wk = 0.0028011 k( 104) = ( -0.2788587 0.4837679 0.5583847), wk = 0.0028011 k( 105) = ( -0.2725210 0.4727731 0.5456941), wk = 0.0028011 k( 106) = ( -0.2661833 0.4617784 0.5330036), wk = 0.0028011 k( 107) = ( -0.2598456 0.4507837 0.5203130), wk = 0.0028011 k( 108) = ( -0.2535079 0.4397890 0.5076225), wk = 0.0028011 k( 109) = ( -0.2471702 0.4287942 0.4949319), wk = 0.0028011 k( 110) = ( -0.2408325 0.4177995 0.4822413), wk = 0.0028011 k( 111) = ( -0.2344948 0.4068048 0.4695508), wk = 0.0028011 k( 112) = ( -0.2281571 0.3958101 0.4568602), wk = 0.0028011 k( 113) = ( -0.2218194 0.3848153 0.4441697), wk = 0.0028011 k( 114) = ( -0.2154817 0.3738206 0.4314791), wk = 0.0028011 k( 115) = ( -0.2091440 0.3628259 0.4187885), wk = 0.0028011 k( 116) = ( -0.2028063 0.3518312 0.4060980), wk = 0.0028011 k( 117) = ( -0.1964686 0.3408364 0.3934074), wk = 0.0028011 k( 118) = ( -0.1901309 0.3298417 0.3807168), wk = 0.0028011 k( 119) = ( -0.1837932 0.3188470 0.3680263), wk = 0.0028011 k( 120) = ( -0.1774555 0.3078523 0.3553357), wk = 0.0028011 k( 121) = ( -0.1711178 0.2968575 0.3426452), wk = 0.0028011 k( 122) = ( -0.1647801 0.2858628 0.3299546), wk = 0.0028011 k( 123) = ( -0.1584424 0.2748681 0.3172640), wk = 0.0028011 k( 124) = ( -0.1521047 0.2638734 0.3045735), wk = 0.0028011 k( 125) = ( -0.1457670 0.2528786 0.2918829), wk = 0.0028011 k( 126) = ( -0.1394293 0.2418839 0.2791924), wk = 0.0028011 k( 127) = ( -0.1330916 0.2308892 0.2665018), wk = 0.0028011 k( 128) = ( -0.1267539 0.2198945 0.2538112), wk = 0.0028011 k( 129) = ( -0.1204162 0.2088998 0.2411207), wk = 0.0028011 k( 130) = ( -0.1140785 0.1979050 0.2284301), wk = 0.0028011 k( 131) = ( -0.1077408 0.1869103 0.2157395), wk = 0.0028011 k( 132) = ( -0.1014031 0.1759156 0.2030490), wk = 0.0028011 k( 133) = ( -0.0950654 0.1649209 0.1903584), wk = 0.0028011 k( 134) = ( -0.0887277 0.1539261 0.1776679), wk = 0.0028011 k( 135) = ( -0.0823901 0.1429314 0.1649773), wk = 0.0028011 k( 136) = ( -0.0760524 0.1319367 0.1522867), wk = 0.0028011 k( 137) = ( -0.0697147 0.1209420 0.1395962), wk = 0.0028011 k( 138) = ( -0.0633770 0.1099472 0.1269056), wk = 0.0028011 k( 139) = ( -0.0570393 0.0989525 0.1142151), wk = 0.0028011 k( 140) = ( -0.0507016 0.0879578 0.1015245), wk = 0.0028011 k( 141) = ( -0.0443639 0.0769631 0.0888339), wk = 0.0028011 k( 142) = ( -0.0380262 0.0659683 0.0761434), wk = 0.0028011 k( 143) = ( -0.0316885 0.0549736 0.0634528), wk = 0.0028011 k( 144) = ( -0.0253508 0.0439789 0.0507623), wk = 0.0028011 k( 145) = ( -0.0190131 0.0329842 0.0380717), wk = 0.0028011 k( 146) = ( -0.0126754 0.0219894 0.0253811), wk = 0.0028011 k( 147) = ( -0.0063377 0.0109947 0.0126906), wk = 0.0028011 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 149) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 150) = ( 0.0156250 0.0090067 -0.0000000), wk = 0.0028011 k( 151) = ( 0.0312500 0.0180135 -0.0000000), wk = 0.0028011 k( 152) = ( 0.0468750 0.0270202 -0.0000000), wk = 0.0028011 k( 153) = ( 0.0625000 0.0360269 -0.0000000), wk = 0.0028011 k( 154) = ( 0.0781250 0.0450337 -0.0000000), wk = 0.0028011 k( 155) = ( 0.0937500 0.0540404 -0.0000000), wk = 0.0028011 k( 156) = ( 0.1093750 0.0630471 -0.0000000), wk = 0.0028011 k( 157) = ( 0.1250000 0.0720538 -0.0000000), wk = 0.0028011 k( 158) = ( 0.1406250 0.0810606 -0.0000000), wk = 0.0028011 k( 159) = ( 0.1562500 0.0900673 -0.0000000), wk = 0.0028011 k( 160) = ( 0.1718750 0.0990740 -0.0000000), wk = 0.0028011 k( 161) = ( 0.1875000 0.1080808 -0.0000000), wk = 0.0028011 k( 162) = ( 0.2031250 0.1170875 -0.0000000), wk = 0.0028011 k( 163) = ( 0.2187500 0.1260942 -0.0000000), wk = 0.0028011 k( 164) = ( 0.2343750 0.1351010 -0.0000000), wk = 0.0028011 k( 165) = ( 0.2500000 0.1441077 -0.0000000), wk = 0.0028011 k( 166) = ( 0.2656250 0.1531144 -0.0000000), wk = 0.0028011 k( 167) = ( 0.2812500 0.1621211 -0.0000000), wk = 0.0028011 k( 168) = ( 0.2968750 0.1711279 -0.0000000), wk = 0.0028011 k( 169) = ( 0.3125000 0.1801346 -0.0000000), wk = 0.0028011 k( 170) = ( 0.3281250 0.1891413 -0.0000000), wk = 0.0028011 k( 171) = ( 0.3437500 0.1981481 -0.0000000), wk = 0.0028011 k( 172) = ( 0.3593750 0.2071548 -0.0000000), wk = 0.0028011 k( 173) = ( 0.3750000 0.2161615 -0.0000000), wk = 0.0028011 k( 174) = ( 0.3906250 0.2251683 -0.0000000), wk = 0.0028011 k( 175) = ( 0.4062500 0.2341750 -0.0000000), wk = 0.0028011 k( 176) = ( 0.4218750 0.2431817 -0.0000000), wk = 0.0028011 k( 177) = ( 0.4375000 0.2521884 -0.0000000), wk = 0.0028011 k( 178) = ( 0.4531250 0.2611952 -0.0000000), wk = 0.0028011 k( 179) = ( 0.4687500 0.2702019 -0.0000000), wk = 0.0028011 k( 180) = ( 0.4843750 0.2792086 -0.0000000), wk = 0.0028011 k( 181) = ( 0.5000000 0.2882154 -0.0000000), wk = 0.0028011 k( 182) = ( 0.5000000 0.2882154 -0.0000000), wk = 0.0028011 k( 183) = ( 0.4936829 0.2991744 0.0126494), wk = 0.0028011 k( 184) = ( 0.4873657 0.3101335 0.0252988), wk = 0.0028011 k( 185) = ( 0.4810486 0.3210926 0.0379483), wk = 0.0028011 k( 186) = ( 0.4747314 0.3320517 0.0505977), wk = 0.0028011 k( 187) = ( 0.4684142 0.3430108 0.0632471), wk = 0.0028011 k( 188) = ( 0.4620971 0.3539698 0.0758965), wk = 0.0028011 k( 189) = ( 0.4557799 0.3649289 0.0885459), wk = 0.0028011 k( 190) = ( 0.4494628 0.3758880 0.1011954), wk = 0.0028011 k( 191) = ( 0.4431457 0.3868471 0.1138448), wk = 0.0028011 k( 192) = ( 0.4368285 0.3978062 0.1264942), wk = 0.0028011 k( 193) = ( 0.4305114 0.4087652 0.1391436), wk = 0.0028011 k( 194) = ( 0.4241942 0.4197243 0.1517930), wk = 0.0028011 k( 195) = ( 0.4178771 0.4306834 0.1644424), wk = 0.0028011 k( 196) = ( 0.4115599 0.4416425 0.1770919), wk = 0.0028011 k( 197) = ( 0.4052427 0.4526016 0.1897413), wk = 0.0028011 k( 198) = ( 0.3989256 0.4635606 0.2023907), wk = 0.0028011 k( 199) = ( 0.3926084 0.4745197 0.2150401), wk = 0.0028011 k( 200) = ( 0.3862913 0.4854788 0.2276895), wk = 0.0028011 k( 201) = ( 0.3799742 0.4964379 0.2403390), wk = 0.0028011 k( 202) = ( 0.3736570 0.5073969 0.2529884), wk = 0.0028011 k( 203) = ( 0.3673399 0.5183560 0.2656378), wk = 0.0028011 k( 204) = ( 0.3610227 0.5293151 0.2782872), wk = 0.0028011 k( 205) = ( 0.3547055 0.5402742 0.2909366), wk = 0.0028011 k( 206) = ( 0.3483884 0.5512333 0.3035861), wk = 0.0028011 k( 207) = ( 0.3420712 0.5621923 0.3162355), wk = 0.0028011 k( 208) = ( 0.3357541 0.5731514 0.3288849), wk = 0.0028011 k( 209) = ( 0.3294370 0.5841105 0.3415343), wk = 0.0028011 k( 210) = ( 0.3231198 0.5950696 0.3541837), wk = 0.0028011 k( 211) = ( 0.3168027 0.6060287 0.3668331), wk = 0.0028011 k( 212) = ( 0.3104855 0.6169877 0.3794826), wk = 0.0028011 k( 213) = ( 0.3041683 0.6279468 0.3921320), wk = 0.0028011 k( 214) = ( 0.2978512 0.6389059 0.4047814), wk = 0.0028011 k( 215) = ( 0.2915340 0.6498650 0.4174308), wk = 0.0028011 k( 216) = ( 0.2915340 0.6498650 0.4174308), wk = 0.0028011 k( 217) = ( 0.2743850 0.6456265 0.4223230), wk = 0.0028011 k( 218) = ( 0.2572359 0.6413881 0.4272152), wk = 0.0028011 k( 219) = ( 0.2400869 0.6371496 0.4321074), wk = 0.0028011 k( 220) = ( 0.2229378 0.6329111 0.4369997), wk = 0.0028011 k( 221) = ( 0.2057887 0.6286727 0.4418919), wk = 0.0028011 k( 222) = ( 0.1886397 0.6244342 0.4467841), wk = 0.0028011 k( 223) = ( 0.1714906 0.6201957 0.4516763), wk = 0.0028011 k( 224) = ( 0.1543416 0.6159573 0.4565685), wk = 0.0028011 k( 225) = ( 0.1371925 0.6117188 0.4614607), wk = 0.0028011 k( 226) = ( 0.1200434 0.6074804 0.4663529), wk = 0.0028011 k( 227) = ( 0.1028944 0.6032419 0.4712451), wk = 0.0028011 k( 228) = ( 0.0857453 0.5990034 0.4761373), wk = 0.0028011 k( 229) = ( 0.0685962 0.5947650 0.4810295), wk = 0.0028011 k( 230) = ( 0.0514472 0.5905265 0.4859217), wk = 0.0028011 k( 231) = ( 0.0342981 0.5862881 0.4908139), wk = 0.0028011 k( 232) = ( 0.0171491 0.5820496 0.4957061), wk = 0.0028011 k( 233) = ( 0.0000000 0.5778111 0.5005983), wk = 0.0028011 k( 234) = ( 0.0000000 0.5778111 0.5005983), wk = 0.0028011 k( 235) = ( 0.0064103 0.5666905 0.5134342), wk = 0.0028011 k( 236) = ( 0.0128205 0.5555699 0.5262700), wk = 0.0028011 k( 237) = ( 0.0192308 0.5444493 0.5391059), wk = 0.0028011 k( 238) = ( 0.0256410 0.5333287 0.5519418), wk = 0.0028011 k( 239) = ( 0.0320513 0.5222081 0.5647776), wk = 0.0028011 k( 240) = ( 0.0384615 0.5110875 0.5776135), wk = 0.0028011 k( 241) = ( 0.0448718 0.4999669 0.5904493), wk = 0.0028011 k( 242) = ( 0.0512821 0.4888463 0.6032852), wk = 0.0028011 k( 243) = ( 0.0576923 0.4777257 0.6161210), wk = 0.0028011 k( 244) = ( 0.0641026 0.4666051 0.6289569), wk = 0.0028011 k( 245) = ( 0.0705128 0.4554845 0.6417927), wk = 0.0028011 k( 246) = ( 0.0769231 0.4443639 0.6546286), wk = 0.0028011 k( 247) = ( 0.0833333 0.4332433 0.6674644), wk = 0.0028011 k( 248) = ( 0.0897436 0.4221227 0.6803003), wk = 0.0028011 k( 249) = ( 0.0961538 0.4110021 0.6931362), wk = 0.0028011 k( 250) = ( 0.1025641 0.3998815 0.7059720), wk = 0.0028011 k( 251) = ( 0.1089744 0.3887609 0.7188079), wk = 0.0028011 k( 252) = ( 0.1153846 0.3776403 0.7316437), wk = 0.0028011 k( 253) = ( 0.1217949 0.3665197 0.7444796), wk = 0.0028011 k( 254) = ( 0.1282051 0.3553991 0.7573154), wk = 0.0028011 k( 255) = ( 0.1346154 0.3442785 0.7701513), wk = 0.0028011 k( 256) = ( 0.1410256 0.3331579 0.7829871), wk = 0.0028011 k( 257) = ( 0.1474359 0.3220373 0.7958230), wk = 0.0028011 k( 258) = ( 0.1538461 0.3109167 0.8086588), wk = 0.0028011 k( 259) = ( 0.1602564 0.2997961 0.8214947), wk = 0.0028011 k( 260) = ( 0.1666667 0.2886755 0.8343306), wk = 0.0028011 k( 261) = ( 0.1730769 0.2775549 0.8471664), wk = 0.0028011 k( 262) = ( 0.1794872 0.2664343 0.8600023), wk = 0.0028011 k( 263) = ( 0.1858974 0.2553137 0.8728381), wk = 0.0028011 k( 264) = ( 0.1923077 0.2441931 0.8856740), wk = 0.0028011 k( 265) = ( 0.1987180 0.2330725 0.8985098), wk = 0.0028011 k( 266) = ( 0.2051282 0.2219519 0.9113457), wk = 0.0028011 k( 267) = ( 0.2115385 0.2108313 0.9241815), wk = 0.0028011 k( 268) = ( 0.2179487 0.1997107 0.9370174), wk = 0.0028011 k( 269) = ( 0.2243590 0.1885901 0.9498532), wk = 0.0028011 k( 270) = ( 0.2307692 0.1774695 0.9626891), wk = 0.0028011 k( 271) = ( 0.2371795 0.1663489 0.9755250), wk = 0.0028011 k( 272) = ( 0.2435897 0.1552283 0.9883608), wk = 0.0028011 k( 273) = ( 0.2500000 0.1441077 1.0011967), wk = 0.0028011 k( 274) = ( 0.2500000 0.1441077 1.0011967), wk = 0.0028011 k( 275) = ( 0.2631579 0.1516923 0.9924422), wk = 0.0028011 k( 276) = ( 0.2763158 0.1592769 0.9836877), wk = 0.0028011 k( 277) = ( 0.2894737 0.1668615 0.9749332), wk = 0.0028011 k( 278) = ( 0.3026316 0.1744461 0.9661788), wk = 0.0028011 k( 279) = ( 0.3157895 0.1820308 0.9574243), wk = 0.0028011 k( 280) = ( 0.3289474 0.1896154 0.9486698), wk = 0.0028011 k( 281) = ( 0.3421053 0.1972000 0.9399153), wk = 0.0028011 k( 282) = ( 0.3552632 0.2047846 0.9311609), wk = 0.0028011 k( 283) = ( 0.3684211 0.2123692 0.9224064), wk = 0.0028011 k( 284) = ( 0.3815789 0.2199538 0.9136519), wk = 0.0028011 k( 285) = ( 0.3947368 0.2275384 0.9048974), wk = 0.0028011 k( 286) = ( 0.4078947 0.2351231 0.8961430), wk = 0.0028011 k( 287) = ( 0.4210526 0.2427077 0.8873885), wk = 0.0028011 k( 288) = ( 0.4342105 0.2502923 0.8786340), wk = 0.0028011 k( 289) = ( 0.4473684 0.2578769 0.8698795), wk = 0.0028011 k( 290) = ( 0.4605263 0.2654615 0.8611251), wk = 0.0028011 k( 291) = ( 0.4736842 0.2730461 0.8523706), wk = 0.0028011 k( 292) = ( 0.4868421 0.2806308 0.8436161), wk = 0.0028011 k( 293) = ( 0.5000000 0.2882154 0.8348616), wk = 0.0028011 k( 294) = ( 0.5000000 0.2882154 0.8348616), wk = 0.0028011 k( 295) = ( 0.5000000 0.2882154 0.8167125), wk = 0.0028011 k( 296) = ( 0.5000000 0.2882154 0.7985633), wk = 0.0028011 k( 297) = ( 0.5000000 0.2882154 0.7804142), wk = 0.0028011 k( 298) = ( 0.5000000 0.2882154 0.7622650), wk = 0.0028011 k( 299) = ( 0.5000000 0.2882154 0.7441158), wk = 0.0028011 k( 300) = ( 0.5000000 0.2882154 0.7259667), wk = 0.0028011 k( 301) = ( 0.5000000 0.2882154 0.7078175), wk = 0.0028011 k( 302) = ( 0.5000000 0.2882154 0.6896683), wk = 0.0028011 k( 303) = ( 0.5000000 0.2882154 0.6715192), wk = 0.0028011 k( 304) = ( 0.5000000 0.2882154 0.6533700), wk = 0.0028011 k( 305) = ( 0.5000000 0.2882154 0.6352208), wk = 0.0028011 k( 306) = ( 0.5000000 0.2882154 0.6170717), wk = 0.0028011 k( 307) = ( 0.5000000 0.2882154 0.5989225), wk = 0.0028011 k( 308) = ( 0.5000000 0.2882154 0.5807733), wk = 0.0028011 k( 309) = ( 0.5000000 0.2882154 0.5626242), wk = 0.0028011 k( 310) = ( 0.5000000 0.2882154 0.5444750), wk = 0.0028011 k( 311) = ( 0.5000000 0.2882154 0.5263258), wk = 0.0028011 k( 312) = ( 0.5000000 0.2882154 0.5081767), wk = 0.0028011 k( 313) = ( 0.5000000 0.2882154 0.4900275), wk = 0.0028011 k( 314) = ( 0.5000000 0.2882154 0.4718783), wk = 0.0028011 k( 315) = ( 0.5000000 0.2882154 0.4537292), wk = 0.0028011 k( 316) = ( 0.5000000 0.2882154 0.4355800), wk = 0.0028011 k( 317) = ( 0.5000000 0.2882154 0.4174308), wk = 0.0028011 k( 318) = ( 0.5000000 0.2882154 0.3992817), wk = 0.0028011 k( 319) = ( 0.5000000 0.2882154 0.3811325), wk = 0.0028011 k( 320) = ( 0.5000000 0.2882154 0.3629833), wk = 0.0028011 k( 321) = ( 0.5000000 0.2882154 0.3448342), wk = 0.0028011 k( 322) = ( 0.5000000 0.2882154 0.3266850), wk = 0.0028011 k( 323) = ( 0.5000000 0.2882154 0.3085358), wk = 0.0028011 k( 324) = ( 0.5000000 0.2882154 0.2903867), wk = 0.0028011 k( 325) = ( 0.5000000 0.2882154 0.2722375), wk = 0.0028011 k( 326) = ( 0.5000000 0.2882154 0.2540883), wk = 0.0028011 k( 327) = ( 0.5000000 0.2882154 0.2359392), wk = 0.0028011 k( 328) = ( 0.5000000 0.2882154 0.2177900), wk = 0.0028011 k( 329) = ( 0.5000000 0.2882154 0.1996408), wk = 0.0028011 k( 330) = ( 0.5000000 0.2882154 0.1814917), wk = 0.0028011 k( 331) = ( 0.5000000 0.2882154 0.1633425), wk = 0.0028011 k( 332) = ( 0.5000000 0.2882154 0.1451933), wk = 0.0028011 k( 333) = ( 0.5000000 0.2882154 0.1270442), wk = 0.0028011 k( 334) = ( 0.5000000 0.2882154 0.1088950), wk = 0.0028011 k( 335) = ( 0.5000000 0.2882154 0.0907458), wk = 0.0028011 k( 336) = ( 0.5000000 0.2882154 0.0725967), wk = 0.0028011 k( 337) = ( 0.5000000 0.2882154 0.0544475), wk = 0.0028011 k( 338) = ( 0.5000000 0.2882154 0.0362983), wk = 0.0028011 k( 339) = ( 0.5000000 0.2882154 0.0181492), wk = 0.0028011 k( 340) = ( 0.5000000 0.2882154 -0.0000000), wk = 0.0028011 k( 341) = ( 0.0000000 0.0000000 1.0011967), wk = 0.0028011 k( 342) = ( 0.0156250 0.0090067 1.0011967), wk = 0.0028011 k( 343) = ( 0.0312500 0.0180135 1.0011967), wk = 0.0028011 k( 344) = ( 0.0468750 0.0270202 1.0011967), wk = 0.0028011 k( 345) = ( 0.0625000 0.0360269 1.0011967), wk = 0.0028011 k( 346) = ( 0.0781250 0.0450337 1.0011967), wk = 0.0028011 k( 347) = ( 0.0937500 0.0540404 1.0011967), wk = 0.0028011 k( 348) = ( 0.1093750 0.0630471 1.0011967), wk = 0.0028011 k( 349) = ( 0.1250000 0.0720538 1.0011967), wk = 0.0028011 k( 350) = ( 0.1406250 0.0810606 1.0011967), wk = 0.0028011 k( 351) = ( 0.1562500 0.0900673 1.0011967), wk = 0.0028011 k( 352) = ( 0.1718750 0.0990740 1.0011967), wk = 0.0028011 k( 353) = ( 0.1875000 0.1080808 1.0011967), wk = 0.0028011 k( 354) = ( 0.2031250 0.1170875 1.0011967), wk = 0.0028011 k( 355) = ( 0.2187500 0.1260942 1.0011967), wk = 0.0028011 k( 356) = ( 0.2343750 0.1351010 1.0011967), wk = 0.0028011 k( 357) = ( 0.2500000 0.1441077 1.0011967), wk = 0.0028011 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 2) = ( 0.0000000 0.0000000 0.0090909), wk = 0.0028011 k( 3) = ( 0.0000000 0.0000000 0.0181818), wk = 0.0028011 k( 4) = ( 0.0000000 0.0000000 0.0272727), wk = 0.0028011 k( 5) = ( 0.0000000 0.0000000 0.0363636), wk = 0.0028011 k( 6) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0028011 k( 7) = ( 0.0000000 0.0000000 0.0545455), wk = 0.0028011 k( 8) = ( 0.0000000 0.0000000 0.0636364), wk = 0.0028011 k( 9) = ( 0.0000000 0.0000000 0.0727273), wk = 0.0028011 k( 10) = ( 0.0000000 0.0000000 0.0818182), wk = 0.0028011 k( 11) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0028011 k( 12) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0028011 k( 13) = ( 0.0000000 0.0000000 0.1090909), wk = 0.0028011 k( 14) = ( 0.0000000 0.0000000 0.1181818), wk = 0.0028011 k( 15) = ( 0.0000000 0.0000000 0.1272727), wk = 0.0028011 k( 16) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0028011 k( 17) = ( 0.0000000 0.0000000 0.1454545), wk = 0.0028011 k( 18) = ( 0.0000000 0.0000000 0.1545455), wk = 0.0028011 k( 19) = ( 0.0000000 0.0000000 0.1636364), wk = 0.0028011 k( 20) = ( 0.0000000 0.0000000 0.1727273), wk = 0.0028011 k( 21) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0028011 k( 22) = ( 0.0000000 0.0000000 0.1909091), wk = 0.0028011 k( 23) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0028011 k( 24) = ( 0.0000000 0.0000000 0.2090909), wk = 0.0028011 k( 25) = ( 0.0000000 0.0000000 0.2181818), wk = 0.0028011 k( 26) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0028011 k( 27) = ( 0.0000000 0.0000000 0.2363636), wk = 0.0028011 k( 28) = ( 0.0000000 0.0000000 0.2454546), wk = 0.0028011 k( 29) = ( 0.0000000 0.0000000 0.2545455), wk = 0.0028011 k( 30) = ( 0.0000000 0.0000000 0.2636364), wk = 0.0028011 k( 31) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0028011 k( 32) = ( 0.0000000 0.0000000 0.2818182), wk = 0.0028011 k( 33) = ( 0.0000000 0.0000000 0.2909091), wk = 0.0028011 k( 34) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0028011 k( 35) = ( 0.0000000 0.0000000 0.3090909), wk = 0.0028011 k( 36) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0028011 k( 37) = ( 0.0000000 0.0000000 0.3272727), wk = 0.0028011 k( 38) = ( 0.0000000 0.0000000 0.3363636), wk = 0.0028011 k( 39) = ( 0.0000000 0.0000000 0.3454546), wk = 0.0028011 k( 40) = ( 0.0000000 0.0000000 0.3545454), wk = 0.0028011 k( 41) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0028011 k( 42) = ( 0.0000000 0.0000000 0.3727273), wk = 0.0028011 k( 43) = ( 0.0000000 0.0000000 0.3818182), wk = 0.0028011 k( 44) = ( 0.0000000 0.0000000 0.3909091), wk = 0.0028011 k( 45) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0028011 k( 46) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0028011 k( 47) = ( 0.0000000 0.0000000 0.4181818), wk = 0.0028011 k( 48) = ( 0.0000000 0.0000000 0.4272727), wk = 0.0028011 k( 49) = ( 0.0000000 0.0000000 0.4363636), wk = 0.0028011 k( 50) = ( 0.0000000 0.0000000 0.4454546), wk = 0.0028011 k( 51) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0028011 k( 52) = ( 0.0000000 0.0000000 0.4636364), wk = 0.0028011 k( 53) = ( 0.0000000 0.0000000 0.4727273), wk = 0.0028011 k( 54) = ( 0.0000000 0.0000000 0.4818182), wk = 0.0028011 k( 55) = ( 0.0000000 0.0000000 0.4909091), wk = 0.0028011 k( 56) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028011 k( 57) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028011 k( 58) = ( -0.0083068 0.0083068 0.5000000), wk = 0.0028011 k( 59) = ( -0.0166136 0.0166136 0.5000000), wk = 0.0028011 k( 60) = ( -0.0249204 0.0249204 0.5000000), wk = 0.0028011 k( 61) = ( -0.0332272 0.0332272 0.5000000), wk = 0.0028011 k( 62) = ( -0.0415341 0.0415341 0.5000000), wk = 0.0028011 k( 63) = ( -0.0498409 0.0498409 0.5000000), wk = 0.0028011 k( 64) = ( -0.0581477 0.0581477 0.5000000), wk = 0.0028011 k( 65) = ( -0.0664545 0.0664545 0.5000000), wk = 0.0028011 k( 66) = ( -0.0747613 0.0747613 0.5000000), wk = 0.0028011 k( 67) = ( -0.0830681 0.0830681 0.5000000), wk = 0.0028011 k( 68) = ( -0.0830681 0.0830681 0.5000000), wk = 0.0028011 k( 69) = ( -0.0893852 0.0893853 0.4936829), wk = 0.0028011 k( 70) = ( -0.0957024 0.0957024 0.4873657), wk = 0.0028011 k( 71) = ( -0.1020196 0.1020196 0.4810486), wk = 0.0028011 k( 72) = ( -0.1083367 0.1083367 0.4747314), wk = 0.0028011 k( 73) = ( -0.1146539 0.1146539 0.4684143), wk = 0.0028011 k( 74) = ( -0.1209710 0.1209710 0.4620971), wk = 0.0028011 k( 75) = ( -0.1272881 0.1272882 0.4557799), wk = 0.0028011 k( 76) = ( -0.1336053 0.1336053 0.4494628), wk = 0.0028011 k( 77) = ( -0.1399225 0.1399225 0.4431457), wk = 0.0028011 k( 78) = ( -0.1462396 0.1462396 0.4368285), wk = 0.0028011 k( 79) = ( -0.1525567 0.1525568 0.4305114), wk = 0.0028011 k( 80) = ( -0.1588739 0.1588739 0.4241942), wk = 0.0028011 k( 81) = ( -0.1651911 0.1651911 0.4178771), wk = 0.0028011 k( 82) = ( -0.1715082 0.1715082 0.4115599), wk = 0.0028011 k( 83) = ( -0.1778253 0.1778254 0.4052427), wk = 0.0028011 k( 84) = ( -0.1841425 0.1841425 0.3989256), wk = 0.0028011 k( 85) = ( -0.1904597 0.1904597 0.3926084), wk = 0.0028011 k( 86) = ( -0.1967768 0.1967768 0.3862913), wk = 0.0028011 k( 87) = ( -0.2030939 0.2030940 0.3799742), wk = 0.0028011 k( 88) = ( -0.2094111 0.2094111 0.3736570), wk = 0.0028011 k( 89) = ( -0.2157283 0.2157283 0.3673399), wk = 0.0028011 k( 90) = ( -0.2220454 0.2220454 0.3610227), wk = 0.0028011 k( 91) = ( -0.2283625 0.2283626 0.3547055), wk = 0.0028011 k( 92) = ( -0.2346797 0.2346797 0.3483884), wk = 0.0028011 k( 93) = ( -0.2409969 0.2409969 0.3420712), wk = 0.0028011 k( 94) = ( -0.2473140 0.2473140 0.3357541), wk = 0.0028011 k( 95) = ( -0.2536312 0.2536312 0.3294370), wk = 0.0028011 k( 96) = ( -0.2599483 0.2599483 0.3231198), wk = 0.0028011 k( 97) = ( -0.2662655 0.2662655 0.3168026), wk = 0.0028011 k( 98) = ( -0.2725826 0.2725826 0.3104855), wk = 0.0028011 k( 99) = ( -0.2788998 0.2788998 0.3041683), wk = 0.0028011 k( 100) = ( -0.2852169 0.2852169 0.2978512), wk = 0.0028011 k( 101) = ( -0.2915340 0.2915341 0.2915340), wk = 0.0028011 k( 102) = ( -0.2915340 0.2915341 0.2915340), wk = 0.0028011 k( 103) = ( -0.2851963 0.2851964 0.2851963), wk = 0.0028011 k( 104) = ( -0.2788587 0.2788587 0.2788587), wk = 0.0028011 k( 105) = ( -0.2725210 0.2725210 0.2725210), wk = 0.0028011 k( 106) = ( -0.2661833 0.2661833 0.2661833), wk = 0.0028011 k( 107) = ( -0.2598456 0.2598456 0.2598456), wk = 0.0028011 k( 108) = ( -0.2535079 0.2535079 0.2535079), wk = 0.0028011 k( 109) = ( -0.2471702 0.2471702 0.2471702), wk = 0.0028011 k( 110) = ( -0.2408325 0.2408325 0.2408325), wk = 0.0028011 k( 111) = ( -0.2344948 0.2344948 0.2344948), wk = 0.0028011 k( 112) = ( -0.2281571 0.2281571 0.2281571), wk = 0.0028011 k( 113) = ( -0.2218194 0.2218194 0.2218194), wk = 0.0028011 k( 114) = ( -0.2154817 0.2154817 0.2154817), wk = 0.0028011 k( 115) = ( -0.2091440 0.2091440 0.2091440), wk = 0.0028011 k( 116) = ( -0.2028063 0.2028063 0.2028063), wk = 0.0028011 k( 117) = ( -0.1964686 0.1964686 0.1964686), wk = 0.0028011 k( 118) = ( -0.1901309 0.1901309 0.1901309), wk = 0.0028011 k( 119) = ( -0.1837932 0.1837932 0.1837932), wk = 0.0028011 k( 120) = ( -0.1774555 0.1774555 0.1774555), wk = 0.0028011 k( 121) = ( -0.1711178 0.1711178 0.1711178), wk = 0.0028011 k( 122) = ( -0.1647801 0.1647801 0.1647801), wk = 0.0028011 k( 123) = ( -0.1584424 0.1584424 0.1584424), wk = 0.0028011 k( 124) = ( -0.1521047 0.1521047 0.1521047), wk = 0.0028011 k( 125) = ( -0.1457670 0.1457670 0.1457670), wk = 0.0028011 k( 126) = ( -0.1394293 0.1394293 0.1394293), wk = 0.0028011 k( 127) = ( -0.1330916 0.1330916 0.1330916), wk = 0.0028011 k( 128) = ( -0.1267539 0.1267539 0.1267539), wk = 0.0028011 k( 129) = ( -0.1204162 0.1204162 0.1204162), wk = 0.0028011 k( 130) = ( -0.1140785 0.1140785 0.1140785), wk = 0.0028011 k( 131) = ( -0.1077408 0.1077408 0.1077408), wk = 0.0028011 k( 132) = ( -0.1014031 0.1014032 0.1014031), wk = 0.0028011 k( 133) = ( -0.0950654 0.0950655 0.0950654), wk = 0.0028011 k( 134) = ( -0.0887277 0.0887278 0.0887277), wk = 0.0028011 k( 135) = ( -0.0823901 0.0823901 0.0823901), wk = 0.0028011 k( 136) = ( -0.0760524 0.0760524 0.0760524), wk = 0.0028011 k( 137) = ( -0.0697147 0.0697147 0.0697147), wk = 0.0028011 k( 138) = ( -0.0633770 0.0633770 0.0633770), wk = 0.0028011 k( 139) = ( -0.0570393 0.0570393 0.0570393), wk = 0.0028011 k( 140) = ( -0.0507016 0.0507016 0.0507016), wk = 0.0028011 k( 141) = ( -0.0443639 0.0443639 0.0443639), wk = 0.0028011 k( 142) = ( -0.0380262 0.0380262 0.0380262), wk = 0.0028011 k( 143) = ( -0.0316885 0.0316885 0.0316885), wk = 0.0028011 k( 144) = ( -0.0253508 0.0253508 0.0253508), wk = 0.0028011 k( 145) = ( -0.0190131 0.0190131 0.0190131), wk = 0.0028011 k( 146) = ( -0.0126754 0.0126754 0.0126754), wk = 0.0028011 k( 147) = ( -0.0063377 0.0063377 0.0063377), wk = 0.0028011 k( 148) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 149) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028011 k( 150) = ( 0.0156250 0.0156250 -0.0156250), wk = 0.0028011 k( 151) = ( 0.0312500 0.0312500 -0.0312500), wk = 0.0028011 k( 152) = ( 0.0468750 0.0468750 -0.0468750), wk = 0.0028011 k( 153) = ( 0.0625000 0.0625000 -0.0625000), wk = 0.0028011 k( 154) = ( 0.0781250 0.0781250 -0.0781250), wk = 0.0028011 k( 155) = ( 0.0937500 0.0937500 -0.0937500), wk = 0.0028011 k( 156) = ( 0.1093750 0.1093750 -0.1093750), wk = 0.0028011 k( 157) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0028011 k( 158) = ( 0.1406250 0.1406250 -0.1406250), wk = 0.0028011 k( 159) = ( 0.1562500 0.1562500 -0.1562500), wk = 0.0028011 k( 160) = ( 0.1718750 0.1718750 -0.1718750), wk = 0.0028011 k( 161) = ( 0.1875000 0.1875000 -0.1875000), wk = 0.0028011 k( 162) = ( 0.2031250 0.2031250 -0.2031250), wk = 0.0028011 k( 163) = ( 0.2187500 0.2187500 -0.2187500), wk = 0.0028011 k( 164) = ( 0.2343750 0.2343750 -0.2343750), wk = 0.0028011 k( 165) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0028011 k( 166) = ( 0.2656250 0.2656250 -0.2656250), wk = 0.0028011 k( 167) = ( 0.2812500 0.2812500 -0.2812500), wk = 0.0028011 k( 168) = ( 0.2968750 0.2968750 -0.2968750), wk = 0.0028011 k( 169) = ( 0.3125000 0.3125000 -0.3125000), wk = 0.0028011 k( 170) = ( 0.3281250 0.3281250 -0.3281250), wk = 0.0028011 k( 171) = ( 0.3437500 0.3437500 -0.3437500), wk = 0.0028011 k( 172) = ( 0.3593750 0.3593750 -0.3593750), wk = 0.0028011 k( 173) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0028011 k( 174) = ( 0.3906250 0.3906250 -0.3906250), wk = 0.0028011 k( 175) = ( 0.4062500 0.4062500 -0.4062500), wk = 0.0028011 k( 176) = ( 0.4218750 0.4218750 -0.4218750), wk = 0.0028011 k( 177) = ( 0.4375000 0.4375000 -0.4375000), wk = 0.0028011 k( 178) = ( 0.4531250 0.4531250 -0.4531250), wk = 0.0028011 k( 179) = ( 0.4687500 0.4687500 -0.4687500), wk = 0.0028011 k( 180) = ( 0.4843750 0.4843750 -0.4843750), wk = 0.0028011 k( 181) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028011 k( 182) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028011 k( 183) = ( 0.4936829 0.5063171 -0.4936829), wk = 0.0028011 k( 184) = ( 0.4873657 0.5126343 -0.4873657), wk = 0.0028011 k( 185) = ( 0.4810486 0.5189514 -0.4810486), wk = 0.0028011 k( 186) = ( 0.4747314 0.5252686 -0.4747314), wk = 0.0028011 k( 187) = ( 0.4684142 0.5315858 -0.4684143), wk = 0.0028011 k( 188) = ( 0.4620971 0.5379029 -0.4620971), wk = 0.0028011 k( 189) = ( 0.4557799 0.5442200 -0.4557799), wk = 0.0028011 k( 190) = ( 0.4494628 0.5505372 -0.4494628), wk = 0.0028011 k( 191) = ( 0.4431457 0.5568544 -0.4431456), wk = 0.0028011 k( 192) = ( 0.4368285 0.5631715 -0.4368285), wk = 0.0028011 k( 193) = ( 0.4305114 0.5694887 -0.4305113), wk = 0.0028011 k( 194) = ( 0.4241942 0.5758058 -0.4241942), wk = 0.0028011 k( 195) = ( 0.4178771 0.5821230 -0.4178770), wk = 0.0028011 k( 196) = ( 0.4115599 0.5884401 -0.4115599), wk = 0.0028011 k( 197) = ( 0.4052427 0.5947573 -0.4052427), wk = 0.0028011 k( 198) = ( 0.3989256 0.6010744 -0.3989256), wk = 0.0028011 k( 199) = ( 0.3926084 0.6073916 -0.3926084), wk = 0.0028011 k( 200) = ( 0.3862913 0.6137087 -0.3862913), wk = 0.0028011 k( 201) = ( 0.3799742 0.6200258 -0.3799741), wk = 0.0028011 k( 202) = ( 0.3736570 0.6263430 -0.3736570), wk = 0.0028011 k( 203) = ( 0.3673399 0.6326601 -0.3673398), wk = 0.0028011 k( 204) = ( 0.3610227 0.6389773 -0.3610227), wk = 0.0028011 k( 205) = ( 0.3547055 0.6452944 -0.3547055), wk = 0.0028011 k( 206) = ( 0.3483884 0.6516116 -0.3483884), wk = 0.0028011 k( 207) = ( 0.3420712 0.6579287 -0.3420712), wk = 0.0028011 k( 208) = ( 0.3357541 0.6642459 -0.3357541), wk = 0.0028011 k( 209) = ( 0.3294370 0.6705631 -0.3294369), wk = 0.0028011 k( 210) = ( 0.3231198 0.6768802 -0.3231198), wk = 0.0028011 k( 211) = ( 0.3168027 0.6831974 -0.3168027), wk = 0.0028011 k( 212) = ( 0.3104855 0.6895145 -0.3104855), wk = 0.0028011 k( 213) = ( 0.3041683 0.6958317 -0.3041683), wk = 0.0028011 k( 214) = ( 0.2978512 0.7021488 -0.2978512), wk = 0.0028011 k( 215) = ( 0.2915340 0.7084660 -0.2915340), wk = 0.0028011 k( 216) = ( 0.2915340 0.7084660 -0.2915340), wk = 0.0028011 k( 217) = ( 0.2743850 0.6962033 -0.2743850), wk = 0.0028011 k( 218) = ( 0.2572359 0.6839406 -0.2572359), wk = 0.0028011 k( 219) = ( 0.2400869 0.6716778 -0.2400869), wk = 0.0028011 k( 220) = ( 0.2229378 0.6594151 -0.2229378), wk = 0.0028011 k( 221) = ( 0.2057887 0.6471524 -0.2057887), wk = 0.0028011 k( 222) = ( 0.1886397 0.6348897 -0.1886397), wk = 0.0028011 k( 223) = ( 0.1714906 0.6226270 -0.1714906), wk = 0.0028011 k( 224) = ( 0.1543416 0.6103643 -0.1543416), wk = 0.0028011 k( 225) = ( 0.1371925 0.5981016 -0.1371925), wk = 0.0028011 k( 226) = ( 0.1200434 0.5858389 -0.1200434), wk = 0.0028011 k( 227) = ( 0.1028944 0.5735762 -0.1028944), wk = 0.0028011 k( 228) = ( 0.0857453 0.5613135 -0.0857453), wk = 0.0028011 k( 229) = ( 0.0685962 0.5490508 -0.0685962), wk = 0.0028011 k( 230) = ( 0.0514472 0.5367881 -0.0514472), wk = 0.0028011 k( 231) = ( 0.0342981 0.5245254 -0.0342981), wk = 0.0028011 k( 232) = ( 0.0171491 0.5122627 -0.0171491), wk = 0.0028011 k( 233) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028011 k( 234) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0028011 k( 235) = ( 0.0064103 0.4935897 0.0064103), wk = 0.0028011 k( 236) = ( 0.0128205 0.4871795 0.0128205), wk = 0.0028011 k( 237) = ( 0.0192308 0.4807692 0.0192308), wk = 0.0028011 k( 238) = ( 0.0256410 0.4743590 0.0256410), wk = 0.0028011 k( 239) = ( 0.0320513 0.4679487 0.0320513), wk = 0.0028011 k( 240) = ( 0.0384615 0.4615385 0.0384615), wk = 0.0028011 k( 241) = ( 0.0448718 0.4551282 0.0448718), wk = 0.0028011 k( 242) = ( 0.0512821 0.4487180 0.0512821), wk = 0.0028011 k( 243) = ( 0.0576923 0.4423077 0.0576923), wk = 0.0028011 k( 244) = ( 0.0641026 0.4358974 0.0641026), wk = 0.0028011 k( 245) = ( 0.0705128 0.4294872 0.0705128), wk = 0.0028011 k( 246) = ( 0.0769231 0.4230769 0.0769231), wk = 0.0028011 k( 247) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0028011 k( 248) = ( 0.0897436 0.4102564 0.0897436), wk = 0.0028011 k( 249) = ( 0.0961538 0.4038462 0.0961538), wk = 0.0028011 k( 250) = ( 0.1025641 0.3974359 0.1025641), wk = 0.0028011 k( 251) = ( 0.1089744 0.3910256 0.1089744), wk = 0.0028011 k( 252) = ( 0.1153846 0.3846154 0.1153846), wk = 0.0028011 k( 253) = ( 0.1217949 0.3782051 0.1217949), wk = 0.0028011 k( 254) = ( 0.1282051 0.3717949 0.1282051), wk = 0.0028011 k( 255) = ( 0.1346154 0.3653846 0.1346154), wk = 0.0028011 k( 256) = ( 0.1410256 0.3589744 0.1410256), wk = 0.0028011 k( 257) = ( 0.1474359 0.3525641 0.1474359), wk = 0.0028011 k( 258) = ( 0.1538461 0.3461538 0.1538462), wk = 0.0028011 k( 259) = ( 0.1602564 0.3397436 0.1602564), wk = 0.0028011 k( 260) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0028011 k( 261) = ( 0.1730769 0.3269231 0.1730769), wk = 0.0028011 k( 262) = ( 0.1794872 0.3205128 0.1794872), wk = 0.0028011 k( 263) = ( 0.1858974 0.3141026 0.1858974), wk = 0.0028011 k( 264) = ( 0.1923077 0.3076923 0.1923077), wk = 0.0028011 k( 265) = ( 0.1987180 0.3012821 0.1987180), wk = 0.0028011 k( 266) = ( 0.2051282 0.2948718 0.2051282), wk = 0.0028011 k( 267) = ( 0.2115385 0.2884615 0.2115385), wk = 0.0028011 k( 268) = ( 0.2179487 0.2820513 0.2179487), wk = 0.0028011 k( 269) = ( 0.2243590 0.2756410 0.2243590), wk = 0.0028011 k( 270) = ( 0.2307692 0.2692308 0.2307692), wk = 0.0028011 k( 271) = ( 0.2371795 0.2628205 0.2371795), wk = 0.0028011 k( 272) = ( 0.2435897 0.2564103 0.2435897), wk = 0.0028011 k( 273) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028011 k( 274) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028011 k( 275) = ( 0.2631579 0.2631579 0.2324701), wk = 0.0028011 k( 276) = ( 0.2763158 0.2763158 0.2149402), wk = 0.0028011 k( 277) = ( 0.2894737 0.2894737 0.1974103), wk = 0.0028011 k( 278) = ( 0.3026316 0.3026316 0.1798804), wk = 0.0028011 k( 279) = ( 0.3157895 0.3157895 0.1623505), wk = 0.0028011 k( 280) = ( 0.3289474 0.3289474 0.1448206), wk = 0.0028011 k( 281) = ( 0.3421053 0.3421053 0.1272907), wk = 0.0028011 k( 282) = ( 0.3552632 0.3552632 0.1097608), wk = 0.0028011 k( 283) = ( 0.3684211 0.3684211 0.0922309), wk = 0.0028011 k( 284) = ( 0.3815789 0.3815789 0.0747010), wk = 0.0028011 k( 285) = ( 0.3947368 0.3947368 0.0571711), wk = 0.0028011 k( 286) = ( 0.4078947 0.4078947 0.0396412), wk = 0.0028011 k( 287) = ( 0.4210526 0.4210526 0.0221113), wk = 0.0028011 k( 288) = ( 0.4342105 0.4342105 0.0045814), wk = 0.0028011 k( 289) = ( 0.4473684 0.4473684 -0.0129485), wk = 0.0028011 k( 290) = ( 0.4605263 0.4605263 -0.0304784), wk = 0.0028011 k( 291) = ( 0.4736842 0.4736842 -0.0480083), wk = 0.0028011 k( 292) = ( 0.4868421 0.4868421 -0.0655382), wk = 0.0028011 k( 293) = ( 0.5000000 0.5000000 -0.0830681), wk = 0.0028011 k( 294) = ( 0.5000000 0.5000000 -0.0830681), wk = 0.0028011 k( 295) = ( 0.5000000 0.5000000 -0.0921318), wk = 0.0028011 k( 296) = ( 0.5000000 0.5000000 -0.1011956), wk = 0.0028011 k( 297) = ( 0.5000000 0.5000000 -0.1102593), wk = 0.0028011 k( 298) = ( 0.5000000 0.5000000 -0.1193230), wk = 0.0028011 k( 299) = ( 0.5000000 0.5000000 -0.1283868), wk = 0.0028011 k( 300) = ( 0.5000000 0.5000000 -0.1374505), wk = 0.0028011 k( 301) = ( 0.5000000 0.5000000 -0.1465143), wk = 0.0028011 k( 302) = ( 0.5000000 0.5000000 -0.1555780), wk = 0.0028011 k( 303) = ( 0.5000000 0.5000000 -0.1646417), wk = 0.0028011 k( 304) = ( 0.5000000 0.5000000 -0.1737055), wk = 0.0028011 k( 305) = ( 0.5000000 0.5000000 -0.1827692), wk = 0.0028011 k( 306) = ( 0.5000000 0.5000000 -0.1918329), wk = 0.0028011 k( 307) = ( 0.5000000 0.5000000 -0.2008967), wk = 0.0028011 k( 308) = ( 0.5000000 0.5000000 -0.2099604), wk = 0.0028011 k( 309) = ( 0.5000000 0.5000000 -0.2190241), wk = 0.0028011 k( 310) = ( 0.5000000 0.5000000 -0.2280879), wk = 0.0028011 k( 311) = ( 0.5000000 0.5000000 -0.2371516), wk = 0.0028011 k( 312) = ( 0.5000000 0.5000000 -0.2462154), wk = 0.0028011 k( 313) = ( 0.5000000 0.5000000 -0.2552791), wk = 0.0028011 k( 314) = ( 0.5000000 0.5000000 -0.2643428), wk = 0.0028011 k( 315) = ( 0.5000000 0.5000000 -0.2734066), wk = 0.0028011 k( 316) = ( 0.5000000 0.5000000 -0.2824703), wk = 0.0028011 k( 317) = ( 0.5000000 0.5000000 -0.2915340), wk = 0.0028011 k( 318) = ( 0.5000000 0.5000000 -0.3005978), wk = 0.0028011 k( 319) = ( 0.5000000 0.5000000 -0.3096615), wk = 0.0028011 k( 320) = ( 0.5000000 0.5000000 -0.3187253), wk = 0.0028011 k( 321) = ( 0.5000000 0.5000000 -0.3277890), wk = 0.0028011 k( 322) = ( 0.5000000 0.5000000 -0.3368527), wk = 0.0028011 k( 323) = ( 0.5000000 0.5000000 -0.3459165), wk = 0.0028011 k( 324) = ( 0.5000000 0.5000000 -0.3549802), wk = 0.0028011 k( 325) = ( 0.5000000 0.5000000 -0.3640439), wk = 0.0028011 k( 326) = ( 0.5000000 0.5000000 -0.3731077), wk = 0.0028011 k( 327) = ( 0.5000000 0.5000000 -0.3821714), wk = 0.0028011 k( 328) = ( 0.5000000 0.5000000 -0.3912352), wk = 0.0028011 k( 329) = ( 0.5000000 0.5000000 -0.4002989), wk = 0.0028011 k( 330) = ( 0.5000000 0.5000000 -0.4093626), wk = 0.0028011 k( 331) = ( 0.5000000 0.5000000 -0.4184264), wk = 0.0028011 k( 332) = ( 0.5000000 0.5000000 -0.4274901), wk = 0.0028011 k( 333) = ( 0.5000000 0.5000000 -0.4365538), wk = 0.0028011 k( 334) = ( 0.5000000 0.5000000 -0.4456176), wk = 0.0028011 k( 335) = ( 0.5000000 0.5000000 -0.4546813), wk = 0.0028011 k( 336) = ( 0.5000000 0.5000000 -0.4637450), wk = 0.0028011 k( 337) = ( 0.5000000 0.5000000 -0.4728088), wk = 0.0028011 k( 338) = ( 0.5000000 0.5000000 -0.4818725), wk = 0.0028011 k( 339) = ( 0.5000000 0.5000000 -0.4909363), wk = 0.0028011 k( 340) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0028011 k( 341) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028011 k( 342) = ( 0.0156250 0.0156250 0.4843750), wk = 0.0028011 k( 343) = ( 0.0312500 0.0312500 0.4687500), wk = 0.0028011 k( 344) = ( 0.0468750 0.0468750 0.4531250), wk = 0.0028011 k( 345) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0028011 k( 346) = ( 0.0781250 0.0781250 0.4218750), wk = 0.0028011 k( 347) = ( 0.0937500 0.0937500 0.4062500), wk = 0.0028011 k( 348) = ( 0.1093750 0.1093750 0.3906250), wk = 0.0028011 k( 349) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0028011 k( 350) = ( 0.1406250 0.1406250 0.3593750), wk = 0.0028011 k( 351) = ( 0.1562500 0.1562500 0.3437500), wk = 0.0028011 k( 352) = ( 0.1718750 0.1718750 0.3281250), wk = 0.0028011 k( 353) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0028011 k( 354) = ( 0.2031250 0.2031250 0.2968750), wk = 0.0028011 k( 355) = ( 0.2187500 0.2187500 0.2812500), wk = 0.0028011 k( 356) = ( 0.2343750 0.2343750 0.2656250), wk = 0.0028011 k( 357) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028011 Dense grid: 65389 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 30769 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.21 Mb ( 224, 62) NL pseudopotentials 0.29 Mb ( 112, 170) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1817) G-vector shells 0.01 Mb ( 850) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.85 Mb ( 224, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.32 Mb ( 170, 2, 62) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./CaxSiRhx2.save/charge-density.dat Starting wfc are 72 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 7.0 secs Computing kpt #: 3 total cpu time spent up to now is 7.8 secs Computing kpt #: 4 total cpu time spent up to now is 8.6 secs Computing kpt #: 5 total cpu time spent up to now is 9.4 secs Computing kpt #: 6 total cpu time spent up to now is 10.2 secs Computing kpt #: 7 total cpu time spent up to now is 11.1 secs Computing kpt #: 8 total cpu time spent up to now is 11.9 secs Computing kpt #: 9 total cpu time spent up to now is 12.7 secs Computing kpt #: 10 total cpu time spent up to now is 13.5 secs Computing kpt #: 11 total cpu time spent up to now is 14.3 secs Computing kpt #: 12 total cpu time spent up to now is 15.1 secs Computing kpt #: 13 total cpu time spent up to now is 16.0 secs Computing kpt #: 14 total cpu time spent up to now is 16.8 secs Computing kpt #: 15 total cpu time spent up to now is 17.6 secs Computing kpt #: 16 total cpu time spent up to now is 18.4 secs 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is 197.7 secs Computing kpt #: 232 total cpu time spent up to now is 198.5 secs Computing kpt #: 233 total cpu time spent up to now is 199.3 secs Computing kpt #: 234 total cpu time spent up to now is 200.2 secs Computing kpt #: 235 total cpu time spent up to now is 200.9 secs Computing kpt #: 236 total cpu time spent up to now is 201.7 secs Computing kpt #: 237 total cpu time spent up to now is 202.5 secs Computing kpt #: 238 total cpu time spent up to now is 203.2 secs Computing kpt #: 239 total cpu time spent up to now is 204.0 secs Computing kpt #: 240 total cpu time spent up to now is 204.8 secs Computing kpt #: 241 total cpu time spent up to now is 205.6 secs Computing kpt #: 242 total cpu time spent up to now is 206.3 secs Computing kpt #: 243 total cpu time spent up to now is 207.1 secs Computing kpt #: 244 total cpu time spent up to now is 207.9 secs Computing kpt #: 245 total cpu time spent up to now is 208.7 secs Computing kpt #: 246 total cpu time spent up to now is 209.6 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total cpu time spent up to now is 246.5 secs Computing kpt #: 293 total cpu time spent up to now is 247.3 secs Computing kpt #: 294 total cpu time spent up to now is 248.1 secs Computing kpt #: 295 total cpu time spent up to now is 251.4 secs Computing kpt #: 296 total cpu time spent up to now is 252.2 secs Computing kpt #: 297 total cpu time spent up to now is 253.0 secs Computing kpt #: 298 total cpu time spent up to now is 253.8 secs Computing kpt #: 299 total cpu time spent up to now is 254.6 secs Computing kpt #: 300 total cpu time spent up to now is 255.4 secs Computing kpt #: 301 total cpu time spent up to now is 256.2 secs Computing kpt #: 302 total cpu time spent up to now is 257.1 secs Computing kpt #: 303 total cpu time spent up to now is 257.9 secs Computing kpt #: 304 total cpu time spent up to now is 258.7 secs Computing kpt #: 305 total cpu time spent up to now is 259.5 secs Computing kpt #: 306 total cpu time spent up to now is 260.3 secs Computing kpt #: 307 total cpu time spent up to now is 261.1 secs Computing kpt #: 308 total cpu time spent up to now is 261.9 secs Computing kpt #: 309 total cpu time spent up to now is 262.7 secs Computing kpt #: 310 total cpu time spent up to now is 263.5 secs Computing kpt #: 311 total cpu time spent up to now is 264.3 secs Computing kpt #: 312 total cpu time spent up to now is 265.1 secs Computing kpt #: 313 total cpu time spent up to now is 265.9 secs Computing kpt #: 314 total cpu time spent up to now is 266.6 secs Computing kpt #: 315 total cpu time spent up to now is 267.5 secs Computing kpt #: 316 total cpu time spent up to now is 268.3 secs Computing kpt #: 317 total cpu time spent up to now is 269.2 secs Computing kpt #: 318 total cpu time spent up to now is 270.0 secs Computing kpt #: 319 total cpu time spent up to now is 270.8 secs Computing kpt #: 320 total cpu time spent up to now is 271.5 secs Computing kpt #: 321 total cpu time spent up to now is 272.3 secs Computing kpt #: 322 total cpu time spent up to now is 273.1 secs Computing kpt #: 323 total cpu time spent up to now is 273.8 secs Computing kpt #: 324 total cpu time spent up to now is 274.6 secs Computing kpt #: 325 total cpu time spent up to now is 275.4 secs Computing kpt #: 326 total cpu time spent up to now is 276.2 secs Computing kpt #: 327 total cpu time spent up to now is 277.1 secs Computing kpt #: 328 total cpu time spent up to now is 278.0 secs Computing kpt #: 329 total cpu time spent up to now is 279.0 secs Computing kpt #: 330 total cpu time spent up to now is 279.9 secs Computing kpt #: 331 total cpu time spent up to now is 280.9 secs Computing kpt #: 332 total cpu time spent up to now is 281.8 secs Computing kpt #: 333 total cpu time spent up to now is 282.8 secs Computing kpt #: 334 total cpu time spent up to now is 283.7 secs Computing kpt #: 335 total cpu time spent up to now is 284.5 secs Computing kpt #: 336 total cpu time spent up to now is 285.4 secs Computing kpt #: 337 total cpu time spent up to now is 286.4 secs Computing kpt #: 338 total cpu time spent up to now is 287.2 secs Computing kpt #: 339 total cpu time spent up to now is 288.0 secs Computing kpt #: 340 total cpu time spent up to now is 288.9 secs Computing kpt #: 341 total cpu time spent up to now is 289.6 secs Computing kpt #: 342 total cpu time spent up to now is 290.4 secs Computing kpt #: 343 total cpu time spent up to now is 291.2 secs Computing kpt #: 344 total cpu time spent up to now is 292.0 secs Computing kpt #: 345 total cpu time spent up to now is 292.8 secs Computing kpt #: 346 total cpu time spent up to now is 293.6 secs Computing kpt #: 347 total cpu time spent up to now is 294.4 secs Computing kpt #: 348 total cpu time spent up to now is 295.2 secs Computing kpt #: 349 total cpu time spent up to now is 296.0 secs Computing kpt #: 350 total cpu time spent up to now is 296.8 secs Computing kpt #: 351 total cpu time spent up to now is 297.6 secs Computing kpt #: 352 total cpu time spent up to now is 298.4 secs Computing kpt #: 353 total cpu time spent up to now is 299.2 secs Computing kpt #: 354 total cpu time spent up to now is 299.9 secs Computing kpt #: 355 total cpu time spent up to now is 300.7 secs Computing kpt #: 356 total cpu time spent up to now is 301.5 secs Computing kpt #: 357 total cpu time spent up to now is 302.3 secs ethr = 1.92E-08, avg # of iterations = 18.8 total cpu time spent up to now is 302.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3799 PWs) bands (ev): -64.9552 -64.9552 -64.9228 -64.9228 -35.6012 -35.6012 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6104 -31.6104 -31.5835 -31.5835 -26.6948 -26.6948 -7.9967 -7.9967 -7.6336 -7.6336 -7.6078 -7.6078 3.1719 3.1719 5.9182 5.9182 7.7786 7.7786 9.0415 9.0415 9.0697 9.0697 9.1224 9.1224 10.6529 10.6529 11.1861 11.1861 11.2781 11.2781 11.8149 11.8149 12.3615 12.3615 12.4548 12.4548 13.4607 13.4607 13.5739 13.5739 13.7369 13.7369 14.6983 14.6983 16.3331 16.3331 16.3646 16.3646 17.7537 17.7537 k = 0.0000 0.0000 0.0182 ( 3807 PWs) bands (ev): -64.9552 -64.9552 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8123 -31.8123 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9967 -7.9967 -7.6337 -7.6337 -7.6078 -7.6078 3.1733 3.1733 5.9187 5.9187 7.7799 7.7799 9.0367 9.0367 9.0730 9.0730 9.1248 9.1248 10.6477 10.6477 11.1886 11.1886 11.2803 11.2803 11.8139 11.8139 12.3610 12.3610 12.4531 12.4531 13.4454 13.4454 13.5567 13.5567 13.7648 13.7648 14.6942 14.6942 16.3281 16.3281 16.3648 16.3648 17.7613 17.7613 k = 0.0000 0.0000 0.0364 ( 3833 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6010 -35.6010 -35.5077 -35.5077 -31.8121 -31.8121 -31.6154 -31.6154 -31.6108 -31.6108 -31.5837 -31.5837 -26.6948 -26.6948 -7.9969 -7.9969 -7.6339 -7.6339 -7.6078 -7.6078 3.1774 3.1774 5.9205 5.9205 7.7840 7.7840 9.0255 9.0255 9.0797 9.0797 9.1313 9.1313 10.6329 10.6329 11.1943 11.1943 11.2881 11.2881 11.8111 11.8111 12.3597 12.3597 12.4477 12.4477 13.3973 13.3973 13.5333 13.5333 13.8224 13.8224 14.6819 14.6819 16.3017 16.3017 16.3774 16.3774 17.7826 17.7826 k = 0.0000 0.0000 0.0546 ( 3821 PWs) bands (ev): -64.9552 -64.9552 -64.9229 -64.9229 -35.6008 -35.6008 -35.5079 -35.5079 -31.8117 -31.8117 -31.6154 -31.6154 -31.6113 -31.6113 -31.5837 -31.5837 -26.6948 -26.6948 -7.9970 -7.9970 -7.6341 -7.6341 -7.6079 -7.6079 3.1842 3.1842 5.9234 5.9234 7.7908 7.7908 9.0115 9.0115 9.0876 9.0876 9.1413 9.1413 10.6100 10.6100 11.1996 11.1996 11.3043 11.3043 11.8065 11.8065 12.3578 12.3578 12.4395 12.4395 13.3253 13.3253 13.5183 13.5183 13.8872 13.8872 14.6622 14.6622 16.2540 16.2540 16.4050 16.4050 17.8139 17.8139 k = 0.0000 0.0000 0.0728 ( 3825 PWs) bands (ev): -64.9551 -64.9551 -64.9230 -64.9230 -35.6006 -35.6006 -35.5081 -35.5081 -31.8111 -31.8111 -31.6153 -31.6153 -31.6119 -31.6119 -31.5838 -31.5838 -26.6947 -26.6947 -7.9973 -7.9973 -7.6345 -7.6345 -7.6079 -7.6079 3.1938 3.1938 5.9275 5.9275 7.8003 7.8003 8.9956 8.9956 9.0963 9.0963 9.1537 9.1537 10.5808 10.5808 11.2009 11.2009 11.3297 11.3297 11.8001 11.8001 12.3549 12.3549 12.4279 12.4279 13.2416 13.2416 13.5061 13.5061 13.9520 13.9520 14.6357 14.6357 16.1914 16.1914 16.4443 16.4443 17.8500 17.8500 k = 0.0000 0.0000 0.0910 ( 3825 PWs) bands (ev): -64.9550 -64.9550 -64.9231 -64.9231 -35.6002 -35.6002 -35.5085 -35.5085 -31.8105 -31.8105 -31.6152 -31.6152 -31.6127 -31.6127 -31.5839 -31.5839 -26.6947 -26.6947 -7.9976 -7.9976 -7.6350 -7.6350 -7.6080 -7.6080 3.2060 3.2060 5.9327 5.9327 7.8124 7.8124 8.9783 8.9783 9.1062 9.1062 9.1679 9.1679 10.5472 10.5472 11.1974 11.1974 11.3632 11.3632 11.7920 11.7920 12.3511 12.3511 12.4132 12.4132 13.1523 13.1523 13.4938 13.4938 14.0147 14.0147 14.6034 14.6034 16.1183 16.1183 16.4934 16.4934 17.8867 17.8867 k = 0.0000 0.0000 0.1092 ( 3825 PWs) bands (ev): -64.9549 -64.9549 -64.9232 -64.9232 -35.5998 -35.5998 -35.5089 -35.5089 -31.8096 -31.8096 -31.6151 -31.6151 -31.6136 -31.6136 -31.5841 -31.5841 -26.6946 -26.6946 -7.9979 -7.9979 -7.6356 -7.6356 -7.6081 -7.6081 3.2209 3.2209 5.9390 5.9390 7.8271 7.8271 8.9598 8.9598 9.1176 9.1176 9.1838 9.1838 10.5105 10.5105 11.1894 11.1894 11.4028 11.4028 11.7824 11.7824 12.3461 12.3461 12.3953 12.3953 13.0602 13.0602 13.4802 13.4802 14.0743 14.0743 14.5661 14.5661 16.0385 16.0385 16.5513 16.5513 17.9213 17.9213 k = 0.0000 0.0000 0.1274 ( 3813 PWs) bands (ev): -64.9547 -64.9547 -64.9234 -64.9234 -35.5993 -35.5993 -35.5094 -35.5094 -31.8086 -31.8086 -31.6151 -31.6151 -31.6146 -31.6146 -31.5841 -31.5841 -26.6946 -26.6946 -7.9984 -7.9984 -7.6363 -7.6363 -7.6082 -7.6082 3.2384 3.2384 5.9464 5.9464 7.8441 7.8441 8.9402 8.9402 9.1306 9.1306 9.2010 9.2010 10.4720 10.4720 11.1774 11.1774 11.4465 11.4465 11.7717 11.7717 12.3398 12.3398 12.3746 12.3746 12.9669 12.9669 13.4647 13.4647 14.1304 14.1304 14.5249 14.5249 15.9546 15.9546 16.6167 16.6167 17.9525 17.9525 k = 0.0000 0.0000 0.1456 ( 3801 PWs) bands (ev): -64.9545 -64.9545 -64.9235 -64.9235 -35.5988 -35.5988 -35.5100 -35.5100 -31.8075 -31.8075 -31.6163 -31.6163 -31.6146 -31.6146 -31.5842 -31.5842 -26.6945 -26.6945 -7.9988 -7.9988 -7.6371 -7.6371 -7.6083 -7.6083 3.2584 3.2584 5.9549 5.9549 7.8635 7.8635 8.9196 8.9196 9.1452 9.1452 9.2196 9.2196 10.4325 10.4325 11.1613 11.1613 11.4929 11.4929 11.7598 11.7598 12.3316 12.3316 12.3514 12.3514 12.8735 12.8735 13.4473 13.4473 14.1827 14.1827 14.4806 14.4806 15.8689 15.8689 16.6886 16.6886 17.9803 17.9803 k = 0.0000 0.0000 0.1638 ( 3801 PWs) bands (ev): -64.9543 -64.9543 -64.9238 -64.9238 -35.5982 -35.5982 -35.5106 -35.5106 -31.8063 -31.8063 -31.6179 -31.6179 -31.6144 -31.6144 -31.5843 -31.5843 -26.6944 -26.6944 -7.9994 -7.9994 -7.6380 -7.6380 -7.6085 -7.6085 3.2810 3.2810 5.9644 5.9644 7.8850 7.8850 8.8980 8.8980 9.1615 9.1615 9.2395 9.2395 10.3925 10.3925 11.1408 11.1408 11.5410 11.5410 11.7473 11.7473 12.3175 12.3175 12.3294 12.3294 12.7814 12.7814 13.4278 13.4278 14.2312 14.2312 14.4338 14.4338 15.7829 15.7829 16.7661 16.7661 18.0053 18.0053 k = 0.0000 0.0000 0.1820 ( 3801 PWs) bands (ev): -64.9540 -64.9540 -64.9240 -64.9240 -35.5975 -35.5975 -35.5113 -35.5113 -31.8049 -31.8049 -31.6197 -31.6197 -31.6141 -31.6141 -31.5843 -31.5843 -26.6943 -26.6943 -8.0000 -8.0000 -7.6390 -7.6390 -7.6086 -7.6086 3.3060 3.3060 5.9749 5.9749 7.9085 7.9085 8.8759 8.8759 9.1795 9.1795 9.2608 9.2608 10.3525 10.3525 11.1156 11.1156 11.5898 11.5898 11.7346 11.7346 12.2905 12.2905 12.3154 12.3154 12.6918 12.6918 13.4061 13.4061 14.2758 14.2758 14.3854 14.3854 15.6981 15.6981 16.8484 16.8484 18.0282 18.0282 k = 0.0000 0.0000 0.2002 ( 3799 PWs) bands (ev): -64.9537 -64.9537 -64.9242 -64.9242 -35.5968 -35.5968 -35.5121 -35.5121 -31.8035 -31.8035 -31.6218 -31.6218 -31.6138 -31.6138 -31.5842 -31.5842 -26.6942 -26.6942 -8.0007 -8.0007 -7.6401 -7.6401 -7.6088 -7.6088 3.3333 3.3333 5.9863 5.9863 7.9337 7.9337 8.8533 8.8533 9.1992 9.1992 9.2836 9.2836 10.3130 10.3130 11.0852 11.0852 11.6375 11.6375 11.7231 11.7231 12.2578 12.2578 12.3020 12.3020 12.6061 12.6061 13.3824 13.3824 14.3143 14.3143 14.3381 14.3381 15.6153 15.6153 16.9348 16.9348 18.0497 18.0497 k = 0.0000 0.0000 0.2184 ( 3803 PWs) bands (ev): -64.9535 -64.9535 -64.9245 -64.9245 -35.5960 -35.5960 -35.5129 -35.5129 -31.8019 -31.8019 -31.6240 -31.6240 -31.6135 -31.6135 -31.5841 -31.5841 -26.6940 -26.6940 -8.0014 -8.0014 -7.6413 -7.6413 -7.6090 -7.6090 3.3630 3.3630 5.9986 5.9986 7.9602 7.9602 8.8306 8.8306 9.2205 9.2205 9.3077 9.3077 10.2743 10.2743 11.0490 11.0490 11.6751 11.6751 11.7218 11.7218 12.2215 12.2215 12.2864 12.2864 12.5258 12.5258 13.3565 13.3565 14.2827 14.2827 14.3564 14.3564 15.5354 15.5354 17.0246 17.0246 18.0702 18.0702 k = 0.0000 0.0000 0.2366 ( 3811 PWs) bands (ev): -64.9532 -64.9532 -64.9248 -64.9248 -35.5951 -35.5951 -35.5138 -35.5138 -31.8002 -31.8002 -31.6265 -31.6265 -31.6131 -31.6131 -31.5840 -31.5840 -26.6939 -26.6939 -8.0022 -8.0022 -7.6425 -7.6425 -7.6092 -7.6092 3.3948 3.3948 6.0117 6.0117 7.9878 7.9878 8.8082 8.8082 9.2434 9.2434 9.3333 9.3333 10.2365 10.2365 11.0067 11.0067 11.6785 11.6785 11.7543 11.7543 12.1815 12.1815 12.2679 12.2679 12.4526 12.4526 13.3285 13.3285 14.2316 14.2316 14.3904 14.3904 15.4590 15.4590 17.1172 17.1172 18.0900 18.0900 k = 0.0000 0.0000 0.2549 ( 3811 PWs) bands (ev): -64.9529 -64.9529 -64.9252 -64.9252 -35.5942 -35.5942 -35.5148 -35.5148 -31.7984 -31.7984 -31.6291 -31.6291 -31.6127 -31.6127 -31.5838 -31.5838 -26.6938 -26.6938 -8.0030 -8.0030 -7.6439 -7.6439 -7.6093 -7.6093 3.4288 3.4288 6.0257 6.0257 8.0160 8.0160 8.7867 8.7867 9.2677 9.2677 9.3604 9.3604 10.1999 10.1999 10.9578 10.9578 11.6669 11.6669 11.8011 11.8011 12.1384 12.1384 12.2458 12.2458 12.3882 12.3882 13.2983 13.2983 14.1798 14.1798 14.4216 14.4216 15.3866 15.3866 17.2120 17.2120 18.1095 18.1095 k = 0.0000 0.0000 0.2731 ( 3811 PWs) bands (ev): -64.9525 -64.9525 -64.9255 -64.9255 -35.5933 -35.5933 -35.5158 -35.5158 -31.7966 -31.7966 -31.6319 -31.6319 -31.6122 -31.6122 -31.5836 -31.5836 -26.6936 -26.6936 -8.0039 -8.0039 -7.6452 -7.6452 -7.6095 -7.6095 3.4648 3.4648 6.0403 6.0403 8.0441 8.0441 8.7666 8.7666 9.2937 9.2937 9.3891 9.3891 10.1646 10.1646 10.9021 10.9021 11.6525 11.6525 11.8495 11.8495 12.0926 12.0926 12.2195 12.2195 12.3337 12.3337 13.2660 13.2660 14.1277 14.1277 14.4500 14.4500 15.3186 15.3186 17.3086 17.3086 18.1289 18.1289 k = 0.0000 0.0000 0.2913 ( 3815 PWs) bands (ev): -64.9522 -64.9522 -64.9259 -64.9259 -35.5923 -35.5923 -35.5169 -35.5169 -31.7947 -31.7947 -31.6349 -31.6349 -31.6117 -31.6117 -31.5833 -31.5833 -26.6935 -26.6935 -8.0048 -8.0048 -7.6467 -7.6467 -7.6097 -7.6097 3.5026 3.5026 6.0556 6.0556 8.0715 8.0715 8.7488 8.7488 9.3211 9.3211 9.4192 9.4192 10.1310 10.1310 10.8398 10.8398 11.6367 11.6367 11.8967 11.8967 12.0452 12.0452 12.1898 12.1898 12.2887 12.2887 13.2315 13.2315 14.0756 14.0756 14.4756 14.4756 15.2552 15.2552 17.4063 17.4063 18.1482 18.1482 k = 0.0000 0.0000 0.3095 ( 3823 PWs) bands (ev): -64.9518 -64.9518 -64.9262 -64.9262 -35.5912 -35.5912 -35.5180 -35.5180 -31.7927 -31.7927 -31.6381 -31.6381 -31.6111 -31.6111 -31.5830 -31.5830 -26.6933 -26.6933 -8.0057 -8.0057 -7.6482 -7.6482 -7.6100 -7.6100 3.5423 3.5423 6.0715 6.0715 8.0971 8.0971 8.7340 8.7340 9.3498 9.3498 9.4507 9.4507 10.0989 10.0989 10.7710 10.7710 11.6197 11.6197 11.9407 11.9407 11.9979 11.9979 12.1595 12.1595 12.2509 12.2509 13.1949 13.1949 14.0236 14.0236 14.4987 14.4987 15.1966 15.1966 17.5047 17.5047 18.1676 18.1676 k = 0.0000 0.0000 0.3277 ( 3831 PWs) bands (ev): -64.9514 -64.9514 -64.9267 -64.9267 -35.5901 -35.5901 -35.5192 -35.5192 -31.7907 -31.7907 -31.6414 -31.6414 -31.6104 -31.6104 -31.5826 -31.5826 -26.6931 -26.6931 -8.0067 -8.0067 -7.6498 -7.6498 -7.6102 -7.6102 3.5835 3.5835 6.0880 6.0880 8.1201 8.1201 8.7236 8.7236 9.3797 9.3797 9.4837 9.4837 10.0687 10.0687 10.6962 10.6962 11.6011 11.6011 11.9516 11.9516 11.9775 11.9775 12.1352 12.1352 12.2173 12.2173 13.1562 13.1562 13.9717 13.9717 14.5193 14.5193 15.1429 15.1429 17.6032 17.6032 18.1870 18.1870 k = 0.0000 0.0000 0.3459 ( 3831 PWs) bands (ev): -64.9510 -64.9510 -64.9271 -64.9271 -35.5890 -35.5890 -35.5204 -35.5204 -31.7887 -31.7887 -31.6449 -31.6449 -31.6097 -31.6097 -31.5823 -31.5823 -26.6930 -26.6930 -8.0077 -8.0077 -7.6514 -7.6514 -7.6104 -7.6104 3.6263 3.6263 6.1049 6.1049 8.1393 8.1393 8.7186 8.7186 9.4109 9.4109 9.5182 9.5182 10.0405 10.0405 10.6161 10.6161 11.5805 11.5805 11.9090 11.9090 11.9949 11.9949 12.1291 12.1291 12.1857 12.1857 13.1154 13.1154 13.9201 13.9201 14.5377 14.5377 15.0941 15.0941 17.7013 17.7013 18.2065 18.2065 k = 0.0000 0.0000 0.3641 ( 3827 PWs) bands (ev): -64.9506 -64.9506 -64.9275 -64.9275 -35.5879 -35.5879 -35.5216 -35.5216 -31.7866 -31.7866 -31.6484 -31.6484 -31.6089 -31.6089 -31.5818 -31.5818 -26.6928 -26.6928 -8.0087 -8.0087 -7.6530 -7.6530 -7.6106 -7.6106 3.6704 3.6704 6.1222 6.1222 8.1537 8.1537 8.7202 8.7202 9.4431 9.4431 9.5540 9.5540 10.0145 10.0145 10.5313 10.5313 11.5576 11.5576 11.8696 11.8696 11.9865 11.9865 12.1454 12.1454 12.1584 12.1584 13.0724 13.0724 13.8687 13.8687 14.5542 14.5542 15.0503 15.0503 17.7985 17.7985 18.2261 18.2261 k = 0.0000 0.0000 0.3823 ( 3835 PWs) bands (ev): -64.9501 -64.9501 -64.9279 -64.9279 -35.5867 -35.5867 -35.5229 -35.5229 -31.7845 -31.7845 -31.6521 -31.6521 -31.6081 -31.6081 -31.5814 -31.5814 -26.6926 -26.6926 -8.0098 -8.0098 -7.6546 -7.6546 -7.6108 -7.6108 3.7158 3.7158 6.1397 6.1397 8.1625 8.1625 8.7290 8.7290 9.4761 9.4761 9.5911 9.5911 9.9906 9.9906 10.4428 10.4428 11.5323 11.5323 11.8337 11.8337 11.9631 11.9631 12.1219 12.1219 12.1869 12.1869 13.0273 13.0273 13.8176 13.8176 14.5687 14.5687 15.0112 15.0112 17.8942 17.8942 18.2458 18.2458 k = 0.0000 0.0000 0.4005 ( 3847 PWs) bands (ev): -64.9497 -64.9497 -64.9284 -64.9284 -35.5855 -35.5855 -35.5242 -35.5242 -31.7824 -31.7824 -31.6558 -31.6558 -31.6071 -31.6071 -31.5809 -31.5809 -26.6924 -26.6924 -8.0109 -8.0109 -7.6563 -7.6563 -7.6111 -7.6111 3.7622 3.7622 6.1575 6.1575 8.1656 8.1656 8.7453 8.7453 9.5099 9.5099 9.6292 9.6292 9.9692 9.9692 10.3514 10.3514 11.5046 11.5046 11.8006 11.8006 11.9344 11.9344 12.0912 12.0912 12.2287 12.2287 12.9801 12.9801 13.7668 13.7668 14.5816 14.5816 14.9766 14.9766 17.9878 17.9878 18.2655 18.2655 k = 0.0000 0.0000 0.4187 ( 3843 PWs) bands (ev): -64.9492 -64.9492 -64.9288 -64.9288 -35.5843 -35.5843 -35.5256 -35.5256 -31.7804 -31.7804 -31.6597 -31.6597 -31.6061 -31.6061 -31.5804 -31.5804 -26.6922 -26.6922 -8.0120 -8.0120 -7.6580 -7.6580 -7.6113 -7.6113 3.8094 3.8094 6.1755 6.1755 8.1633 8.1633 8.7689 8.7689 9.5444 9.5444 9.6682 9.6682 9.9504 9.9504 10.2580 10.2580 11.4749 11.4749 11.7700 11.7700 11.9042 11.9042 12.0614 12.0614 12.2728 12.2728 12.9310 12.9310 13.7163 13.7163 14.5929 14.5929 14.9463 14.9463 18.0787 18.0787 18.2853 18.2853 k = 0.0000 0.0000 0.4369 ( 3835 PWs) bands (ev): -64.9488 -64.9488 -64.9293 -64.9293 -35.5831 -35.5831 -35.5269 -35.5269 -31.7783 -31.7783 -31.6636 -31.6636 -31.6051 -31.6051 -31.5798 -31.5798 -26.6920 -26.6920 -8.0130 -8.0130 -7.6597 -7.6597 -7.6115 -7.6115 3.8573 3.8573 6.1935 6.1935 8.1562 8.1562 8.7991 8.7991 9.5793 9.5793 9.7076 9.7076 9.9345 9.9345 10.1638 10.1638 11.4437 11.4437 11.7406 11.7406 11.8732 11.8732 12.0332 12.0332 12.3176 12.3176 12.8798 12.8798 13.6660 13.6660 14.6028 14.6028 14.9200 14.9200 18.1664 18.1664 18.3051 18.3051 k = 0.0000 0.0000 0.4551 ( 3837 PWs) bands (ev): -64.9483 -64.9483 -64.9297 -64.9297 -35.5818 -35.5818 -35.5283 -35.5283 -31.7763 -31.7763 -31.6675 -31.6675 -31.6039 -31.6039 -31.5793 -31.5793 -26.6918 -26.6918 -8.0142 -8.0142 -7.6614 -7.6614 -7.6117 -7.6117 3.9058 3.9058 6.2115 6.2115 8.1456 8.1456 8.8349 8.8349 9.6142 9.6142 9.7463 9.7463 9.9217 9.9217 10.0703 10.0703 11.4114 11.4114 11.7121 11.7121 11.8411 11.8411 12.0080 12.0080 12.3624 12.3624 12.8266 12.8266 13.6160 13.6160 14.6115 14.6115 14.8971 14.8971 18.2501 18.2501 18.3249 18.3249 k = 0.0000 0.0000 0.4733 ( 3829 PWs) bands (ev): -64.9478 -64.9478 -64.9302 -64.9302 -35.5806 -35.5806 -35.5297 -35.5297 -31.7743 -31.7743 -31.6715 -31.6715 -31.6027 -31.6027 -31.5787 -31.5787 -26.6916 -26.6916 -8.0152 -8.0152 -7.6631 -7.6631 -7.6119 -7.6119 3.9545 3.9545 6.2294 6.2294 8.1323 8.1323 8.8752 8.8752 9.6486 9.6486 9.7815 9.7815 9.9111 9.9111 9.9825 9.9825 11.3785 11.3785 11.6840 11.6840 11.8071 11.8071 11.9867 11.9867 12.4069 12.4069 12.7716 12.7716 13.5662 13.5662 14.6191 14.6191 14.8772 14.8772 18.3271 18.3271 18.3470 18.3470 k = 0.0000 0.0000 0.4915 ( 3829 PWs) bands (ev): -64.9474 -64.9474 -64.9306 -64.9306 -35.5793 -35.5793 -35.5311 -35.5311 -31.7723 -31.7723 -31.6755 -31.6755 -31.6014 -31.6014 -31.5782 -31.5782 -26.6914 -26.6914 -8.0164 -8.0164 -7.6648 -7.6648 -7.6121 -7.6121 4.0034 4.0034 6.2472 6.2472 8.1174 8.1174 8.9192 8.9192 9.6809 9.6809 9.8005 9.8005 9.8840 9.8840 9.9334 9.9334 11.3452 11.3452 11.6563 11.6563 11.7706 11.7706 11.9698 11.9698 12.4510 12.4510 12.7149 12.7149 13.5165 13.5165 14.6256 14.6256 14.8600 14.8600 18.3608 18.3608 18.4071 18.4071 k = 0.0000 0.0000 0.5097 ( 3829 PWs) bands (ev): -64.9469 -64.9469 -64.9311 -64.9311 -35.5781 -35.5781 -35.5325 -35.5325 -31.7704 -31.7704 -31.6795 -31.6795 -31.6000 -31.6000 -31.5776 -31.5776 -26.6912 -26.6912 -8.0175 -8.0175 -7.6665 -7.6665 -7.6123 -7.6123 4.0522 4.0522 6.2647 6.2647 8.1017 8.1017 8.9661 8.9661 9.7017 9.7017 9.7666 9.7666 9.8673 9.8673 9.9425 9.9425 11.3120 11.3120 11.6291 11.6291 11.7317 11.7317 11.9573 11.9573 12.4943 12.4943 12.6569 12.6569 13.4670 13.4670 14.6313 14.6313 14.8448 14.8448 18.3796 18.3796 18.4763 18.4763 k = 0.0000 0.0000 0.5279 ( 3829 PWs) bands (ev): -64.9464 -64.9464 -64.9315 -64.9315 -35.5768 -35.5768 -35.5340 -35.5340 -31.7686 -31.7686 -31.6835 -31.6835 -31.5986 -31.5986 -31.5770 -31.5770 -26.6910 -26.6910 -8.0185 -8.0185 -7.6681 -7.6681 -7.6124 -7.6124 4.1006 4.1006 6.2819 6.2819 8.0858 8.0858 9.0151 9.0151 9.6532 9.6532 9.7619 9.7619 9.8741 9.8741 9.9727 9.9727 11.2791 11.2791 11.6024 11.6024 11.6908 11.6908 11.9487 11.9487 12.5343 12.5343 12.6001 12.6001 13.4175 13.4175 14.6361 14.6361 14.8311 14.8311 18.3966 18.3966 18.5406 18.5406 k = 0.0000 0.0000 0.5461 ( 3835 PWs) bands (ev): -64.9460 -64.9460 -64.9320 -64.9320 -35.5756 -35.5756 -35.5354 -35.5354 -31.7669 -31.7669 -31.6875 -31.6875 -31.5971 -31.5971 -31.5764 -31.5764 -26.6909 -26.6909 -8.0196 -8.0196 -7.6698 -7.6698 -7.6126 -7.6126 4.1486 4.1486 6.2987 6.2987 8.0704 8.0704 9.0656 9.0656 9.5678 9.5678 9.7857 9.7857 9.8843 9.8843 10.0124 10.0124 11.2466 11.2466 11.5760 11.5760 11.6490 11.6490 11.9433 11.9433 12.5261 12.5261 12.5895 12.5895 13.3681 13.3681 14.6401 14.6401 14.8183 14.8183 18.4109 18.4109 18.5812 18.5812 k = 0.0000 0.0000 0.5643 ( 3841 PWs) bands (ev): -64.9455 -64.9455 -64.9325 -64.9325 -35.5744 -35.5744 -35.5368 -35.5368 -31.7652 -31.7652 -31.6914 -31.6914 -31.5956 -31.5956 -31.5758 -31.5758 -26.6907 -26.6907 -8.0207 -8.0207 -7.6714 -7.6714 -7.6128 -7.6128 4.1959 4.1959 6.3150 6.3150 8.0559 8.0559 9.1172 9.1172 9.4793 9.4793 9.8082 9.8082 9.8991 9.8991 10.0564 10.0564 11.2147 11.2147 11.5487 11.5487 11.6083 11.6083 11.9405 11.9405 12.4665 12.4665 12.6285 12.6285 13.3187 13.3187 14.6435 14.6435 14.8060 14.8060 18.4193 18.4193 18.5700 18.5700 k = 0.0000 0.0000 0.5825 ( 3845 PWs) bands (ev): -64.9451 -64.9451 -64.9329 -64.9329 -35.5732 -35.5732 -35.5382 -35.5382 -31.7636 -31.7636 -31.6953 -31.6953 -31.5940 -31.5940 -31.5752 -31.5752 -26.6905 -26.6905 -8.0217 -8.0217 -7.6730 -7.6730 -7.6130 -7.6130 4.2422 4.2422 6.3308 6.3308 8.0428 8.0428 9.1691 9.1691 9.3918 9.3918 9.8268 9.8268 9.9197 9.9197 10.1023 10.1023 11.1836 11.1836 11.5174 11.5174 11.5726 11.5726 11.9397 11.9397 12.4026 12.4026 12.6702 12.6702 13.2692 13.2692 14.6462 14.6462 14.7936 14.7936 18.4118 18.4118 18.5446 18.5446 k = 0.0000 0.0000 0.6007 ( 3841 PWs) bands (ev): -64.9446 -64.9446 -64.9334 -64.9334 -35.5720 -35.5720 -35.5395 -35.5395 -31.7621 -31.7621 -31.6991 -31.6991 -31.5924 -31.5924 -31.5747 -31.5747 -26.6903 -26.6903 -8.0228 -8.0228 -7.6745 -7.6745 -7.6131 -7.6131 4.2874 4.2874 6.3461 6.3461 8.0313 8.0313 9.2193 9.2193 9.3082 9.3082 9.8425 9.8425 9.9447 9.9447 10.1492 10.1492 11.1534 11.1534 11.4793 11.4793 11.5456 11.5456 11.9405 11.9405 12.3371 12.3371 12.7119 12.7119 13.2197 13.2197 14.6483 14.6483 14.7808 14.7808 18.3725 18.3725 18.5096 18.5096 k = 0.0000 0.0000 0.6189 ( 3841 PWs) bands (ev): -64.9441 -64.9441 -64.9338 -64.9338 -35.5708 -35.5708 -35.5409 -35.5409 -31.7606 -31.7606 -31.7029 -31.7029 -31.5907 -31.5907 -31.5741 -31.5741 -26.6901 -26.6901 -8.0238 -8.0238 -7.6760 -7.6760 -7.6133 -7.6133 4.3314 4.3314 6.3607 6.3607 8.0216 8.0216 9.2133 9.2133 9.2833 9.2833 9.8573 9.8573 9.9719 9.9719 10.1963 10.1963 11.1241 11.1241 11.4357 11.4357 11.5266 11.5266 11.9421 11.9421 12.2706 12.2706 12.7534 12.7534 13.1700 13.1700 14.6495 14.6495 14.7671 14.7671 18.3103 18.3103 18.4532 18.4532 k = 0.0000 0.0000 0.6371 ( 3839 PWs) bands (ev): -64.9437 -64.9437 -64.9343 -64.9343 -35.5697 -35.5697 -35.5422 -35.5422 -31.7593 -31.7593 -31.7065 -31.7065 -31.5890 -31.5890 -31.5735 -31.5735 -26.6899 -26.6899 -8.0247 -8.0247 -7.6775 -7.6775 -7.6134 -7.6134 4.3738 4.3738 6.3747 6.3747 8.0140 8.0140 9.1358 9.1358 9.3323 9.3323 9.8726 9.8726 9.9997 9.9997 10.2433 10.2433 11.0958 11.0958 11.3894 11.3894 11.5134 11.5134 11.9442 11.9442 12.2035 12.2035 12.7946 12.7946 13.1201 13.1201 14.6500 14.6500 14.7524 14.7524 18.2453 18.2453 18.3808 18.3808 k = 0.0000 0.0000 0.6553 ( 3845 PWs) bands (ev): -64.9432 -64.9432 -64.9347 -64.9347 -35.5686 -35.5686 -35.5435 -35.5435 -31.7580 -31.7580 -31.7101 -31.7101 -31.5874 -31.5874 -31.5730 -31.5730 -26.6897 -26.6897 -8.0257 -8.0257 -7.6789 -7.6789 -7.6135 -7.6135 4.4146 4.4146 6.3881 6.3881 8.0085 8.0085 9.0580 9.0580 9.3843 9.3843 9.8894 9.8894 10.0270 10.0270 10.2896 10.2896 11.0686 11.0686 11.3420 11.3420 11.5049 11.5049 11.9461 11.9461 12.1366 12.1366 12.8353 12.8353 13.0701 13.0701 14.6492 14.6492 14.7365 14.7365 18.1858 18.1858 18.2992 18.2992 k = 0.0000 0.0000 0.6735 ( 3845 PWs) bands (ev): -64.9428 -64.9428 -64.9351 -64.9351 -35.5675 -35.5675 -35.5448 -35.5448 -31.7569 -31.7569 -31.7135 -31.7135 -31.5857 -31.5857 -31.5724 -31.5724 -26.6896 -26.6896 -8.0266 -8.0266 -7.6802 -7.6802 -7.6137 -7.6137 4.4535 4.4535 6.4007 6.4007 8.0053 8.0053 8.9827 8.9827 9.4364 9.4364 9.9080 9.9080 10.0532 10.0532 10.3347 10.3347 11.0426 11.0426 11.2947 11.2947 11.5008 11.5008 11.9456 11.9456 12.0718 12.0718 12.8756 12.8756 13.0198 13.0198 14.6467 14.6467 14.7200 14.7200 18.1339 18.1339 18.2132 18.2132 k = 0.0000 0.0000 0.6917 ( 3843 PWs) bands (ev): -64.9424 -64.9424 -64.9355 -64.9355 -35.5665 -35.5665 -35.5460 -35.5460 -31.7558 -31.7558 -31.7169 -31.7169 -31.5840 -31.5840 -31.5719 -31.5719 -26.6894 -26.6894 -8.0274 -8.0274 -7.6815 -7.6815 -7.6138 -7.6138 4.4906 4.4906 6.4125 6.4125 8.0042 8.0042 8.9107 8.9107 9.4880 9.4880 9.9287 9.9287 10.0779 10.0779 10.3781 10.3781 11.0179 11.0179 11.2479 11.2479 11.5008 11.5008 11.9354 11.9354 12.0167 12.0167 12.9152 12.9152 12.9693 12.9693 14.6410 14.6410 14.7041 14.7041 18.0861 18.0861 18.1306 18.1306 k = 0.0000 0.0000 0.7099 ( 3839 PWs) bands (ev): -64.9421 -64.9421 -64.9358 -64.9358 -35.5655 -35.5655 -35.5471 -35.5471 -31.7547 -31.7547 -31.7201 -31.7201 -31.5823 -31.5823 -31.5714 -31.5714 -26.6892 -26.6892 -8.0283 -8.0283 -7.6827 -7.6827 -7.6139 -7.6139 4.5256 4.5256 6.4237 6.4237 8.0054 8.0054 8.8420 8.8420 9.5390 9.5390 9.9516 9.9516 10.1008 10.1008 10.4192 10.4192 10.9947 10.9947 11.2022 11.2022 11.5051 11.5051 11.8967 11.8967 11.9900 11.9900 12.9183 12.9183 12.9544 12.9544 14.6300 14.6300 14.6911 14.6911 18.0179 18.0179 18.0785 18.0785 k = 0.0000 0.0000 0.7281 ( 3851 PWs) bands (ev): -64.9418 -64.9418 -64.9362 -64.9362 -35.5645 -35.5645 -35.5483 -35.5483 -31.7538 -31.7538 -31.7232 -31.7232 -31.5806 -31.5806 -31.5710 -31.5710 -26.6891 -26.6891 -8.0291 -8.0291 -7.6839 -7.6839 -7.6140 -7.6140 4.5584 4.5584 6.4340 6.4340 8.0086 8.0086 8.7768 8.7768 9.5892 9.5892 9.9765 9.9765 10.1219 10.1219 10.4573 10.4573 10.9728 10.9728 11.1583 11.1583 11.5133 11.5133 11.8361 11.8361 11.9854 11.9854 12.8673 12.8673 12.9924 12.9924 14.6123 14.6123 14.6824 14.6824 17.9323 17.9323 18.0553 18.0553 k = 0.0000 0.0000 0.7463 ( 3851 PWs) bands (ev): -64.9414 -64.9414 -64.9365 -64.9365 -35.5636 -35.5636 -35.5494 -35.5494 -31.7529 -31.7529 -31.7261 -31.7261 -31.5790 -31.5790 -31.5705 -31.5705 -26.6890 -26.6890 -8.0298 -8.0298 -7.6850 -7.6850 -7.6141 -7.6141 4.5890 4.5890 6.4436 6.4436 8.0138 8.0138 8.7154 8.7154 9.6385 9.6385 10.0034 10.0034 10.1411 10.1411 10.4916 10.4916 10.9526 10.9526 11.1168 11.1168 11.5253 11.5253 11.7697 11.7697 11.9870 11.9870 12.8160 12.8160 13.0298 13.0298 14.5891 14.5891 14.6773 14.6773 17.8457 17.8457 18.0458 18.0458 k = 0.0000 0.0000 0.7646 ( 3847 PWs) bands (ev): -64.9411 -64.9411 -64.9368 -64.9368 -35.5628 -35.5628 -35.5504 -35.5504 -31.7522 -31.7522 -31.7288 -31.7288 -31.5775 -31.5775 -31.5701 -31.5701 -26.6888 -26.6888 -8.0305 -8.0305 -7.6861 -7.6861 -7.6142 -7.6142 4.6174 4.6174 6.4525 6.4525 8.0207 8.0207 8.6577 8.6577 9.6868 9.6868 10.0319 10.0319 10.1589 10.1589 10.5208 10.5208 10.9343 10.9343 11.0786 11.0786 11.5402 11.5402 11.7031 11.7031 11.9905 11.9905 12.7644 12.7644 13.0660 13.0660 14.5624 14.5624 14.6743 14.6743 17.7612 17.7612 18.0472 18.0472 k = 0.0000 0.0000 0.7828 ( 3851 PWs) bands (ev): -64.9408 -64.9408 -64.9371 -64.9371 -35.5620 -35.5620 -35.5514 -35.5514 -31.7515 -31.7515 -31.7314 -31.7314 -31.5760 -31.5760 -31.5697 -31.5697 -26.6887 -26.6887 -8.0312 -8.0312 -7.6870 -7.6870 -7.6142 -7.6142 4.6435 4.6435 6.4606 6.4606 8.0292 8.0292 8.6039 8.6039 9.7341 9.7341 10.0615 10.0615 10.1754 10.1754 10.5437 10.5437 10.9179 10.9179 11.0446 11.0446 11.5532 11.5532 11.6419 11.6419 11.9946 11.9946 12.7125 12.7125 13.1010 13.1010 14.5335 14.5335 14.6723 14.6723 17.6801 17.6801 18.0587 18.0587 k = 0.0000 0.0000 0.8010 ( 3853 PWs) bands (ev): -64.9405 -64.9405 -64.9374 -64.9374 -35.5613 -35.5613 -35.5522 -35.5522 -31.7508 -31.7508 -31.7338 -31.7338 -31.5746 -31.5746 -31.5693 -31.5693 -26.6886 -26.6886 -8.0318 -8.0318 -7.6879 -7.6879 -7.6143 -7.6143 4.6673 4.6673 6.4679 6.4679 8.0389 8.0389 8.5541 8.5541 9.7804 9.7804 10.0912 10.0912 10.1917 10.1917 10.5589 10.5589 10.9037 10.9037 11.0161 11.0161 11.5368 11.5368 11.6142 11.6142 11.9989 11.9989 12.6603 12.6603 13.1345 13.1345 14.5035 14.5035 14.6709 14.6709 17.6031 17.6031 18.0793 18.0793 k = 0.0000 0.0000 0.8192 ( 3839 PWs) bands (ev): -64.9402 -64.9402 -64.9377 -64.9377 -35.5606 -35.5606 -35.5531 -35.5531 -31.7503 -31.7503 -31.7360 -31.7360 -31.5732 -31.5732 -31.5689 -31.5689 -26.6885 -26.6885 -8.0323 -8.0323 -7.6887 -7.6887 -7.6144 -7.6144 4.6888 4.6888 6.4746 6.4746 8.0495 8.0495 8.5085 8.5085 9.8256 9.8256 10.1196 10.1196 10.2094 10.2094 10.5654 10.5654 10.8915 10.8915 10.9944 10.9944 11.4801 11.4801 11.6311 11.6311 12.0031 12.0031 12.6081 12.6081 13.1663 13.1663 14.4733 14.4733 14.6699 14.6699 17.5309 17.5309 18.1082 18.1082 k = 0.0000 0.0000 0.8374 ( 3839 PWs) bands (ev): -64.9400 -64.9400 -64.9379 -64.9379 -35.5600 -35.5600 -35.5538 -35.5538 -31.7497 -31.7497 -31.7380 -31.7380 -31.5720 -31.5720 -31.5686 -31.5686 -26.6884 -26.6884 -8.0328 -8.0328 -7.6895 -7.6895 -7.6144 -7.6144 4.7080 4.7080 6.4805 6.4805 8.0606 8.0606 8.4669 8.4669 9.8696 9.8696 10.1441 10.1441 10.2304 10.2304 10.5628 10.5628 10.8804 10.8804 10.9805 10.9805 11.4157 11.4157 11.6600 11.6600 12.0071 12.0071 12.5557 12.5557 13.1962 13.1962 14.4436 14.4436 14.6690 14.6690 17.4638 17.4638 18.1442 18.1442 k = 0.0000 0.0000 0.8556 ( 3846 PWs) bands (ev): -64.9398 -64.9398 -64.9381 -64.9381 -35.5594 -35.5594 -35.5545 -35.5545 -31.7493 -31.7493 -31.7399 -31.7399 -31.5709 -31.5709 -31.5683 -31.5683 -26.6883 -26.6883 -8.0333 -8.0333 -7.6902 -7.6902 -7.6145 -7.6145 4.7250 4.7250 6.4857 6.4857 8.0719 8.0719 8.4296 8.4296 9.9126 9.9126 10.1629 10.1629 10.2564 10.2564 10.5520 10.5520 10.8697 10.8697 10.9745 10.9745 11.3510 11.3510 11.6936 11.6936 12.0108 12.0108 12.5034 12.5034 13.2239 13.2239 14.4151 14.4151 14.6683 14.6683 17.4023 17.4023 18.1858 18.1858 k = 0.0000 0.0000 0.8738 ( 3854 PWs) bands (ev): -64.9396 -64.9396 -64.9384 -64.9384 -35.5589 -35.5589 -35.5551 -35.5551 -31.7489 -31.7489 -31.7415 -31.7415 -31.5699 -31.5699 -31.5681 -31.5681 -26.6882 -26.6882 -8.0337 -8.0337 -7.6908 -7.6908 -7.6145 -7.6145 4.7399 4.7399 6.4903 6.4903 8.0831 8.0831 8.3964 8.3964 9.9543 9.9543 10.1760 10.1760 10.2868 10.2868 10.5348 10.5348 10.8594 10.8594 10.9748 10.9748 11.2876 11.2876 11.7304 11.7304 12.0141 12.0141 12.4512 12.4512 13.2491 13.2491 14.3884 14.3884 14.6676 14.6676 17.3469 17.3469 18.2316 18.2316 k = 0.0000 0.0000 0.8920 ( 3858 PWs) bands (ev): -64.9394 -64.9394 -64.9385 -64.9385 -35.5585 -35.5585 -35.5557 -35.5557 -31.7486 -31.7486 -31.7430 -31.7430 -31.5690 -31.5690 -31.5678 -31.5678 -26.6881 -26.6881 -8.0341 -8.0341 -7.6913 -7.6913 -7.6146 -7.6146 4.7526 4.7526 6.4942 6.4942 8.0937 8.0937 8.3677 8.3677 9.9948 9.9948 10.1848 10.1848 10.3188 10.3188 10.5142 10.5142 10.8500 10.8500 10.9795 10.9795 11.2265 11.2265 11.7698 11.7698 12.0170 12.0170 12.3994 12.3994 13.2717 13.2717 14.3640 14.3640 14.6670 14.6670 17.2980 17.2980 18.2792 18.2792 k = 0.0000 0.0000 0.9102 ( 3858 PWs) bands (ev): -64.9393 -64.9393 -64.9387 -64.9387 -35.5581 -35.5581 -35.5561 -35.5561 -31.7483 -31.7483 -31.7442 -31.7442 -31.5682 -31.5682 -31.5676 -31.5676 -26.6881 -26.6881 -8.0344 -8.0344 -7.6917 -7.6917 -7.6146 -7.6146 4.7633 4.7633 6.4975 6.4975 8.1034 8.1034 8.3432 8.3432 10.0340 10.0340 10.1907 10.1907 10.3481 10.3481 10.4941 10.4941 10.8419 10.8419 10.9862 10.9862 11.1688 11.1688 11.8109 11.8109 12.0193 12.0193 12.3484 12.3484 13.2913 13.2913 14.3424 14.3424 14.6666 14.6666 17.2560 17.2560 18.3260 18.3260 k = 0.0000 0.0000 0.9284 ( 3854 PWs) bands (ev): -64.9391 -64.9391 -64.9388 -64.9388 -35.5578 -35.5578 -35.5565 -35.5565 -31.7481 -31.7481 -31.7452 -31.7452 -31.5677 -31.5677 -31.5674 -31.5674 -26.6880 -26.6880 -8.0346 -8.0346 -7.6921 -7.6921 -7.6146 -7.6146 4.7719 4.7719 6.5002 6.5002 8.1118 8.1118 8.3232 8.3232 10.0714 10.0714 10.1944 10.1944 10.3675 10.3675 10.4817 10.4817 10.8353 10.8353 10.9935 10.9935 11.1157 11.1157 11.8532 11.8532 12.0209 12.0209 12.2987 12.2987 13.3077 13.3077 14.3243 14.3243 14.6662 14.6662 17.2212 17.2212 18.3691 18.3691 k = 0.0000 0.0000 0.9466 ( 3856 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5576 -35.5576 -35.5568 -35.5568 -31.7479 -31.7479 -31.7459 -31.7459 -31.5674 -31.5674 -31.5671 -31.5671 -26.6880 -26.6880 -8.0348 -8.0348 -7.6924 -7.6924 -7.6147 -7.6147 4.7786 4.7786 6.5022 6.5022 8.1188 8.1188 8.3076 8.3076 10.1065 10.1065 10.1962 10.1962 10.3687 10.3687 10.4847 10.4847 10.8305 10.8305 11.0000 11.0000 11.0693 11.0693 11.8956 11.8956 12.0214 12.0214 12.2513 12.2513 13.3206 13.3206 14.3097 14.3097 14.6659 14.6659 17.1937 17.1937 18.4053 18.4053 k = 0.0000 0.0000 0.9648 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5574 -35.5574 -35.5570 -35.5570 -31.7478 -31.7478 -31.7465 -31.7465 -31.5673 -31.5673 -31.5667 -31.5667 -26.6879 -26.6879 -8.0350 -8.0350 -7.6926 -7.6926 -7.6147 -7.6147 4.7833 4.7833 6.5037 6.5037 8.1239 8.1239 8.2965 8.2965 10.1381 10.1381 10.1959 10.1959 10.3560 10.3560 10.4986 10.4986 10.8275 10.8275 11.0049 11.0049 11.0322 11.0322 11.9366 11.9366 12.0202 12.0202 12.2087 12.2087 13.3300 13.3300 14.2991 14.2991 14.6658 14.6658 17.1740 17.1740 18.4323 18.4323 k = 0.0000 0.0000 0.9830 ( 3836 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5571 -35.5571 -31.7477 -31.7477 -31.7468 -31.7468 -31.5672 -31.5672 -31.5665 -31.5665 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7861 4.7861 6.5046 6.5046 8.1270 8.1270 8.2898 8.2898 10.1641 10.1641 10.1924 10.1924 10.3419 10.3419 10.5118 10.5118 10.8261 10.8261 11.0042 11.0042 11.0115 11.0115 11.9729 11.9729 12.0151 12.0151 12.1759 12.1759 13.3358 13.3358 14.2927 14.2927 14.6657 14.6657 17.1621 17.1621 18.4489 18.4489 k = 0.0000 0.0000 1.0012 ( 3828 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5049 6.5049 8.1281 8.1281 8.2875 8.2875 10.1798 10.1798 10.1851 10.1851 10.3358 10.3358 10.5170 10.5170 10.8258 10.8258 10.9972 10.9972 11.0108 11.0108 11.9955 11.9955 12.0053 12.0053 12.1628 12.1628 13.3377 13.3377 14.2905 14.2905 14.6657 14.6657 17.1581 17.1581 18.4544 18.4544 k = 0.0000 0.0000 1.0012 ( 3828 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5049 6.5049 8.1281 8.1281 8.2875 8.2875 10.1798 10.1798 10.1851 10.1851 10.3358 10.3358 10.5170 10.5170 10.8258 10.8258 10.9972 10.9972 11.0108 11.0108 11.9955 11.9955 12.0053 12.0053 12.1628 12.1628 13.3377 13.3377 14.2905 14.2905 14.6657 14.6657 17.1581 17.1581 18.4544 18.4544 k =-0.0083 0.0144 1.0012 ( 3836 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7476 -31.7476 -31.7470 -31.7470 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5027 6.5027 8.1298 8.1298 8.2886 8.2886 10.1690 10.1690 10.1949 10.1949 10.3362 10.3362 10.5172 10.5172 10.8249 10.8249 10.9955 10.9955 11.0066 11.0066 11.9943 11.9943 12.0032 12.0032 12.1682 12.1682 13.3435 13.3435 14.2905 14.2905 14.6678 14.6678 17.1589 17.1589 18.4556 18.4556 k =-0.0166 0.0288 1.0012 ( 3848 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5571 -35.5571 -31.7474 -31.7474 -31.7470 -31.7470 -31.5675 -31.5675 -31.5665 -31.5665 -26.6879 -26.6879 -8.0350 -8.0350 -7.6926 -7.6926 -7.6147 -7.6147 4.7870 4.7870 6.4962 6.4962 8.1348 8.1348 8.2916 8.2916 10.1544 10.1544 10.2064 10.2064 10.3378 10.3378 10.5176 10.5176 10.8220 10.8220 10.9869 10.9869 10.9980 10.9980 11.9875 11.9875 11.9994 11.9994 12.1852 12.1852 13.3609 13.3609 14.2906 14.2906 14.6738 14.6738 17.1614 17.1614 18.4590 18.4590 k =-0.0249 0.0432 1.0012 ( 3852 PWs) bands (ev): -64.9391 -64.9391 -64.9388 -64.9388 -35.5574 -35.5574 -35.5569 -35.5569 -31.7472 -31.7472 -31.7468 -31.7468 -31.5678 -31.5678 -31.5666 -31.5666 -26.6880 -26.6880 -8.0349 -8.0349 -7.6924 -7.6924 -7.6147 -7.6147 4.7870 4.7870 6.4855 6.4855 8.1431 8.1431 8.2966 8.2966 10.1378 10.1378 10.2181 10.2181 10.3404 10.3404 10.5184 10.5184 10.8173 10.8173 10.9661 10.9661 10.9914 10.9914 11.9710 11.9710 11.9973 11.9973 12.2143 12.2143 13.3890 13.3890 14.2907 14.2907 14.6842 14.6842 17.1655 17.1655 18.4641 18.4641 k =-0.0332 0.0576 1.0012 ( 3860 PWs) bands (ev): -64.9392 -64.9392 -64.9387 -64.9387 -35.5576 -35.5576 -35.5567 -35.5567 -31.7473 -31.7473 -31.7462 -31.7462 -31.5682 -31.5682 -31.5667 -31.5667 -26.6880 -26.6880 -8.0347 -8.0347 -7.6922 -7.6922 -7.6147 -7.6147 4.7869 4.7869 6.4706 6.4706 8.1548 8.1548 8.3034 8.3034 10.1187 10.1187 10.2300 10.2300 10.3441 10.3441 10.5195 10.5195 10.8107 10.8107 10.9374 10.9374 10.9844 10.9844 11.9461 11.9461 11.9957 11.9957 12.2549 12.2549 13.4268 13.4268 14.2909 14.2909 14.6986 14.6986 17.1712 17.1712 18.4701 18.4701 k =-0.0415 0.0721 1.0012 ( 3864 PWs) bands (ev): -64.9393 -64.9393 -64.9387 -64.9387 -35.5579 -35.5579 -35.5564 -35.5564 -31.7475 -31.7475 -31.7454 -31.7454 -31.5687 -31.5687 -31.5668 -31.5668 -26.6880 -26.6880 -8.0345 -8.0345 -7.6919 -7.6919 -7.6148 -7.6148 4.7867 4.7867 6.4518 6.4518 8.1698 8.1698 8.3121 8.3121 10.0968 10.0968 10.2426 10.2426 10.3489 10.3489 10.5208 10.5208 10.8021 10.8021 10.9037 10.9037 10.9758 10.9758 11.9146 11.9146 11.9941 11.9941 12.3055 12.3055 13.4731 13.4731 14.2911 14.2911 14.7172 14.7172 17.1783 17.1783 18.4759 18.4759 k =-0.0498 0.0865 1.0012 ( 3868 PWs) bands (ev): -64.9394 -64.9394 -64.9386 -64.9386 -35.5582 -35.5582 -35.5560 -35.5560 -31.7477 -31.7477 -31.7444 -31.7444 -31.5694 -31.5694 -31.5670 -31.5670 -26.6881 -26.6881 -8.0343 -8.0343 -7.6915 -7.6915 -7.6148 -7.6148 4.7864 4.7864 6.4291 6.4291 8.1880 8.1880 8.3223 8.3223 10.0718 10.0718 10.2558 10.2558 10.3548 10.3548 10.5220 10.5220 10.7911 10.7911 10.8672 10.8672 10.9656 10.9656 11.8782 11.8782 11.9923 11.9923 12.3645 12.3645 13.5267 13.5267 14.2915 14.2915 14.7400 14.7400 17.1869 17.1869 18.4802 18.4802 k =-0.0581 0.1009 1.0012 ( 3864 PWs) bands (ev): -64.9395 -64.9395 -64.9384 -64.9384 -35.5586 -35.5586 -35.5556 -35.5556 -31.7480 -31.7480 -31.7432 -31.7432 -31.5701 -31.5701 -31.5672 -31.5672 -26.6881 -26.6881 -8.0340 -8.0340 -7.6910 -7.6910 -7.6148 -7.6148 4.7860 4.7860 6.4029 6.4029 8.2095 8.2095 8.3341 8.3341 10.0434 10.0434 10.2698 10.2698 10.3619 10.3619 10.5231 10.5231 10.7772 10.7772 10.8305 10.8305 10.9538 10.9538 11.8384 11.8384 11.9904 11.9904 12.4305 12.4305 13.5867 13.5867 14.2920 14.2920 14.7669 14.7669 17.1969 17.1969 18.4817 18.4817 k =-0.0665 0.1153 1.0012 ( 3864 PWs) bands (ev): -64.9397 -64.9397 -64.9383 -64.9383 -35.5590 -35.5590 -35.5550 -35.5550 -31.7483 -31.7483 -31.7418 -31.7418 -31.5710 -31.5710 -31.5674 -31.5674 -26.6882 -26.6882 -8.0336 -8.0336 -7.6905 -7.6905 -7.6149 -7.6149 4.7855 4.7855 6.3734 6.3734 8.2342 8.2342 8.3471 8.3471 10.0116 10.0116 10.2843 10.2843 10.3701 10.3701 10.5237 10.5237 10.7582 10.7582 10.7970 10.7970 10.9406 10.9406 11.7965 11.7965 11.9882 11.9882 12.5021 12.5021 13.6518 13.6518 14.2926 14.2926 14.7981 14.7981 17.2080 17.2080 18.4790 18.4790 k =-0.0748 0.1297 1.0012 ( 3864 PWs) bands (ev): -64.9399 -64.9399 -64.9381 -64.9381 -35.5595 -35.5595 -35.5545 -35.5545 -31.7487 -31.7487 -31.7403 -31.7403 -31.5719 -31.5719 -31.5676 -31.5676 -26.6882 -26.6882 -8.0332 -8.0332 -7.6899 -7.6899 -7.6149 -7.6149 4.7847 4.7847 6.3407 6.3407 8.2620 8.2620 8.3613 8.3613 9.9763 9.9763 10.2991 10.2991 10.3793 10.3793 10.5237 10.5237 10.7315 10.7315 10.7709 10.7709 10.9260 10.9260 11.7537 11.7537 11.9857 11.9857 12.5784 12.5784 13.7214 13.7214 14.2933 14.2933 14.8334 14.8334 17.2203 17.2203 18.4713 18.4713 k =-0.0831 0.1441 1.0012 ( 3862 PWs) bands (ev): -64.9401 -64.9401 -64.9379 -64.9379 -35.5600 -35.5600 -35.5538 -35.5538 -31.7491 -31.7491 -31.7386 -31.7386 -31.5729 -31.5729 -31.5679 -31.5679 -26.6883 -26.6883 -8.0328 -8.0328 -7.6893 -7.6893 -7.6150 -7.6150 4.7838 4.7838 6.3052 6.3052 8.2929 8.2929 8.3765 8.3765 9.9375 9.9375 10.3137 10.3137 10.3893 10.3893 10.5226 10.5226 10.7001 10.7001 10.7507 10.7507 10.9103 10.9103 11.7111 11.7111 11.9829 11.9829 12.6585 12.6585 13.7948 13.7948 14.2941 14.2941 14.8730 14.8730 17.2336 17.2336 18.4577 18.4577 k =-0.0831 0.1441 1.0012 ( 3862 PWs) bands (ev): -64.9401 -64.9401 -64.9379 -64.9379 -35.5600 -35.5600 -35.5538 -35.5538 -31.7491 -31.7491 -31.7386 -31.7386 -31.5729 -31.5729 -31.5679 -31.5679 -26.6883 -26.6883 -8.0328 -8.0328 -7.6893 -7.6893 -7.6150 -7.6150 4.7838 4.7838 6.3052 6.3052 8.2929 8.2929 8.3765 8.3765 9.9375 9.9375 10.3137 10.3137 10.3893 10.3893 10.5226 10.5226 10.7001 10.7001 10.7507 10.7507 10.9103 10.9103 11.7111 11.7111 11.9829 11.9829 12.6585 12.6585 13.7948 13.7948 14.2941 14.2941 14.8730 14.8730 17.2336 17.2336 18.4577 18.4577 k =-0.0894 0.1551 0.9885 ( 3865 PWs) bands (ev): -64.9402 -64.9402 -64.9377 -64.9377 -35.5604 -35.5604 -35.5533 -35.5533 -31.7494 -31.7494 -31.7372 -31.7372 -31.5738 -31.5738 -31.5682 -31.5682 -26.6884 -26.6884 -8.0325 -8.0325 -7.6887 -7.6887 -7.6150 -7.6150 4.7825 4.7825 6.2764 6.2764 8.3177 8.3177 8.3897 8.3897 9.9060 9.9060 10.3139 10.3139 10.4064 10.4064 10.5190 10.5190 10.6767 10.6767 10.7372 10.7372 10.9001 10.9001 11.6793 11.6793 11.9800 11.9800 12.7220 12.7220 13.8518 13.8518 14.2965 14.2965 14.9062 14.9062 17.2461 17.2461 18.4398 18.4398 k =-0.0957 0.1660 0.9759 ( 3860 PWs) bands (ev): -64.9404 -64.9404 -64.9375 -64.9375 -35.5608 -35.5608 -35.5528 -35.5528 -31.7496 -31.7496 -31.7357 -31.7357 -31.5747 -31.5747 -31.5685 -31.5685 -26.6884 -26.6884 -8.0320 -8.0320 -7.6881 -7.6881 -7.6150 -7.6150 4.7803 4.7803 6.2463 6.2463 8.3428 8.3428 8.4052 8.4052 9.8733 9.8733 10.3024 10.3024 10.4302 10.4302 10.5130 10.5130 10.6551 10.6551 10.7258 10.7258 10.8932 10.8932 11.6484 11.6484 11.9760 11.9760 12.7866 12.7866 13.9085 13.9085 14.3024 14.3024 14.9430 14.9430 17.2626 17.2626 18.4120 18.4120 k =-0.1020 0.1770 0.9632 ( 3858 PWs) bands (ev): -64.9406 -64.9406 -64.9374 -64.9374 -35.5612 -35.5612 -35.5523 -35.5523 -31.7498 -31.7498 -31.7342 -31.7342 -31.5757 -31.5757 -31.5689 -31.5689 -26.6885 -26.6885 -8.0316 -8.0316 -7.6874 -7.6874 -7.6151 -7.6151 4.7773 4.7773 6.2151 6.2151 8.3681 8.3681 8.4229 8.4229 9.8393 9.8393 10.2882 10.2882 10.4435 10.4435 10.5111 10.5111 10.6363 10.6363 10.7185 10.7185 10.8879 10.8879 11.6189 11.6189 11.9714 11.9714 12.8510 12.8510 13.9646 13.9646 14.3125 14.3125 14.9835 14.9835 17.2829 17.2829 18.3764 18.3764 k =-0.1083 0.1879 0.9506 ( 3854 PWs) bands (ev): -64.9407 -64.9407 -64.9372 -64.9372 -35.5615 -35.5615 -35.5518 -35.5518 -31.7499 -31.7499 -31.7326 -31.7326 -31.5767 -31.5767 -31.5694 -31.5694 -26.6886 -26.6886 -8.0311 -8.0311 -7.6866 -7.6866 -7.6151 -7.6151 4.7735 4.7735 6.1831 6.1831 8.3934 8.3934 8.4427 8.4427 9.8044 9.8044 10.2748 10.2748 10.4376 10.4376 10.5153 10.5153 10.6229 10.6229 10.7177 10.7177 10.8826 10.8826 11.5913 11.5913 11.9665 11.9665 12.9138 12.9138 14.0198 14.0198 14.3272 14.3272 15.0281 15.0281 17.3069 17.3069 18.3356 18.3356 k =-0.1147 0.1989 0.9379 ( 3852 PWs) bands (ev): -64.9408 -64.9408 -64.9371 -64.9371 -35.5619 -35.5619 -35.5513 -35.5513 -31.7499 -31.7499 -31.7309 -31.7309 -31.5778 -31.5778 -31.5700 -31.5700 -26.6887 -26.6887 -8.0306 -8.0306 -7.6858 -7.6858 -7.6151 -7.6151 4.7690 4.7690 6.1503 6.1503 8.4187 8.4187 8.4645 8.4645 9.7686 9.7686 10.2633 10.2633 10.4202 10.4202 10.5124 10.5124 10.6167 10.6167 10.7267 10.7267 10.8761 10.8761 11.5658 11.5658 11.9612 11.9612 12.9740 12.9740 14.0739 14.0739 14.3471 14.3471 15.0770 15.0770 17.3342 17.3342 18.2918 18.2918 k =-0.1210 0.2099 0.9253 ( 3860 PWs) bands (ev): -64.9410 -64.9410 -64.9370 -64.9370 -35.5623 -35.5623 -35.5508 -35.5508 -31.7498 -31.7498 -31.7292 -31.7292 -31.5789 -31.5789 -31.5707 -31.5707 -26.6888 -26.6888 -8.0301 -8.0301 -7.6850 -7.6850 -7.6150 -7.6150 4.7639 4.7639 6.1170 6.1170 8.4438 8.4438 8.4881 8.4881 9.7323 9.7323 10.2543 10.2543 10.3985 10.3985 10.4973 10.4973 10.6139 10.6139 10.7477 10.7477 10.8676 10.8676 11.5427 11.5427 11.9556 11.9556 13.0309 13.0309 14.1268 14.1268 14.3723 14.3723 15.1304 15.1304 17.3647 17.3647 18.2466 18.2466 k =-0.1273 0.2208 0.9127 ( 3856 PWs) bands (ev): -64.9411 -64.9411 -64.9368 -64.9368 -35.5626 -35.5626 -35.5503 -35.5503 -31.7497 -31.7497 -31.7274 -31.7274 -31.5801 -31.5801 -31.5714 -31.5714 -26.6889 -26.6889 -8.0296 -8.0296 -7.6842 -7.6842 -7.6150 -7.6150 4.7582 4.7582 6.0835 6.0835 8.4685 8.4685 8.5133 8.5133 9.6958 9.6958 10.2479 10.2479 10.3754 10.3754 10.4747 10.4747 10.6091 10.6091 10.7784 10.7784 10.8568 10.8568 11.5221 11.5221 11.9495 11.9495 13.0840 13.0840 14.1783 14.1783 14.4032 14.4032 15.1885 15.1885 17.3981 17.3981 18.2014 18.2014 k =-0.1336 0.2318 0.9000 ( 3854 PWs) bands (ev): -64.9413 -64.9413 -64.9367 -64.9367 -35.5629 -35.5629 -35.5498 -35.5498 -31.7495 -31.7495 -31.7256 -31.7256 -31.5813 -31.5813 -31.5722 -31.5722 -26.6890 -26.6890 -8.0290 -8.0290 -7.6833 -7.6833 -7.6149 -7.6149 4.7519 4.7519 6.0498 6.0498 8.4929 8.4929 8.5401 8.5401 9.6593 9.6593 10.2440 10.2440 10.3521 10.3521 10.4488 10.4488 10.6011 10.6011 10.8130 10.8130 10.8455 10.8455 11.5040 11.5040 11.9428 11.9428 13.1329 13.1329 14.2283 14.2283 14.4397 14.4397 15.2515 15.2515 17.4340 17.4340 18.1573 18.1573 k =-0.1399 0.2427 0.8874 ( 3850 PWs) bands (ev): -64.9414 -64.9414 -64.9365 -64.9365 -35.5632 -35.5632 -35.5493 -35.5493 -31.7493 -31.7493 -31.7238 -31.7238 -31.5825 -31.5825 -31.5731 -31.5731 -26.6891 -26.6891 -8.0285 -8.0285 -7.6823 -7.6823 -7.6148 -7.6148 4.7452 4.7452 6.0161 6.0161 8.5166 8.5166 8.5683 8.5683 9.6231 9.6231 10.2418 10.2418 10.3297 10.3297 10.4219 10.4219 10.5902 10.5902 10.8202 10.8202 10.8623 10.8623 11.4883 11.4883 11.9353 11.9353 13.1779 13.1779 14.2767 14.2767 14.4814 14.4814 15.3194 15.3194 17.4724 17.4724 18.1151 18.1151 k =-0.1462 0.2537 0.8747 ( 3852 PWs) bands (ev): -64.9415 -64.9415 -64.9364 -64.9364 -35.5635 -35.5635 -35.5488 -35.5488 -31.7490 -31.7490 -31.7219 -31.7219 -31.5838 -31.5838 -31.5741 -31.5741 -26.6892 -26.6892 -8.0279 -8.0279 -7.6814 -7.6814 -7.6147 -7.6147 4.7380 4.7380 5.9827 5.9827 8.5396 8.5396 8.5980 8.5980 9.5876 9.5876 10.2397 10.2397 10.3092 10.3092 10.3959 10.3959 10.5767 10.5767 10.8030 10.8030 10.9023 10.9023 11.4745 11.4745 11.9268 11.9268 13.2192 13.2192 14.3235 14.3235 14.5276 14.5276 15.3921 15.3921 17.5127 17.5127 18.0754 18.0754 k =-0.1526 0.2647 0.8621 ( 3848 PWs) bands (ev): -64.9417 -64.9417 -64.9363 -64.9363 -35.5638 -35.5638 -35.5484 -35.5484 -31.7487 -31.7487 -31.7200 -31.7200 -31.5851 -31.5851 -31.5751 -31.5751 -26.6894 -26.6894 -8.0273 -8.0273 -7.6805 -7.6805 -7.6145 -7.6145 4.7306 4.7306 5.9497 5.9497 8.5617 8.5617 8.6291 8.6291 9.5532 9.5532 10.2342 10.2342 10.2934 10.2934 10.3722 10.3722 10.5609 10.5609 10.7829 10.7829 10.9438 10.9438 11.4623 11.4623 11.9170 11.9170 13.2576 13.2576 14.3686 14.3686 14.5775 14.5775 15.4697 15.4697 17.5548 17.5548 18.0389 18.0389 k =-0.1589 0.2756 0.8494 ( 3846 PWs) bands (ev): -64.9418 -64.9418 -64.9361 -64.9361 -35.5641 -35.5641 -35.5479 -35.5479 -31.7483 -31.7483 -31.7180 -31.7180 -31.5864 -31.5864 -31.5761 -31.5761 -26.6895 -26.6895 -8.0267 -8.0267 -7.6795 -7.6795 -7.6143 -7.6143 4.7228 4.7228 5.9171 5.9171 8.5827 8.5827 8.6615 8.6615 9.5199 9.5199 10.2206 10.2206 10.2854 10.2854 10.3529 10.3529 10.5427 10.5427 10.7619 10.7619 10.9846 10.9846 11.4516 11.4516 11.9057 11.9057 13.2938 13.2938 14.4120 14.4120 14.6300 14.6300 15.5518 15.5518 17.5982 17.5982 18.0059 18.0059 k =-0.1652 0.2866 0.8368 ( 3852 PWs) bands (ev): -64.9419 -64.9419 -64.9360 -64.9360 -35.5643 -35.5643 -35.5475 -35.5475 -31.7479 -31.7479 -31.7161 -31.7161 -31.5877 -31.5877 -31.5773 -31.5773 -26.6896 -26.6896 -8.0262 -8.0262 -7.6786 -7.6786 -7.6141 -7.6141 4.7149 4.7149 5.8852 5.8852 8.6024 8.6024 8.6952 8.6952 9.4881 9.4881 10.1990 10.1990 10.2820 10.2820 10.3403 10.3403 10.5222 10.5222 10.7410 10.7410 11.0239 11.0239 11.4419 11.4419 11.8927 11.8927 13.3288 13.3288 14.4537 14.4537 14.6838 14.6838 15.6383 15.6383 17.6427 17.6427 17.9764 17.9764 k =-0.1715 0.2975 0.8241 ( 3848 PWs) bands (ev): -64.9421 -64.9421 -64.9359 -64.9359 -35.5646 -35.5646 -35.5470 -35.5470 -31.7474 -31.7474 -31.7141 -31.7141 -31.5890 -31.5890 -31.5784 -31.5784 -26.6897 -26.6897 -8.0256 -8.0256 -7.6777 -7.6777 -7.6138 -7.6138 4.7069 4.7069 5.8541 5.8541 8.6207 8.6207 8.7301 8.7301 9.4580 9.4580 10.1729 10.1729 10.2771 10.2771 10.3367 10.3367 10.5003 10.5003 10.7213 10.7213 11.0608 11.0608 11.4332 11.4332 11.8778 11.8778 13.3635 13.3635 14.4938 14.4938 14.7375 14.7375 15.7290 15.7290 17.6880 17.6880 17.9495 17.9495 k =-0.1778 0.3085 0.8115 ( 3844 PWs) bands (ev): -64.9422 -64.9422 -64.9358 -64.9358 -35.5648 -35.5648 -35.5466 -35.5466 -31.7469 -31.7469 -31.7121 -31.7121 -31.5903 -31.5903 -31.5796 -31.5796 -26.6898 -26.6898 -8.0251 -8.0251 -7.6769 -7.6769 -7.6135 -7.6135 4.6988 4.6988 5.8239 5.8239 8.6376 8.6376 8.7662 8.7662 9.4298 9.4298 10.1445 10.1445 10.2686 10.2686 10.3399 10.3399 10.4789 10.4789 10.7031 10.7031 11.0948 11.0948 11.4254 11.4254 11.8609 11.8609 13.3991 13.3991 14.5323 14.5323 14.7898 14.7898 15.8235 15.8235 17.7336 17.7336 17.9192 17.9192 k =-0.1841 0.3195 0.7988 ( 3848 PWs) bands (ev): -64.9423 -64.9423 -64.9357 -64.9357 -35.5650 -35.5650 -35.5462 -35.5462 -31.7464 -31.7464 -31.7101 -31.7101 -31.5916 -31.5916 -31.5809 -31.5809 -26.6900 -26.6900 -8.0246 -8.0246 -7.6760 -7.6760 -7.6132 -7.6132 4.6907 4.6907 5.7947 5.7947 8.6529 8.6529 8.8034 8.8034 9.4037 9.4037 10.1151 10.1151 10.2580 10.2580 10.3429 10.3429 10.4622 10.4622 10.6870 10.6870 11.1253 11.1253 11.4186 11.4186 11.8418 11.8418 13.4362 13.4362 14.5691 14.5691 14.8392 14.8392 15.9214 15.9214 17.7791 17.7791 17.8689 17.8689 k =-0.1905 0.3304 0.7862 ( 3842 PWs) bands (ev): -64.9424 -64.9424 -64.9356 -64.9356 -35.5652 -35.5652 -35.5459 -35.5459 -31.7459 -31.7459 -31.7082 -31.7082 -31.5928 -31.5928 -31.5821 -31.5821 -26.6901 -26.6901 -8.0241 -8.0241 -7.6752 -7.6752 -7.6128 -7.6128 4.6826 4.6826 5.7666 5.7666 8.6666 8.6666 8.8417 8.8417 9.3800 9.3800 10.0855 10.0855 10.2462 10.2462 10.3380 10.3380 10.4565 10.4565 10.6731 10.6731 11.1519 11.1519 11.4130 11.4130 11.8202 11.8202 13.4758 13.4758 14.6042 14.6042 14.8844 14.8844 16.0223 16.0223 17.8006 17.8006 17.8245 17.8245 k =-0.1968 0.3414 0.7735 ( 3844 PWs) bands (ev): -64.9425 -64.9425 -64.9355 -64.9355 -35.5654 -35.5654 -35.5455 -35.5455 -31.7454 -31.7454 -31.7062 -31.7062 -31.5941 -31.5941 -31.5834 -31.5834 -26.6902 -26.6902 -8.0236 -8.0236 -7.6745 -7.6745 -7.6125 -7.6125 4.6747 4.6747 5.7398 5.7398 8.6785 8.6785 8.8810 8.8810 9.3585 9.3585 10.0560 10.0560 10.2318 10.2318 10.3235 10.3235 10.4642 10.4642 10.6618 10.6618 11.1738 11.1738 11.4089 11.4089 11.7962 11.7962 13.5183 13.5183 14.6377 14.6377 14.9240 14.9240 16.1259 16.1259 17.7295 17.7295 17.8665 17.8665 k =-0.2031 0.3523 0.7609 ( 3848 PWs) bands (ev): -64.9426 -64.9426 -64.9354 -64.9354 -35.5656 -35.5656 -35.5451 -35.5451 -31.7448 -31.7448 -31.7043 -31.7043 -31.5953 -31.5953 -31.5847 -31.5847 -26.6903 -26.6903 -8.0232 -8.0232 -7.6738 -7.6738 -7.6121 -7.6121 4.6670 4.6670 5.7142 5.7142 8.6888 8.6888 8.9212 8.9212 9.3395 9.3395 10.0273 10.0273 10.2121 10.2121 10.3059 10.3059 10.4807 10.4807 10.6537 10.6537 11.1907 11.1907 11.4067 11.4067 11.7697 11.7697 13.5643 13.5643 14.6695 14.6695 14.9568 14.9568 16.2315 16.2315 17.6585 17.6585 17.9036 17.9036 k =-0.2094 0.3633 0.7482 ( 3845 PWs) bands (ev): -64.9427 -64.9427 -64.9353 -64.9353 -35.5658 -35.5658 -35.5448 -35.5448 -31.7443 -31.7443 -31.7024 -31.7024 -31.5965 -31.5965 -31.5860 -31.5860 -26.6904 -26.6904 -8.0228 -8.0228 -7.6731 -7.6731 -7.6116 -7.6116 4.6596 4.6596 5.6901 5.6901 8.6974 8.6974 8.9623 8.9623 9.3229 9.3229 9.9994 9.9994 10.1847 10.1847 10.2918 10.2918 10.5005 10.5005 10.6500 10.6500 11.2026 11.2026 11.4067 11.4067 11.7407 11.7407 13.6141 13.6141 14.6996 14.6996 14.9819 14.9819 16.3387 16.3387 17.5897 17.5897 17.9330 17.9330 k =-0.2157 0.3742 0.7356 ( 3844 PWs) bands (ev): -64.9427 -64.9427 -64.9353 -64.9353 -35.5659 -35.5659 -35.5445 -35.5445 -31.7437 -31.7437 -31.7006 -31.7006 -31.5976 -31.5976 -31.5872 -31.5872 -26.6905 -26.6905 -8.0224 -8.0224 -7.6725 -7.6725 -7.6112 -7.6112 4.6525 4.6525 5.6674 5.6674 8.7044 8.7044 9.0041 9.0041 9.3088 9.3088 9.9728 9.9728 10.1497 10.1497 10.2832 10.2832 10.5187 10.5187 10.6529 10.6529 11.2096 11.2096 11.4087 11.4087 11.7093 11.7093 13.6678 13.6678 14.7279 14.7279 14.9983 14.9983 16.4469 16.4469 17.5241 17.5241 17.9587 17.9587 k =-0.2220 0.3852 0.7229 ( 3842 PWs) bands (ev): -64.9428 -64.9428 -64.9352 -64.9352 -35.5660 -35.5660 -35.5442 -35.5442 -31.7432 -31.7432 -31.6989 -31.6989 -31.5986 -31.5986 -31.5885 -31.5885 -26.6906 -26.6906 -8.0220 -8.0220 -7.6719 -7.6719 -7.6108 -7.6108 4.6457 4.6457 5.6463 5.6463 8.7098 8.7098 9.0466 9.0466 9.2972 9.2972 9.9475 9.9475 10.1095 10.1095 10.2791 10.2791 10.5316 10.5316 10.6651 10.6651 11.2123 11.2123 11.4124 11.4124 11.6757 11.6757 13.7254 13.7254 14.7545 14.7545 15.0056 15.0056 16.5553 16.5553 17.4624 17.4624 17.9855 17.9855 k =-0.2284 0.3962 0.7103 ( 3842 PWs) bands (ev): -64.9429 -64.9429 -64.9351 -64.9351 -35.5662 -35.5662 -35.5440 -35.5440 -31.7427 -31.7427 -31.6972 -31.6972 -31.5996 -31.5996 -31.5897 -31.5897 -26.6907 -26.6907 -8.0217 -8.0217 -7.6714 -7.6714 -7.6103 -7.6103 4.6393 4.6393 5.6269 5.6269 8.7139 8.7139 9.0896 9.0896 9.2880 9.2880 9.9238 9.9238 10.0658 10.0658 10.2781 10.2781 10.5373 10.5373 10.6873 10.6873 11.2116 11.2116 11.4172 11.4172 11.6398 11.6398 13.7869 13.7869 14.7790 14.7790 15.0033 15.0033 16.6634 16.6634 17.4051 17.4051 18.0143 18.0143 k =-0.2347 0.4071 0.6976 ( 3838 PWs) bands (ev): -64.9429 -64.9429 -64.9351 -64.9351 -35.5663 -35.5663 -35.5437 -35.5437 -31.7422 -31.7422 -31.6956 -31.6956 -31.6005 -31.6005 -31.5908 -31.5908 -26.6908 -26.6908 -8.0213 -8.0213 -7.6709 -7.6709 -7.6099 -7.6099 4.6334 4.6334 5.6090 5.6090 8.7167 8.7167 9.1326 9.1326 9.2815 9.2815 9.9017 9.9017 10.0200 10.0200 10.2791 10.2791 10.5376 10.5376 10.7176 10.7176 11.2085 11.2085 11.4224 11.4224 11.6022 11.6022 13.8520 13.8520 14.8016 14.8016 14.9914 14.9914 16.7700 16.7700 17.3528 17.3528 18.0438 18.0438 k =-0.2410 0.4181 0.6850 ( 3842 PWs) bands (ev): -64.9430 -64.9430 -64.9350 -64.9350 -35.5664 -35.5664 -35.5435 -35.5435 -31.7418 -31.7418 -31.6942 -31.6942 -31.6014 -31.6014 -31.5919 -31.5919 -26.6909 -26.6909 -8.0211 -8.0211 -7.6705 -7.6705 -7.6095 -7.6095 4.6280 4.6280 5.5930 5.5930 8.7185 8.7185 9.1749 9.1749 9.2780 9.2780 9.8815 9.8815 9.9729 9.9729 10.2817 10.2817 10.5344 10.5344 10.7531 10.7531 11.2038 11.2038 11.4275 11.4275 11.5630 11.5630 13.9202 13.9202 14.8221 14.8221 14.9700 14.9700 16.8741 16.8741 17.3058 17.3058 18.0722 18.0722 k =-0.2473 0.4290 0.6723 ( 3840 PWs) bands (ev): -64.9430 -64.9430 -64.9350 -64.9350 -35.5665 -35.5665 -35.5433 -35.5433 -31.7414 -31.7414 -31.6928 -31.6928 -31.6021 -31.6021 -31.5929 -31.5929 -26.6909 -26.6909 -8.0208 -8.0208 -7.6702 -7.6702 -7.6091 -7.6091 4.6232 4.6232 5.5787 5.5787 8.7194 8.7194 9.2134 9.2134 9.2804 9.2804 9.8631 9.8631 9.9251 9.9251 10.2852 10.2852 10.5295 10.5295 10.7920 10.7920 11.1983 11.1983 11.4319 11.4319 11.5229 11.5229 13.9913 13.9913 14.8402 14.8402 14.9399 14.9399 16.9743 16.9743 17.2646 17.2646 18.0973 18.0973 k =-0.2536 0.4400 0.6597 ( 3838 PWs) bands (ev): -64.9431 -64.9431 -64.9349 -64.9349 -35.5666 -35.5666 -35.5431 -35.5431 -31.7410 -31.7410 -31.6916 -31.6916 -31.6028 -31.6028 -31.5939 -31.5939 -26.6910 -26.6910 -8.0206 -8.0206 -7.6699 -7.6699 -7.6088 -7.6088 4.6189 4.6189 5.5662 5.5662 8.7198 8.7198 9.2389 9.2389 9.2976 9.2976 9.8459 9.8459 9.8777 9.8777 10.2894 10.2894 10.5239 10.5239 10.8327 10.8327 11.1926 11.1926 11.4344 11.4344 11.4833 11.4833 14.0647 14.0647 14.8552 14.8552 14.9021 14.9021 17.0681 17.0681 17.2302 17.2302 18.1176 18.1176 k =-0.2599 0.4510 0.6470 ( 3843 PWs) bands (ev): -64.9431 -64.9431 -64.9349 -64.9349 -35.5666 -35.5666 -35.5430 -35.5430 -31.7407 -31.7407 -31.6906 -31.6906 -31.6034 -31.6034 -31.5947 -31.5947 -26.6910 -26.6910 -8.0204 -8.0204 -7.6697 -7.6697 -7.6085 -7.6085 4.6152 4.6152 5.5556 5.5556 8.7197 8.7197 9.2476 9.2476 9.3329 9.3329 9.8213 9.8213 9.8398 9.8398 10.2938 10.2938 10.5181 10.5181 10.8740 10.8740 11.1873 11.1873 11.4257 11.4257 11.4539 11.4539 14.1397 14.1397 14.8492 14.8492 14.8754 14.8754 17.1469 17.1469 17.2093 17.2093 18.1328 18.1328 k =-0.2663 0.4619 0.6344 ( 3836 PWs) bands (ev): -64.9431 -64.9431 -64.9349 -64.9349 -35.5667 -35.5667 -35.5429 -35.5429 -31.7405 -31.7405 -31.6897 -31.6897 -31.6038 -31.6038 -31.5954 -31.5954 -26.6911 -26.6911 -8.0203 -8.0203 -7.6694 -7.6694 -7.6082 -7.6082 4.6122 4.6122 5.5468 5.5468 8.7194 8.7194 9.2499 9.2499 9.3756 9.3756 9.7764 9.7764 9.8247 9.8247 10.2981 10.2981 10.5128 10.5128 10.9148 10.9148 11.1828 11.1828 11.3923 11.3923 11.4493 11.4493 14.2157 14.2157 14.7992 14.7992 14.8838 14.8838 17.1613 17.1613 17.2492 17.2492 18.1434 18.1434 k =-0.2726 0.4729 0.6217 ( 3834 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5667 -35.5667 -35.5428 -35.5428 -31.7403 -31.7403 -31.6890 -31.6890 -31.6042 -31.6042 -31.5959 -31.5959 -26.6911 -26.6911 -8.0202 -8.0202 -7.6693 -7.6693 -7.6080 -7.6080 4.6098 4.6098 5.5400 5.5400 8.7189 8.7189 9.2506 9.2506 9.4200 9.4200 9.7292 9.7292 9.8150 9.8150 10.3018 10.3018 10.5082 10.5082 10.9532 10.9532 11.1794 11.1794 11.3547 11.3547 11.4503 11.4503 14.2916 14.2916 14.7411 14.7411 14.8923 14.8923 17.1462 17.1462 17.3118 17.3118 18.1504 18.1504 k =-0.2789 0.4838 0.6091 ( 3836 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5667 -35.5667 -35.5427 -35.5427 -31.7401 -31.7401 -31.6884 -31.6884 -31.6045 -31.6045 -31.5963 -31.5963 -26.6911 -26.6911 -8.0201 -8.0201 -7.6692 -7.6692 -7.6078 -7.6078 4.6081 4.6081 5.5351 5.5351 8.7186 8.7186 9.2509 9.2509 9.4640 9.4640 9.6834 9.6834 9.8083 9.8083 10.3048 10.3048 10.5047 10.5047 10.9866 10.9866 11.1774 11.1774 11.3208 11.3208 11.4515 11.4515 14.3660 14.3660 14.6791 14.6791 14.8986 14.8986 17.1335 17.1335 17.3621 17.3621 18.1548 18.1548 k =-0.2852 0.4948 0.5964 ( 3828 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5668 -35.5668 -35.5427 -35.5427 -31.7401 -31.7401 -31.6881 -31.6881 -31.6046 -31.6046 -31.5966 -31.5966 -26.6912 -26.6912 -8.0200 -8.0200 -7.6691 -7.6691 -7.6077 -7.6077 4.6070 4.6070 5.5322 5.5322 8.7183 8.7183 9.2510 9.2510 9.5032 9.5032 9.6431 9.6431 9.8043 9.8043 10.3068 10.3068 10.5024 10.5024 11.0106 11.0106 11.1769 11.1769 11.2957 11.2957 11.4523 11.4523 14.4343 14.4343 14.6180 14.6180 14.9025 14.9025 17.1257 17.1257 17.3942 17.3942 18.1572 18.1572 k =-0.2915 0.5058 0.5838 ( 3825 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5668 -35.5668 -35.5427 -35.5427 -31.7401 -31.7401 -31.6880 -31.6880 -31.6046 -31.6046 -31.5967 -31.5967 -26.6912 -26.6912 -8.0200 -8.0200 -7.6691 -7.6691 -7.6077 -7.6077 4.6067 4.6067 5.5312 5.5312 8.7183 8.7183 9.2511 9.2511 9.5222 9.5222 9.6237 9.6237 9.8029 9.8029 10.3074 10.3074 10.5017 10.5017 11.0197 11.0197 11.1771 11.1771 11.2859 11.2859 11.4526 11.4526 14.4722 14.4722 14.5826 14.5826 14.9037 14.9037 17.1230 17.1230 17.4052 17.4052 18.1580 18.1580 k =-0.2915 0.5058 0.5838 ( 3825 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5668 -35.5668 -35.5427 -35.5427 -31.7401 -31.7401 -31.6880 -31.6880 -31.6046 -31.6046 -31.5967 -31.5967 -26.6912 -26.6912 -8.0200 -8.0200 -7.6691 -7.6691 -7.6077 -7.6077 4.6067 4.6067 5.5312 5.5312 8.7183 8.7183 9.2511 9.2511 9.5222 9.5222 9.6237 9.6237 9.8029 9.8029 10.3074 10.3074 10.5017 10.5017 11.0197 11.0197 11.1771 11.1771 11.2859 11.2859 11.4526 11.4526 14.4722 14.4722 14.5826 14.5826 14.9037 14.9037 17.1230 17.1230 17.4052 17.4052 18.1580 18.1580 k =-0.2852 0.4948 0.5711 ( 3827 PWs) bands (ev): -64.9425 -64.9425 -64.9354 -64.9354 -35.5650 -35.5650 -35.5445 -35.5445 -31.7362 -31.7362 -31.6919 -31.6919 -31.6040 -31.6040 -31.5973 -31.5973 -26.6911 -26.6911 -8.0205 -8.0205 -7.6698 -7.6698 -7.6074 -7.6074 4.5983 4.5983 5.5788 5.5788 8.7106 8.7106 9.2417 9.2417 9.5635 9.5635 9.6640 9.6640 9.7620 9.7620 10.3555 10.3555 10.5031 10.5031 10.9943 10.9943 11.1509 11.1509 11.2258 11.2258 11.4378 11.4378 14.4222 14.4222 14.5904 14.5904 14.7990 14.7990 17.1871 17.1871 17.3285 17.3285 18.2327 18.2327 k =-0.2789 0.4838 0.5584 ( 3831 PWs) bands (ev): -64.9419 -64.9419 -64.9361 -64.9361 -35.5631 -35.5631 -35.5463 -35.5463 -31.7323 -31.7323 -31.6959 -31.6959 -31.6035 -31.6035 -31.5980 -31.5980 -26.6911 -26.6911 -8.0209 -8.0209 -7.6704 -7.6704 -7.6072 -7.6072 4.5869 4.5869 5.6252 5.6252 8.6965 8.6965 9.2381 9.2381 9.6066 9.6066 9.7031 9.7031 9.7251 9.7251 10.3953 10.3953 10.5085 10.5085 10.9659 10.9659 11.1313 11.1313 11.1714 11.1714 11.4286 11.4286 14.3733 14.3733 14.6001 14.6001 14.6955 14.6955 17.2207 17.2207 17.2821 17.2821 18.2763 18.2763 k =-0.2725 0.4728 0.5457 ( 3839 PWs) bands (ev): -64.9413 -64.9413 -64.9367 -64.9367 -35.5613 -35.5613 -35.5482 -35.5482 -31.7284 -31.7284 -31.6999 -31.6999 -31.6029 -31.6029 -31.5986 -31.5986 -26.6911 -26.6911 -8.0213 -8.0213 -7.6708 -7.6708 -7.6069 -7.6069 4.5724 4.5724 5.6702 5.6702 8.6782 8.6782 9.2378 9.2378 9.6483 9.6483 9.6831 9.6831 9.7535 9.7535 10.4143 10.4143 10.5299 10.5299 10.9332 10.9332 11.1118 11.1118 11.1321 11.1321 11.4248 11.4248 14.3262 14.3262 14.5900 14.5900 14.6144 14.6144 17.1546 17.1546 17.3347 17.3347 18.2876 18.2876 k =-0.2662 0.4618 0.5330 ( 3835 PWs) bands (ev): -64.9406 -64.9406 -64.9373 -64.9373 -35.5595 -35.5595 -35.5500 -35.5500 -31.7244 -31.7244 -31.7039 -31.7039 -31.6022 -31.6022 -31.5992 -31.5992 -26.6911 -26.6911 -8.0215 -8.0215 -7.6712 -7.6712 -7.6067 -7.6067 4.5547 4.5547 5.7137 5.7137 8.6575 8.6575 9.2382 9.2382 9.6362 9.6362 9.7030 9.7030 9.8006 9.8006 10.4095 10.4095 10.5709 10.5709 10.8946 10.8946 11.0798 11.0798 11.1232 11.1232 11.4260 11.4260 14.2811 14.2811 14.4905 14.4905 14.6253 14.6253 17.0743 17.0743 17.4002 17.4002 18.2971 18.2971 k =-0.2598 0.4508 0.5203 ( 3835 PWs) bands (ev): -64.9400 -64.9400 -64.9380 -64.9380 -35.5576 -35.5576 -35.5519 -35.5519 -31.7205 -31.7205 -31.7079 -31.7079 -31.6016 -31.6016 -31.5998 -31.5998 -26.6911 -26.6911 -8.0217 -8.0217 -7.6714 -7.6714 -7.6065 -7.6065 4.5340 4.5340 5.7554 5.7554 8.6363 8.6363 9.2372 9.2372 9.5988 9.5988 9.7495 9.7495 9.8511 9.8511 10.3913 10.3913 10.6212 10.6212 10.8500 10.8500 11.0544 11.0544 11.1263 11.1263 11.4319 11.4319 14.2377 14.2377 14.3908 14.3908 14.6395 14.6395 16.9921 16.9921 17.4650 17.4650 18.3071 18.3071 k =-0.2535 0.4398 0.5076 ( 3847 PWs) bands (ev): -64.9394 -64.9394 -64.9387 -64.9387 -35.5558 -35.5558 -35.5537 -35.5537 -31.7165 -31.7165 -31.7120 -31.7120 -31.6010 -31.6010 -31.6005 -31.6005 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6064 -7.6064 4.5101 4.5101 5.7951 5.7951 8.6156 8.6156 9.2331 9.2331 9.5610 9.5610 9.7975 9.7975 9.9050 9.9050 10.3665 10.3665 10.6732 10.6732 10.8025 10.8025 11.0401 11.0401 11.1361 11.1361 11.4421 11.4421 14.1954 14.1954 14.2932 14.2932 14.6552 14.6552 16.9090 16.9090 17.5270 17.5270 18.3178 18.3178 k =-0.2472 0.4288 0.4949 ( 3843 PWs) bands (ev): -64.9393 -64.9393 -64.9387 -64.9387 -35.5556 -35.5556 -35.5539 -35.5539 -31.7160 -31.7160 -31.7125 -31.7125 -31.6011 -31.6011 -31.6004 -31.6004 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.4832 4.4832 5.8326 5.8326 8.5964 8.5964 9.2250 9.2250 9.5240 9.5240 9.8457 9.8457 9.9627 9.9627 10.3382 10.3382 10.7067 10.7067 10.7720 10.7720 11.0362 11.0362 11.1515 11.1515 11.4563 11.4563 14.1496 14.1496 14.2025 14.2025 14.6725 14.6725 16.8256 16.8256 17.5844 17.5844 18.3295 18.3295 k =-0.2408 0.4178 0.4822 ( 3843 PWs) bands (ev): -64.9400 -64.9400 -64.9380 -64.9380 -35.5575 -35.5575 -35.5521 -35.5521 -31.7200 -31.7200 -31.7084 -31.7084 -31.6017 -31.6017 -31.5997 -31.5997 -26.6911 -26.6911 -8.0217 -8.0217 -7.6715 -7.6715 -7.6062 -7.6062 4.4534 4.4534 5.8679 5.8679 8.5790 8.5790 9.2121 9.2121 9.4879 9.4879 9.8936 9.8936 10.0241 10.0241 10.3082 10.3082 10.6729 10.6729 10.8080 10.8080 11.0418 11.0418 11.1715 11.1715 11.4741 11.4741 14.0796 14.0796 14.1394 14.1394 14.6914 14.6914 16.7419 16.7419 17.6352 17.6352 18.3421 18.3421 k =-0.2345 0.4068 0.4696 ( 3845 PWs) bands (ev): -64.9406 -64.9406 -64.9374 -64.9374 -35.5593 -35.5593 -35.5502 -35.5502 -31.7240 -31.7240 -31.7044 -31.7044 -31.6023 -31.6023 -31.5991 -31.5991 -26.6911 -26.6911 -8.0215 -8.0215 -7.6713 -7.6713 -7.6061 -7.6061 4.4208 4.4208 5.9008 5.9008 8.5638 8.5638 9.1943 9.1943 9.4527 9.4527 9.9407 9.9407 10.0890 10.0890 10.2780 10.2780 10.6191 10.6191 10.8641 10.8641 11.0559 11.0559 11.1954 11.1954 11.4952 11.4952 13.9892 13.9892 14.1002 14.1002 14.7120 14.7120 16.6581 16.6581 17.6772 17.6772 18.3557 18.3557 k =-0.2282 0.3958 0.4569 ( 3845 PWs) bands (ev): -64.9413 -64.9413 -64.9368 -64.9368 -35.5612 -35.5612 -35.5483 -35.5483 -31.7279 -31.7279 -31.7004 -31.7004 -31.6030 -31.6030 -31.5985 -31.5985 -26.6912 -26.6912 -8.0212 -8.0212 -7.6709 -7.6709 -7.6060 -7.6060 4.3856 4.3856 5.9311 5.9311 8.5509 8.5509 9.1718 9.1718 9.4185 9.4185 9.9869 9.9869 10.1569 10.1569 10.2489 10.2489 10.5630 10.5630 10.9229 10.9229 11.0779 11.0779 11.2231 11.2231 11.5195 11.5195 13.8957 13.8957 14.0676 14.0676 14.7343 14.7343 16.5742 16.5742 17.7082 17.7082 18.3703 18.3703 k =-0.2218 0.3848 0.4442 ( 3841 PWs) bands (ev): -64.9419 -64.9419 -64.9361 -64.9361 -35.5630 -35.5630 -35.5465 -35.5465 -31.7319 -31.7319 -31.6964 -31.6964 -31.6036 -31.6036 -31.5978 -31.5978 -26.6913 -26.6913 -8.0208 -8.0208 -7.6705 -7.6705 -7.6060 -7.6060 4.3481 4.3481 5.9588 5.9588 8.5402 8.5402 9.1450 9.1450 9.3854 9.3854 10.0311 10.0311 10.2161 10.2161 10.2337 10.2337 10.5072 10.5072 10.9823 10.9823 11.1073 11.1073 11.2540 11.2540 11.5466 11.5466 13.8025 13.8025 14.0383 14.0383 14.7584 14.7584 16.4904 16.4904 17.7258 17.7258 18.3860 18.3860 k =-0.2155 0.3738 0.4315 ( 3835 PWs) bands (ev): -64.9425 -64.9425 -64.9355 -64.9355 -35.5648 -35.5648 -35.5446 -35.5446 -31.7358 -31.7358 -31.6924 -31.6924 -31.6041 -31.6041 -31.5972 -31.5972 -26.6913 -26.6913 -8.0204 -8.0204 -7.6699 -7.6699 -7.6060 -7.6060 4.3083 4.3083 5.9838 5.9838 8.5313 8.5313 9.1145 9.1145 9.3534 9.3534 10.0703 10.0703 10.1994 10.1994 10.3007 10.3007 10.4544 10.4544 11.0412 11.0412 11.1438 11.1438 11.2880 11.2880 11.5764 11.5764 13.7101 13.7101 14.0118 14.0118 14.7842 14.7842 16.4066 16.4066 17.7287 17.7287 18.4027 18.4027 k =-0.2091 0.3628 0.4188 ( 3835 PWs) bands (ev): -64.9431 -64.9431 -64.9349 -64.9349 -35.5666 -35.5666 -35.5428 -35.5428 -31.7396 -31.7396 -31.6884 -31.6884 -31.6047 -31.6047 -31.5966 -31.5966 -26.6914 -26.6914 -8.0198 -8.0198 -7.6693 -7.6693 -7.6060 -7.6060 4.2666 4.2666 6.0060 6.0060 8.5239 8.5239 9.0812 9.0812 9.3227 9.3227 10.0957 10.0957 10.1930 10.1930 10.3563 10.3563 10.4215 10.4215 11.0990 11.0990 11.1869 11.1869 11.3249 11.3249 11.6086 11.6086 13.6187 13.6187 13.9879 13.9879 14.8119 14.8119 16.3229 16.3229 17.7166 17.7166 18.4204 18.4204 k =-0.2028 0.3518 0.4061 ( 3835 PWs) bands (ev): -64.9438 -64.9438 -64.9343 -64.9343 -35.5684 -35.5684 -35.5410 -35.5410 -31.7434 -31.7434 -31.6845 -31.6845 -31.6053 -31.6053 -31.5959 -31.5959 -26.6915 -26.6915 -8.0192 -8.0192 -7.6685 -7.6685 -7.6060 -7.6060 4.2232 4.2232 6.0254 6.0254 8.5175 8.5175 9.0462 9.0462 9.2931 9.2931 10.0964 10.0964 10.2103 10.2103 10.3343 10.3343 10.4720 10.4720 11.1551 11.1551 11.2360 11.2360 11.3649 11.3649 11.6429 11.6429 13.5286 13.5286 13.9667 13.9667 14.8415 14.8415 16.2394 16.2394 17.6903 17.6903 18.4392 18.4392 k =-0.1965 0.3408 0.3934 ( 3839 PWs) bands (ev): -64.9444 -64.9444 -64.9336 -64.9336 -35.5702 -35.5702 -35.5393 -35.5393 -31.7472 -31.7472 -31.6806 -31.6806 -31.6059 -31.6059 -31.5953 -31.5953 -26.6916 -26.6916 -8.0186 -8.0186 -7.6677 -7.6677 -7.6061 -7.6061 4.1783 4.1783 6.0421 6.0421 8.5115 8.5115 9.0105 9.0105 9.2648 9.2648 10.0813 10.0813 10.2324 10.2324 10.3019 10.3019 10.5487 10.5487 11.2100 11.2100 11.2899 11.2899 11.4079 11.4079 11.6792 11.6792 13.4398 13.4398 13.9482 13.9482 14.8729 14.8729 16.1560 16.1560 17.6519 17.6519 18.4590 18.4590 k =-0.1901 0.3298 0.3807 ( 3837 PWs) bands (ev): -64.9450 -64.9450 -64.9330 -64.9330 -35.5719 -35.5719 -35.5375 -35.5375 -31.7509 -31.7509 -31.6768 -31.6768 -31.6064 -31.6064 -31.5947 -31.5947 -26.6917 -26.6917 -8.0178 -8.0178 -7.6667 -7.6667 -7.6062 -7.6062 4.1323 4.1323 6.0561 6.0561 8.5049 8.5049 8.9754 8.9754 9.2379 9.2379 10.0609 10.0609 10.2158 10.2158 10.3147 10.3147 10.6288 10.6288 11.2642 11.2642 11.3472 11.3472 11.4543 11.4543 11.7173 11.7173 13.3525 13.3525 13.9325 13.9325 14.9062 14.9062 16.0728 16.0728 17.6039 17.6039 18.4797 18.4797 k =-0.1838 0.3188 0.3680 ( 3839 PWs) bands (ev): -64.9456 -64.9456 -64.9324 -64.9324 -35.5736 -35.5736 -35.5358 -35.5358 -31.7545 -31.7545 -31.6730 -31.6730 -31.6070 -31.6070 -31.5941 -31.5941 -26.6918 -26.6918 -8.0171 -8.0171 -7.6657 -7.6657 -7.6063 -7.6063 4.0853 4.0853 6.0673 6.0673 8.4967 8.4967 8.9423 8.9423 9.2122 9.2122 10.0376 10.0376 10.1786 10.1786 10.3542 10.3542 10.7098 10.7098 11.3184 11.3184 11.4063 11.4063 11.5042 11.5042 11.7569 11.7569 13.2668 13.2668 13.9197 13.9197 14.9414 14.9414 15.9898 15.9898 17.5484 17.5484 18.5016 18.5016 k =-0.1775 0.3079 0.3553 ( 3839 PWs) bands (ev): -64.9462 -64.9462 -64.9318 -64.9318 -35.5753 -35.5753 -35.5341 -35.5341 -31.7581 -31.7581 -31.6693 -31.6693 -31.6075 -31.6075 -31.5934 -31.5934 -26.6919 -26.6919 -8.0162 -8.0162 -7.6645 -7.6645 -7.6064 -7.6064 4.0377 4.0377 6.0760 6.0760 8.4858 8.4858 8.9126 8.9126 9.1879 9.1879 10.0104 10.0104 10.1438 10.1438 10.3987 10.3987 10.7906 10.7906 11.3730 11.3730 11.4663 11.4663 11.5577 11.5577 11.7977 11.7977 13.1828 13.1828 13.9099 13.9099 14.9786 14.9786 15.9071 15.9071 17.4877 17.4877 18.5245 18.5245 k =-0.1711 0.2969 0.3426 ( 3833 PWs) bands (ev): -64.9468 -64.9468 -64.9313 -64.9313 -35.5769 -35.5769 -35.5324 -35.5324 -31.7615 -31.7615 -31.6656 -31.6656 -31.6080 -31.6080 -31.5928 -31.5928 -26.6920 -26.6920 -8.0153 -8.0153 -7.6633 -7.6633 -7.6065 -7.6065 3.9897 3.9897 6.0822 6.0822 8.4711 8.4711 8.8877 8.8877 9.1650 9.1650 9.9781 9.9781 10.1168 10.1168 10.4445 10.4445 10.8703 10.8703 11.4283 11.4283 11.5266 11.5266 11.6148 11.6148 11.8395 11.8395 13.1009 13.1009 13.9034 13.9034 15.0176 15.0176 15.8246 15.8246 17.4235 17.4235 18.5485 18.5485 k =-0.1648 0.2859 0.3300 ( 3829 PWs) bands (ev): -64.9473 -64.9473 -64.9307 -64.9307 -35.5785 -35.5785 -35.5308 -35.5308 -31.7649 -31.7649 -31.6620 -31.6620 -31.6085 -31.6085 -31.5923 -31.5923 -26.6922 -26.6922 -8.0144 -8.0144 -7.6620 -7.6620 -7.6066 -7.6066 3.9414 3.9414 6.0860 6.0860 8.4517 8.4517 8.8686 8.8686 9.1435 9.1435 9.9406 9.9406 10.0985 10.0985 10.4908 10.4908 10.9478 10.9478 11.4846 11.4846 11.5866 11.5866 11.6752 11.6752 11.8821 11.8821 13.0212 13.0212 13.9003 13.9003 15.0585 15.0585 15.7423 15.7423 17.3571 17.3571 18.5736 18.5736 k =-0.1584 0.2749 0.3173 ( 3833 PWs) bands (ev): -64.9479 -64.9479 -64.9302 -64.9302 -35.5801 -35.5801 -35.5292 -35.5292 -31.7683 -31.7683 -31.6585 -31.6585 -31.6090 -31.6090 -31.5917 -31.5917 -26.6923 -26.6923 -8.0134 -8.0134 -7.6607 -7.6607 -7.6068 -7.6068 3.8932 3.8932 6.0876 6.0876 8.4275 8.4275 8.8556 8.8556 9.1234 9.1234 9.8993 9.8993 10.0878 10.0878 10.5369 10.5369 11.0225 11.0225 11.5418 11.5418 11.6465 11.6465 11.7382 11.7382 11.9252 11.9252 12.9442 12.9442 13.9008 13.9008 15.1013 15.1013 15.6602 15.6602 17.2897 17.2897 18.5996 18.5996 k =-0.1521 0.2639 0.3046 ( 3835 PWs) bands (ev): -64.9484 -64.9484 -64.9296 -64.9296 -35.5816 -35.5816 -35.5276 -35.5276 -31.7715 -31.7715 -31.6551 -31.6551 -31.6095 -31.6095 -31.5911 -31.5911 -26.6924 -26.6924 -8.0125 -8.0125 -7.6593 -7.6593 -7.6069 -7.6069 3.8453 3.8453 6.0871 6.0871 8.3986 8.3986 8.8487 8.8487 9.1047 9.1047 9.8560 9.8560 10.0833 10.0833 10.5827 10.5827 11.0934 11.0934 11.6000 11.6000 11.7060 11.7060 11.8034 11.8034 11.9686 11.9686 12.8707 12.8707 13.9051 13.9051 15.1458 15.1458 15.5785 15.5785 17.2220 17.2220 18.6266 18.6266 k =-0.1458 0.2529 0.2919 ( 3831 PWs) bands (ev): -64.9489 -64.9489 -64.9291 -64.9291 -35.5831 -35.5831 -35.5261 -35.5261 -31.7746 -31.7746 -31.6518 -31.6518 -31.6100 -31.6100 -31.5906 -31.5906 -26.6926 -26.6926 -8.0115 -8.0115 -7.6578 -7.6578 -7.6071 -7.6071 3.7979 3.7979 6.0848 6.0848 8.3657 8.3657 8.8471 8.8471 9.0875 9.0875 9.8119 9.8119 10.0839 10.0839 10.6280 10.6280 11.1600 11.1600 11.6588 11.6588 11.7647 11.7647 11.8697 11.8697 12.0123 12.0123 12.8016 12.8016 13.9134 13.9134 15.1919 15.1919 15.4973 15.4973 17.1548 17.1548 18.6541 18.6541 k =-0.1394 0.2419 0.2792 ( 3827 PWs) bands (ev): -64.9494 -64.9494 -64.9286 -64.9286 -35.5845 -35.5845 -35.5246 -35.5246 -31.7776 -31.7776 -31.6485 -31.6485 -31.6104 -31.6104 -31.5900 -31.5900 -26.6927 -26.6927 -8.0105 -8.0105 -7.6563 -7.6563 -7.6072 -7.6072 3.7512 3.7512 6.0808 6.0808 8.3299 8.3299 8.8500 8.8500 9.0718 9.0718 9.7677 9.7677 10.0887 10.0887 10.6726 10.6726 11.2219 11.2219 11.7179 11.7179 11.8216 11.8216 11.9360 11.9360 12.0565 12.0565 12.7386 12.7386 13.9259 13.9259 15.2390 15.2390 15.4171 15.4171 17.0887 17.0887 18.6783 18.6783 k =-0.1331 0.2309 0.2665 ( 3831 PWs) bands (ev): -64.9499 -64.9499 -64.9281 -64.9281 -35.5859 -35.5859 -35.5232 -35.5232 -31.7806 -31.7806 -31.6454 -31.6454 -31.6109 -31.6109 -31.5895 -31.5895 -26.6929 -26.6929 -8.0095 -8.0095 -7.6548 -7.6548 -7.6074 -7.6074 3.7054 3.7054 6.0753 6.0753 8.2921 8.2921 8.8564 8.8564 9.0575 9.0575 9.7240 9.7240 10.0973 10.0973 10.7163 10.7163 11.2790 11.2790 11.7768 11.7768 11.8751 11.8751 12.0004 12.0004 12.1018 12.1018 12.6841 12.6841 13.9426 13.9426 15.2809 15.2809 15.3439 15.3439 17.0240 17.0240 18.6822 18.6822 k =-0.1268 0.2199 0.2538 ( 3825 PWs) bands (ev): -64.9504 -64.9504 -64.9276 -64.9276 -35.5873 -35.5873 -35.5218 -35.5218 -31.7834 -31.7834 -31.6423 -31.6423 -31.6113 -31.6113 -31.5890 -31.5890 -26.6930 -26.6930 -8.0085 -8.0085 -7.6532 -7.6532 -7.6075 -7.6075 3.6606 3.6606 6.0685 6.0685 8.2532 8.2532 8.8655 8.8655 9.0449 9.0449 9.6810 9.6810 10.1094 10.1094 10.7590 10.7590 11.3314 11.3314 11.8348 11.8348 11.9222 11.9222 12.0599 12.0599 12.1500 12.1500 12.6420 12.6420 13.9638 13.9638 15.2448 15.2448 15.3507 15.3507 16.9612 16.9612 18.6726 18.6726 k =-0.1204 0.2089 0.2411 ( 3833 PWs) bands (ev): -64.9509 -64.9509 -64.9272 -64.9272 -35.5886 -35.5886 -35.5205 -35.5205 -31.7861 -31.7861 -31.6394 -31.6394 -31.6117 -31.6117 -31.5885 -31.5885 -26.6932 -26.6932 -8.0075 -8.0075 -7.6517 -7.6517 -7.6077 -7.6077 3.6171 3.6171 6.0605 6.0605 8.2139 8.2139 8.8763 8.8763 9.0339 9.0339 9.6389 9.6389 10.1246 10.1246 10.8005 10.8005 11.3791 11.3791 11.8913 11.8913 11.9591 11.9591 12.1103 12.1103 12.2029 12.2029 12.6176 12.6176 13.9893 13.9893 15.1670 15.1670 15.4010 15.4010 16.9005 16.9005 18.6592 18.6592 k =-0.1141 0.1979 0.2284 ( 3829 PWs) bands (ev): -64.9513 -64.9513 -64.9267 -64.9267 -35.5898 -35.5898 -35.5192 -35.5192 -31.7887 -31.7887 -31.6366 -31.6366 -31.6120 -31.6120 -31.5880 -31.5880 -26.6933 -26.6933 -8.0065 -8.0065 -7.6501 -7.6501 -7.6078 -7.6078 3.5749 3.5749 6.0517 6.0517 8.1748 8.1748 8.8883 8.8883 9.0246 9.0246 9.5978 9.5978 10.1428 10.1428 10.8408 10.8408 11.4227 11.4227 11.9456 11.9456 11.9810 11.9810 12.1498 12.1498 12.2617 12.2617 12.6161 12.6161 14.0192 14.0192 15.0869 15.0869 15.4553 15.4553 16.8423 16.8423 18.6435 18.6435 k =-0.1077 0.1869 0.2157 ( 3821 PWs) bands (ev): -64.9517 -64.9517 -64.9263 -64.9263 -35.5910 -35.5910 -35.5180 -35.5180 -31.7912 -31.7912 -31.6339 -31.6339 -31.6124 -31.6124 -31.5876 -31.5876 -26.6934 -26.6934 -8.0055 -8.0055 -7.6485 -7.6485 -7.6079 -7.6079 3.5342 3.5342 6.0422 6.0422 8.1363 8.1363 8.9009 8.9009 9.0173 9.0173 9.5578 9.5578 10.1638 10.1638 10.8796 10.8796 11.4622 11.4622 11.9812 11.9812 12.0004 12.0004 12.1808 12.1808 12.3248 12.3248 12.6395 12.6395 14.0533 14.0533 15.0064 15.0064 15.5116 15.5116 16.7868 16.7868 18.6258 18.6258 k =-0.1014 0.1759 0.2030 ( 3825 PWs) bands (ev): -64.9521 -64.9521 -64.9259 -64.9259 -35.5921 -35.5921 -35.5169 -35.5169 -31.7935 -31.7935 -31.6313 -31.6313 -31.6127 -31.6127 -31.5871 -31.5871 -26.6936 -26.6936 -8.0046 -8.0046 -7.6470 -7.6470 -7.6080 -7.6080 3.4953 3.4953 6.0321 6.0321 8.0989 8.0989 8.9134 8.9134 9.0119 9.0119 9.5190 9.5190 10.1874 10.1874 10.9169 10.9169 11.4976 11.4976 11.9659 11.9659 12.0494 12.0494 12.2070 12.2070 12.3910 12.3910 12.6844 12.6844 14.0914 14.0914 14.9257 14.9257 15.5694 15.5694 16.7342 16.7342 18.6067 18.6067 k =-0.0951 0.1649 0.1904 ( 3821 PWs) bands (ev): -64.9525 -64.9525 -64.9255 -64.9255 -35.5932 -35.5932 -35.5158 -35.5158 -31.7957 -31.7957 -31.6289 -31.6289 -31.6130 -31.6130 -31.5867 -31.5867 -26.6937 -26.6937 -8.0037 -8.0037 -7.6455 -7.6455 -7.6081 -7.6081 3.4581 3.4581 6.0217 6.0217 8.0627 8.0627 8.9253 8.9253 9.0089 9.0089 9.4814 9.4814 10.2134 10.2134 10.9526 10.9526 11.5291 11.5291 11.9352 11.9352 12.0969 12.0969 12.2305 12.2305 12.4596 12.4596 12.7445 12.7445 14.1331 14.1331 14.8452 14.8452 15.6285 15.6285 16.6847 16.6847 18.5864 18.5864 k =-0.0887 0.1539 0.1777 ( 3819 PWs) bands (ev): -64.9529 -64.9529 -64.9252 -64.9252 -35.5942 -35.5942 -35.5147 -35.5147 -31.7978 -31.7978 -31.6266 -31.6266 -31.6133 -31.6133 -31.5863 -31.5863 -26.6938 -26.6938 -8.0029 -8.0029 -7.6441 -7.6441 -7.6082 -7.6082 3.4228 3.4228 6.0111 6.0111 8.0282 8.0282 8.9360 8.9360 9.0085 9.0085 9.4451 9.4451 10.2416 10.2416 10.9865 10.9865 11.5560 11.5560 11.8958 11.8958 12.1418 12.1418 12.2517 12.2517 12.5301 12.5301 12.8140 12.8140 14.1780 14.1780 14.7647 14.7647 15.6887 15.6887 16.6383 16.6383 18.5652 18.5652 k =-0.0824 0.1429 0.1650 ( 3819 PWs) bands (ev): -64.9532 -64.9532 -64.9248 -64.9248 -35.5951 -35.5951 -35.5138 -35.5138 -31.7998 -31.7998 -31.6245 -31.6245 -31.6136 -31.6136 -31.5860 -31.5860 -26.6940 -26.6940 -8.0021 -8.0021 -7.6427 -7.6427 -7.6082 -7.6082 3.3895 3.3895 6.0005 6.0005 7.9954 7.9954 8.9450 8.9450 9.0110 9.0110 9.4101 9.4101 10.2718 10.2718 11.0184 11.0184 11.5773 11.5773 11.8532 11.8532 12.1839 12.1839 12.2706 12.2706 12.6021 12.6021 12.8884 12.8884 14.2254 14.2254 14.6841 14.6841 15.7497 15.7497 16.5954 16.5954 18.5432 18.5432 k =-0.0761 0.1319 0.1523 ( 3809 PWs) bands (ev): -64.9535 -64.9535 -64.9245 -64.9245 -35.5960 -35.5960 -35.5129 -35.5129 -31.8016 -31.8016 -31.6224 -31.6224 -31.6139 -31.6139 -31.5856 -31.5856 -26.6941 -26.6941 -8.0013 -8.0013 -7.6414 -7.6414 -7.6082 -7.6082 3.3583 3.3583 5.9902 5.9902 7.9645 7.9645 8.9523 8.9523 9.0163 9.0163 9.3764 9.3764 10.3038 10.3038 11.0484 11.0484 11.5902 11.5902 11.8129 11.8129 12.2232 12.2232 12.2873 12.2873 12.6753 12.6753 12.9647 12.9647 14.2749 14.2749 14.6037 14.6037 15.8112 15.8112 16.5560 16.5560 18.5106 18.5106 k =-0.0697 0.1209 0.1396 ( 3803 PWs) bands (ev): -64.9538 -64.9538 -64.9242 -64.9242 -35.5968 -35.5968 -35.5120 -35.5120 -31.8033 -31.8033 -31.6206 -31.6206 -31.6141 -31.6141 -31.5853 -31.5853 -26.6942 -26.6942 -8.0006 -8.0006 -7.6402 -7.6402 -7.6082 -7.6082 3.3293 3.3293 5.9800 5.9800 7.9357 7.9357 8.9583 8.9583 9.0237 9.0237 9.3442 9.3442 10.3374 10.3374 11.0762 11.0762 11.5902 11.5902 11.7815 11.7815 12.2596 12.2596 12.3019 12.3019 12.7495 12.7495 13.0406 13.0406 14.3255 14.3255 14.5234 14.5234 15.8729 15.8729 16.5200 16.5200 18.4161 18.4161 k =-0.0634 0.1099 0.1269 ( 3803 PWs) bands (ev): -64.9540 -64.9540 -64.9240 -64.9240 -35.5975 -35.5975 -35.5112 -35.5112 -31.8049 -31.8049 -31.6188 -31.6188 -31.6143 -31.6143 -31.5850 -31.5850 -26.6943 -26.6943 -7.9999 -7.9999 -7.6391 -7.6391 -7.6082 -7.6082 3.3025 3.3025 5.9703 5.9703 7.9091 7.9091 8.9636 8.9636 9.0322 9.0322 9.3133 9.3133 10.3723 10.3723 11.1018 11.1018 11.5730 11.5730 11.7646 11.7646 12.2929 12.2929 12.3146 12.3146 12.8243 12.8243 13.1145 13.1145 14.3764 14.3764 14.4433 14.4433 15.9345 15.9345 16.4878 16.4878 18.3226 18.3226 k =-0.0570 0.0990 0.1142 ( 3803 PWs) bands (ev): -64.9543 -64.9543 -64.9237 -64.9237 -35.5982 -35.5982 -35.5105 -35.5105 -31.8063 -31.8063 -31.6173 -31.6173 -31.6145 -31.6145 -31.5847 -31.5847 -26.6944 -26.6944 -7.9993 -7.9993 -7.6380 -7.6380 -7.6082 -7.6082 3.2781 3.2781 5.9612 5.9612 7.8848 7.8848 8.9690 8.9690 9.0413 9.0413 9.2839 9.2839 10.4081 10.4081 11.1249 11.1249 11.5402 11.5402 11.7616 11.7616 12.3210 12.3210 12.3275 12.3275 12.8998 12.8998 13.1851 13.1851 14.3629 14.3629 14.4271 14.4271 15.9952 15.9952 16.4591 16.4591 18.2327 18.2327 k =-0.0507 0.0880 0.1015 ( 3813 PWs) bands (ev): -64.9545 -64.9545 -64.9235 -64.9235 -35.5988 -35.5988 -35.5099 -35.5099 -31.8075 -31.8075 -31.6159 -31.6159 -31.6147 -31.6147 -31.5845 -31.5845 -26.6945 -26.6945 -7.9988 -7.9988 -7.6371 -7.6371 -7.6082 -7.6082 3.2561 3.2561 5.9527 5.9527 7.8628 7.8628 8.9748 8.9748 9.0501 9.0501 9.2560 9.2560 10.4445 10.4445 11.1455 11.1455 11.4986 11.4986 11.7666 11.7666 12.3329 12.3329 12.3515 12.3515 12.9756 12.9756 13.2513 13.2513 14.2832 14.2832 14.4759 14.4759 16.0546 16.0546 16.4342 16.4342 18.1470 18.1470 k =-0.0444 0.0770 0.0888 ( 3813 PWs) bands (ev): -64.9547 -64.9547 -64.9234 -64.9234 -35.5994 -35.5994 -35.5094 -35.5094 -31.8087 -31.8087 -31.6151 -31.6151 -31.6145 -31.6145 -31.5843 -31.5843 -26.6946 -26.6946 -7.9983 -7.9983 -7.6363 -7.6363 -7.6081 -7.6081 3.2366 3.2366 5.9449 5.9449 7.8433 7.8433 8.9814 8.9814 9.0584 9.0584 9.2297 9.2297 10.4810 10.4810 11.1634 11.1634 11.4538 11.4538 11.7750 11.7750 12.3405 12.3405 12.3755 12.3755 13.0515 13.0515 13.3122 13.3122 14.2037 14.2037 14.5222 14.5222 16.1118 16.1118 16.4128 16.4128 18.0664 18.0664 k =-0.0380 0.0660 0.0761 ( 3821 PWs) bands (ev): -64.9549 -64.9549 -64.9232 -64.9232 -35.5998 -35.5998 -35.5089 -35.5089 -31.8097 -31.8097 -31.6151 -31.6151 -31.6135 -31.6135 -31.5841 -31.5841 -26.6946 -26.6946 -7.9979 -7.9979 -7.6356 -7.6356 -7.6081 -7.6081 3.2196 3.2196 5.9381 5.9381 7.8262 7.8262 8.9889 8.9889 9.0656 9.0656 9.2051 9.2051 10.5169 10.5169 11.1781 11.1781 11.4095 11.4095 11.7842 11.7842 12.3465 12.3465 12.3963 12.3963 13.1271 13.1271 13.3672 13.3672 14.1247 14.1247 14.5651 14.5651 16.1658 16.1658 16.3951 16.3951 17.9920 17.9920 k =-0.0317 0.0550 0.0635 ( 3823 PWs) bands (ev): -64.9550 -64.9550 -64.9231 -64.9231 -35.6002 -35.6002 -35.5085 -35.5085 -31.8105 -31.8105 -31.6152 -31.6152 -31.6126 -31.6126 -31.5839 -31.5839 -26.6947 -26.6947 -7.9975 -7.9975 -7.6350 -7.6350 -7.6080 -7.6080 3.2051 3.2051 5.9321 5.9321 7.8117 7.8117 8.9975 8.9975 9.0716 9.0716 9.1826 9.1826 10.5514 10.5514 11.1892 11.1892 11.3681 11.3681 11.7929 11.7929 12.3513 12.3513 12.4141 12.4141 13.2020 13.2020 13.4157 13.4157 14.0464 14.0464 14.6034 14.6034 16.2153 16.2153 16.3808 16.3808 17.9250 17.9250 k =-0.0254 0.0440 0.0508 ( 3823 PWs) bands (ev): -64.9551 -64.9551 -64.9230 -64.9230 -35.6006 -35.6006 -35.5081 -35.5081 -31.8112 -31.8112 -31.6153 -31.6153 -31.6118 -31.6118 -31.5838 -31.5838 -26.6948 -26.6948 -7.9973 -7.9973 -7.6345 -7.6345 -7.6079 -7.6079 3.1932 3.1932 5.9272 5.9272 7.7998 7.7998 9.0069 9.0069 9.0758 9.0758 9.1623 9.1623 10.5834 10.5834 11.1960 11.1960 11.3325 11.3325 11.8005 11.8005 12.3551 12.3551 12.4286 12.4286 13.2751 13.2751 13.4575 13.4575 13.9693 13.9693 14.6363 14.6363 16.2588 16.2588 16.3700 16.3700 17.8667 17.8667 k =-0.0190 0.0330 0.0381 ( 3823 PWs) bands (ev): -64.9552 -64.9552 -64.9229 -64.9229 -35.6008 -35.6008 -35.5079 -35.5079 -31.8117 -31.8117 -31.6154 -31.6154 -31.6112 -31.6112 -31.5837 -31.5837 -26.6948 -26.6948 -7.9970 -7.9970 -7.6341 -7.6341 -7.6079 -7.6079 3.1839 3.1839 5.9233 5.9233 7.7905 7.7905 9.0171 9.0171 9.0776 9.0776 9.1452 9.1452 10.6114 10.6114 11.1974 11.1974 11.3053 11.3053 11.8067 11.8067 12.3578 12.3578 12.4400 12.4400 13.3442 13.3442 13.4933 13.4933 13.8943 13.8943 14.6628 14.6628 16.2941 16.2941 16.3629 16.3629 17.8189 17.8189 k =-0.0127 0.0220 0.0254 ( 3819 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6010 -35.6010 -35.5077 -35.5077 -31.8121 -31.8121 -31.6154 -31.6154 -31.6108 -31.6108 -31.5836 -31.5836 -26.6948 -26.6948 -7.9968 -7.9968 -7.6338 -7.6338 -7.6078 -7.6078 3.1772 3.1772 5.9204 5.9204 7.7839 7.7839 9.0276 9.0276 9.0764 9.0764 9.1324 9.1324 10.6335 10.6335 11.1938 11.1938 11.2883 11.2883 11.8112 11.8112 12.3598 12.3598 12.4481 12.4481 13.4045 13.4045 13.5254 13.5254 13.8238 13.8238 14.6823 14.6823 16.3186 16.3186 16.3604 16.3604 17.7832 17.7832 k =-0.0063 0.0110 0.0127 ( 3807 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8123 -31.8123 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9967 -7.9967 -7.6337 -7.6337 -7.6078 -7.6078 3.1733 3.1733 5.9187 5.9187 7.7799 7.7799 9.0371 9.0371 9.0725 9.0725 9.1249 9.1249 10.6478 10.6478 11.1885 11.1885 11.2802 11.2802 11.8139 11.8139 12.3610 12.3610 12.4531 12.4531 13.4462 13.4462 13.5564 13.5564 13.7644 13.7644 14.6943 14.6943 16.3304 16.3304 16.3625 16.3625 17.7612 17.7612 k = 0.0000 0.0000 0.0000 ( 3799 PWs) bands (ev): -64.9552 -64.9552 -64.9228 -64.9228 -35.6012 -35.6012 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6104 -31.6104 -31.5835 -31.5835 -26.6948 -26.6948 -7.9967 -7.9967 -7.6336 -7.6336 -7.6078 -7.6078 3.1719 3.1719 5.9182 5.9182 7.7786 7.7786 9.0415 9.0415 9.0697 9.0697 9.1224 9.1224 10.6529 10.6529 11.1861 11.1861 11.2781 11.2781 11.8149 11.8149 12.3615 12.3615 12.4548 12.4548 13.4607 13.4607 13.5739 13.5739 13.7369 13.7369 14.6983 14.6983 16.3331 16.3331 16.3646 16.3646 17.7537 17.7537 k = 0.0000 0.0000 0.0000 ( 3799 PWs) bands (ev): -64.9552 -64.9552 -64.9228 -64.9228 -35.6012 -35.6012 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6104 -31.6104 -31.5835 -31.5835 -26.6948 -26.6948 -7.9967 -7.9967 -7.6336 -7.6336 -7.6078 -7.6078 3.1719 3.1719 5.9182 5.9182 7.7786 7.7786 9.0415 9.0415 9.0697 9.0697 9.1224 9.1224 10.6529 10.6529 11.1861 11.1861 11.2781 11.2781 11.8149 11.8149 12.3615 12.3615 12.4548 12.4548 13.4607 13.4607 13.5739 13.5739 13.7369 13.7369 14.6983 14.6983 16.3331 16.3331 16.3646 16.3646 17.7537 17.7537 k = 0.0156 0.0090-0.0000 ( 3803 PWs) bands (ev): -64.9553 -64.9553 -64.9227 -64.9227 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9967 -7.9967 -7.6336 -7.6336 -7.6078 -7.6078 3.1733 3.1733 5.9156 5.9156 7.7794 7.7794 9.0418 9.0418 9.0697 9.0697 9.1227 9.1227 10.6493 10.6493 11.1857 11.1857 11.2772 11.2772 11.8129 11.8129 12.3667 12.3667 12.4548 12.4548 13.4601 13.4601 13.5730 13.5730 13.7370 13.7370 14.7019 14.7019 16.3369 16.3369 16.3685 16.3685 17.7529 17.7529 k = 0.0312 0.0180-0.0000 ( 3815 PWs) bands (ev): -64.9553 -64.9553 -64.9227 -64.9227 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9967 -7.9967 -7.6336 -7.6336 -7.6079 -7.6079 3.1773 3.1773 5.9078 5.9078 7.7817 7.7817 9.0424 9.0424 9.0699 9.0699 9.1233 9.1233 10.6386 10.6386 11.1848 11.1848 11.2750 11.2750 11.8065 11.8065 12.3826 12.3826 12.4549 12.4549 13.4586 13.4586 13.5705 13.5705 13.7370 13.7370 14.7126 14.7126 16.3479 16.3479 16.3800 16.3800 17.7506 17.7506 k = 0.0469 0.0270-0.0000 ( 3819 PWs) bands (ev): -64.9553 -64.9553 -64.9227 -64.9227 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9968 -7.9968 -7.6336 -7.6336 -7.6080 -7.6080 3.1840 3.1840 5.8949 5.8949 7.7856 7.7856 9.0432 9.0432 9.0701 9.0701 9.1243 9.1243 10.6215 10.6215 11.1833 11.1833 11.2716 11.2716 11.7961 11.7961 12.4088 12.4088 12.4552 12.4552 13.4564 13.4564 13.5666 13.5666 13.7371 13.7371 14.7302 14.7302 16.3662 16.3662 16.3991 16.3991 17.7467 17.7467 k = 0.0625 0.0360-0.0000 ( 3815 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9968 -7.9968 -7.6336 -7.6336 -7.6081 -7.6081 3.1934 3.1934 5.8770 5.8770 7.7908 7.7908 9.0444 9.0444 9.0706 9.0706 9.1258 9.1258 10.5987 10.5987 11.1810 11.1810 11.2669 11.2669 11.7818 11.7818 12.4447 12.4447 12.4556 12.4556 13.4534 13.4534 13.5614 13.5614 13.7371 13.7371 14.7545 14.7545 16.3916 16.3916 16.4256 16.4256 17.7414 17.7414 k = 0.0781 0.0450-0.0000 ( 3815 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9968 -7.9968 -7.6335 -7.6335 -7.6083 -7.6083 3.2054 3.2054 5.8544 5.8544 7.7971 7.7971 9.0460 9.0460 9.0711 9.0711 9.1276 9.1276 10.5711 10.5711 11.1778 11.1778 11.2607 11.2607 11.7641 11.7641 12.4561 12.4561 12.4894 12.4894 13.4498 13.4498 13.5549 13.5549 13.7372 13.7372 14.7852 14.7852 16.4238 16.4238 16.4592 16.4592 17.7347 17.7347 k = 0.0938 0.0540-0.0000 ( 3815 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6155 -31.6155 -31.6105 -31.6105 -31.5836 -31.5836 -26.6948 -26.6948 -7.9969 -7.9969 -7.6335 -7.6335 -7.6085 -7.6085 3.2200 3.2200 5.8274 5.8274 7.8043 7.8043 9.0479 9.0479 9.0718 9.0718 9.1298 9.1298 10.5398 10.5398 11.1735 11.1735 11.2533 11.2533 11.7432 11.7432 12.4566 12.4566 12.5423 12.5423 13.4456 13.4456 13.5475 13.5475 13.7372 13.7372 14.8218 14.8218 16.4628 16.4628 16.4997 16.4997 17.7267 17.7267 k = 0.1094 0.0630-0.0000 ( 3823 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5836 -31.5836 -26.6947 -26.6947 -7.9970 -7.9970 -7.6335 -7.6335 -7.6087 -7.6087 3.2373 3.2373 5.7961 5.7961 7.8120 7.8120 9.0500 9.0500 9.0724 9.0724 9.1324 9.1324 10.5056 10.5056 11.1680 11.1680 11.2447 11.2447 11.7196 11.7196 12.4570 12.4570 12.6026 12.6026 13.4411 13.4411 13.5393 13.5393 13.7373 13.7373 14.8637 14.8637 16.5081 16.5081 16.5467 16.5467 17.7174 17.7174 k = 0.1250 0.0721-0.0000 ( 3823 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5837 -31.5837 -26.6947 -26.6947 -7.9970 -7.9970 -7.6334 -7.6334 -7.6090 -7.6090 3.2571 3.2571 5.7610 5.7610 7.8200 7.8200 9.0525 9.0525 9.0732 9.0732 9.1353 9.1353 10.4694 10.4694 11.1614 11.1614 11.2349 11.2349 11.6937 11.6937 12.4575 12.4575 12.6695 12.6695 13.4364 13.4364 13.5306 13.5306 13.7374 13.7374 14.9106 14.9106 16.5594 16.5594 16.5999 16.5999 17.7070 17.7070 k = 0.1406 0.0811-0.0000 ( 3826 PWs) bands (ev): -64.9553 -64.9553 -64.9228 -64.9228 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5837 -31.5837 -26.6947 -26.6947 -7.9971 -7.9971 -7.6334 -7.6334 -7.6093 -7.6093 3.2795 3.2795 5.7222 5.7222 7.8279 7.8279 9.0553 9.0553 9.0741 9.0741 9.1386 9.1386 10.4322 10.4322 11.1537 11.1537 11.2240 11.2240 11.6659 11.6659 12.4580 12.4580 12.7422 12.7422 13.4317 13.4317 13.5218 13.5218 13.7374 13.7374 14.9618 14.9618 16.6164 16.6164 16.6589 16.6589 17.6957 17.6957 k = 0.1562 0.0901-0.0000 ( 3818 PWs) bands (ev): -64.9553 -64.9553 -64.9227 -64.9227 -35.6011 -35.6011 -35.5075 -35.5075 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5837 -31.5837 -26.6946 -26.6946 -7.9972 -7.9972 -7.6333 -7.6333 -7.6096 -7.6096 3.3044 3.3044 5.6802 5.6802 7.8356 7.8356 9.0584 9.0584 9.0752 9.0752 9.1423 9.1423 10.3946 10.3946 11.1449 11.1449 11.2121 11.2121 11.6366 11.6366 12.4584 12.4584 12.8202 12.8202 13.4271 13.4271 13.5129 13.5129 13.7375 13.7375 15.0167 15.0167 16.6787 16.6787 16.7233 16.7233 17.6834 17.6834 k = 0.1719 0.0991-0.0000 ( 3822 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5837 -31.5837 -26.6946 -26.6946 -7.9973 -7.9973 -7.6333 -7.6333 -7.6100 -7.6100 3.3317 3.3317 5.6351 5.6351 7.8428 7.8428 9.0616 9.0616 9.0763 9.0763 9.1462 9.1462 10.3572 10.3572 11.1350 11.1350 11.1992 11.1992 11.6063 11.6063 12.4588 12.4588 12.9028 12.9028 13.4228 13.4228 13.5043 13.5043 13.7376 13.7376 15.0748 15.0748 16.7459 16.7459 16.7926 16.7926 17.6704 17.6704 k = 0.1875 0.1081-0.0000 ( 3814 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5837 -31.5837 -26.6945 -26.6945 -7.9974 -7.9974 -7.6332 -7.6332 -7.6103 -7.6103 3.3615 3.3615 5.5873 5.5873 7.8492 7.8492 9.0651 9.0651 9.0775 9.0775 9.1504 9.1504 10.3205 10.3205 11.1243 11.1243 11.1855 11.1855 11.5752 11.5752 12.4592 12.4592 12.9893 12.9893 13.4189 13.4189 13.4963 13.4963 13.7379 13.7379 15.1353 15.1353 16.8177 16.8177 16.8665 16.8665 17.6568 17.6568 k = 0.2031 0.1171-0.0000 ( 3814 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5838 -31.5838 -26.6945 -26.6945 -7.9975 -7.9975 -7.6332 -7.6332 -7.6107 -7.6107 3.3936 3.3936 5.5370 5.5370 7.8548 7.8548 9.0687 9.0687 9.0789 9.0789 9.1549 9.1549 10.2849 10.2849 11.1128 11.1128 11.1712 11.1712 11.5439 11.5439 12.4595 12.4595 13.0792 13.0792 13.4154 13.4154 13.4891 13.4891 13.7380 13.7380 15.1978 15.1978 16.8936 16.8936 16.9445 16.9445 17.6428 17.6428 k = 0.2188 0.1261-0.0000 ( 3818 PWs) bands (ev): -64.9553 -64.9553 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5838 -31.5838 -26.6944 -26.6944 -7.9976 -7.9976 -7.6331 -7.6331 -7.6111 -7.6111 3.4281 3.4281 5.4846 5.4846 7.8593 7.8593 9.0722 9.0722 9.0804 9.0804 9.1594 9.1594 10.2509 10.2509 11.1006 11.1006 11.1564 11.1564 11.5124 11.5124 12.4598 12.4598 13.1716 13.1716 13.4125 13.4125 13.4832 13.4832 13.7381 13.7381 15.2615 15.2615 16.9731 16.9731 17.0260 17.0260 17.6284 17.6284 k = 0.2344 0.1351-0.0000 ( 3826 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5838 -31.5838 -26.6944 -26.6944 -7.9977 -7.9977 -7.6330 -7.6330 -7.6115 -7.6115 3.4648 3.4648 5.4301 5.4301 7.8626 7.8626 9.0756 9.0756 9.0822 9.0822 9.1643 9.1643 10.2186 10.2186 11.0878 11.0878 11.1411 11.1411 11.4814 11.4814 12.4598 12.4598 13.2649 13.2649 13.4101 13.4101 13.4799 13.4799 13.7384 13.7384 15.3260 15.3260 17.0559 17.0559 17.1106 17.1106 17.6138 17.6138 k = 0.2500 0.1441-0.0000 ( 3842 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5838 -31.5838 -26.6943 -26.6943 -7.9978 -7.9978 -7.6330 -7.6330 -7.6119 -7.6119 3.5037 3.5037 5.3739 5.3739 7.8648 7.8648 9.0785 9.0785 9.0845 9.0845 9.1691 9.1691 10.1883 10.1883 11.0745 11.0745 11.1254 11.1254 11.4509 11.4509 12.4599 12.4599 13.3541 13.3541 13.4083 13.4083 13.4835 13.4835 13.7388 13.7388 15.3906 15.3906 17.1414 17.1414 17.1979 17.1979 17.5991 17.5991 k = 0.2656 0.1531-0.0000 ( 3830 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5838 -31.5838 -26.6943 -26.6943 -7.9979 -7.9979 -7.6329 -7.6329 -7.6123 -7.6123 3.5448 3.5448 5.3161 5.3161 7.8659 7.8659 9.0809 9.0809 9.0877 9.0877 9.1742 9.1742 10.1601 10.1601 11.0610 11.0610 11.1097 11.1097 11.4212 11.4212 12.4602 12.4602 13.4071 13.4071 13.4174 13.4174 13.5155 13.5155 13.7397 13.7397 15.4549 15.4549 17.2291 17.2291 17.2872 17.2872 17.5846 17.5846 k = 0.2812 0.1621-0.0000 ( 3830 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5839 -31.5839 -26.6942 -26.6942 -7.9980 -7.9980 -7.6329 -7.6329 -7.6127 -7.6127 3.5878 3.5878 5.2569 5.2569 7.8659 7.8659 9.0826 9.0826 9.0914 9.0914 9.1793 9.1793 10.1341 10.1341 11.0474 11.0474 11.0940 11.0940 11.3925 11.3925 12.4604 12.4604 13.4066 13.4066 13.4356 13.4356 13.5936 13.5936 13.7416 13.7416 15.5180 15.5180 17.3184 17.3184 17.3778 17.3778 17.5704 17.5704 k = 0.2969 0.1711-0.0000 ( 3834 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5839 -31.5839 -26.6942 -26.6942 -7.9982 -7.9982 -7.6328 -7.6328 -7.6131 -7.6131 3.6329 3.6329 5.1966 5.1966 7.8649 7.8649 9.0841 9.0841 9.0953 9.0953 9.1844 9.1844 10.1103 10.1103 11.0338 11.0338 11.0785 11.0785 11.3651 11.3651 12.4605 12.4605 13.4065 13.4065 13.4381 13.4381 13.6826 13.6826 13.7498 13.7498 15.5795 15.5795 17.4087 17.4087 17.4690 17.4690 17.5565 17.5565 k = 0.3125 0.1801-0.0000 ( 3842 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5839 -31.5839 -26.6942 -26.6942 -7.9983 -7.9983 -7.6328 -7.6328 -7.6135 -7.6135 3.6798 3.6798 5.1352 5.1352 7.8629 7.8629 9.0854 9.0854 9.0993 9.0993 9.1895 9.1895 10.0887 10.0887 11.0203 11.0203 11.0633 11.0633 11.3391 11.3391 12.4606 12.4606 13.4069 13.4069 13.4376 13.4376 13.7265 13.7265 13.8071 13.8071 15.6390 15.6390 17.4990 17.4990 17.5431 17.5431 17.5600 17.5600 k = 0.3281 0.1891-0.0000 ( 3842 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5839 -31.5839 -26.6941 -26.6941 -7.9984 -7.9984 -7.6327 -7.6327 -7.6139 -7.6139 3.7286 3.7286 5.0730 5.0730 7.8602 7.8602 9.0867 9.0867 9.1033 9.1033 9.1944 9.1944 10.0694 10.0694 11.0073 11.0073 11.0488 11.0488 11.3146 11.3146 12.4607 12.4607 13.4077 13.4077 13.4364 13.4364 13.7323 13.7323 13.9034 13.9034 15.6958 15.6958 17.5302 17.5302 17.5887 17.5887 17.6495 17.6495 k = 0.3438 0.1981-0.0000 ( 3842 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5840 -31.5840 -26.6941 -26.6941 -7.9985 -7.9985 -7.6326 -7.6326 -7.6142 -7.6142 3.7791 3.7791 5.0100 5.0100 7.8569 7.8569 9.0878 9.0878 9.1072 9.1072 9.1992 9.1992 10.0522 10.0522 10.9948 10.9948 11.0348 11.0348 11.2918 11.2918 12.4608 12.4608 13.4089 13.4089 13.4353 13.4353 13.7338 13.7338 14.0032 14.0032 15.7496 15.7496 17.5182 17.5182 17.6763 17.6763 17.7365 17.7365 k = 0.3594 0.2072-0.0000 ( 3846 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5840 -31.5840 -26.6940 -26.6940 -7.9986 -7.9986 -7.6326 -7.6326 -7.6145 -7.6145 3.8311 3.8311 4.9466 4.9466 7.8533 7.8533 9.0888 9.0888 9.1109 9.1109 9.2037 9.2037 10.0370 10.0370 10.9829 10.9829 11.0217 11.0217 11.2708 11.2708 12.4607 12.4607 13.4103 13.4103 13.4343 13.4343 13.7345 13.7345 14.1018 14.1018 15.7997 15.7997 17.5069 17.5069 17.7605 17.7605 17.8192 17.8192 k = 0.3750 0.2162-0.0000 ( 3846 PWs) bands (ev): -64.9554 -64.9554 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5840 -31.5840 -26.6940 -26.6940 -7.9986 -7.9986 -7.6326 -7.6326 -7.6148 -7.6148 3.8847 3.8847 4.8827 4.8827 7.8493 7.8493 9.0898 9.0898 9.1143 9.1143 9.2080 9.2080 10.0239 10.0239 10.9718 10.9718 11.0096 11.0096 11.2518 11.2518 12.4608 12.4608 13.4119 13.4119 13.4337 13.4337 13.7349 13.7349 14.1974 14.1974 15.8458 15.8458 17.4966 17.4966 17.8399 17.8399 17.8960 17.8960 k = 0.3906 0.2252-0.0000 ( 3862 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5840 -31.5840 -26.6940 -26.6940 -7.9987 -7.9987 -7.6325 -7.6325 -7.6151 -7.6151 3.9397 3.9397 4.8185 4.8185 7.8453 7.8453 9.0906 9.0906 9.1174 9.1174 9.2118 9.2118 10.0125 10.0125 10.9617 10.9617 10.9986 10.9986 11.2347 11.2347 12.4608 12.4608 13.4136 13.4136 13.4333 13.4333 13.7350 13.7350 14.2883 14.2883 15.8875 15.8875 17.4873 17.4873 17.9126 17.9126 17.9652 17.9652 k = 0.4062 0.2342-0.0000 ( 3854 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6154 -31.6154 -31.6105 -31.6105 -31.5840 -31.5840 -26.6939 -26.6939 -7.9988 -7.9988 -7.6325 -7.6325 -7.6153 -7.6153 3.9958 3.9958 4.7544 4.7544 7.8415 7.8415 9.0914 9.0914 9.1204 9.1204 9.2154 9.2154 10.0030 10.0030 10.9527 10.9527 10.9888 10.9888 11.2198 11.2198 12.4609 12.4609 13.4152 13.4152 13.4331 13.4331 13.7352 13.7352 14.3729 14.3729 15.9244 15.9244 17.4791 17.4791 17.9773 17.9773 18.0252 18.0252 k = 0.4219 0.2432-0.0000 ( 3854 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5840 -31.5840 -26.6939 -26.6939 -7.9988 -7.9988 -7.6325 -7.6325 -7.6155 -7.6155 4.0531 4.0531 4.6903 4.6903 7.8379 7.8379 9.0920 9.0920 9.1229 9.1229 9.2184 9.2184 9.9950 9.9950 10.9448 10.9448 10.9803 10.9803 11.2072 11.2072 12.4609 12.4609 13.4167 13.4167 13.4330 13.4330 13.7353 13.7353 14.4494 14.4494 15.9562 15.9562 17.4720 17.4720 18.0323 18.0323 18.0743 18.0743 k = 0.4375 0.2522-0.0000 ( 3850 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5840 -31.5840 -26.6939 -26.6939 -7.9989 -7.9989 -7.6324 -7.6324 -7.6157 -7.6157 4.1111 4.1111 4.6268 4.6268 7.8348 7.8348 9.0925 9.0925 9.1250 9.1250 9.2210 9.2210 9.9888 9.9888 10.9383 10.9383 10.9732 10.9732 11.1966 11.1966 12.4609 12.4609 13.4181 13.4181 13.4331 13.4331 13.7353 13.7353 14.5159 14.5159 15.9825 15.9825 17.4662 17.4662 18.0648 18.0648 18.0769 18.0769 k = 0.4531 0.2612-0.0000 ( 3858 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5840 -31.5840 -26.6939 -26.6939 -7.9989 -7.9989 -7.6324 -7.6324 -7.6158 -7.6158 4.1693 4.1693 4.5641 4.5641 7.8323 7.8323 9.0928 9.0928 9.1266 9.1266 9.2231 9.2231 9.9839 9.9839 10.9331 10.9331 10.9676 10.9676 11.1883 11.1883 12.4609 12.4609 13.4192 13.4192 13.4331 13.4331 13.7354 13.7354 14.5703 14.5703 16.0032 16.0032 17.4615 17.4615 18.0037 18.0037 18.1108 18.1108 k = 0.4688 0.2702-0.0000 ( 3858 PWs) bands (ev): -64.9555 -64.9555 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5841 -31.5841 -26.6939 -26.6939 -7.9990 -7.9990 -7.6324 -7.6324 -7.6159 -7.6159 4.2267 4.2267 4.5036 4.5036 7.8304 7.8304 9.0931 9.0931 9.1279 9.1279 9.2246 9.2246 9.9805 9.9805 10.9292 10.9292 10.9635 10.9635 11.1825 11.1825 12.4609 12.4609 13.4199 13.4199 13.4332 13.4332 13.7354 13.7354 14.6107 14.6107 16.0182 16.0182 17.4582 17.4582 17.9551 17.9551 18.1343 18.1343 k = 0.4844 0.2792-0.0000 ( 3858 PWs) bands (ev): -64.9555 -64.9555 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5841 -31.5841 -26.6939 -26.6939 -7.9990 -7.9990 -7.6324 -7.6324 -7.6160 -7.6160 4.2792 4.2792 4.4492 4.4492 7.8292 7.8292 9.0933 9.0933 9.1287 9.1287 9.2255 9.2255 9.9784 9.9784 10.9269 10.9269 10.9611 10.9611 11.1789 11.1789 12.4610 12.4610 13.4205 13.4205 13.4333 13.4333 13.7354 13.7354 14.6357 14.6357 16.0273 16.0273 17.4562 17.4562 17.9244 17.9244 18.1481 18.1481 k = 0.5000 0.2882-0.0000 ( 3858 PWs) bands (ev): -64.9555 -64.9555 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5841 -31.5841 -26.6939 -26.6939 -7.9990 -7.9990 -7.6324 -7.6324 -7.6160 -7.6160 4.3070 4.3070 4.4208 4.4208 7.8288 7.8288 9.0933 9.0933 9.1289 9.1289 9.2258 9.2258 9.9778 9.9778 10.9262 10.9262 10.9602 10.9602 11.1778 11.1778 12.4610 12.4610 13.4206 13.4206 13.4333 13.4333 13.7354 13.7354 14.6441 14.6441 16.0303 16.0303 17.4555 17.4555 17.9139 17.9139 18.1526 18.1526 k = 0.5000 0.2882-0.0000 ( 3858 PWs) bands (ev): -64.9555 -64.9555 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5841 -31.5841 -26.6939 -26.6939 -7.9990 -7.9990 -7.6324 -7.6324 -7.6160 -7.6160 4.3070 4.3070 4.4208 4.4208 7.8288 7.8288 9.0933 9.0933 9.1289 9.1289 9.2258 9.2258 9.9778 9.9778 10.9262 10.9262 10.9602 10.9602 11.1778 11.1778 12.4610 12.4610 13.4206 13.4206 13.4333 13.4333 13.7354 13.7354 14.6441 14.6441 16.0303 16.0303 17.4555 17.4555 17.9139 17.9139 18.1526 18.1526 k = 0.4937 0.2992 0.0126 ( 3854 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5077 -35.5077 -31.8123 -31.8123 -31.6153 -31.6153 -31.6106 -31.6106 -31.5841 -31.5841 -26.6938 -26.6938 -7.9990 -7.9990 -7.6324 -7.6324 -7.6160 -7.6160 4.3077 4.3077 4.4221 4.4221 7.8301 7.8301 9.0917 9.0917 9.1312 9.1312 9.2266 9.2266 9.9787 9.9787 10.9229 10.9229 10.9564 10.9564 11.1813 11.1813 12.4594 12.4594 13.4086 13.4086 13.4216 13.4216 13.7481 13.7481 14.6510 14.6510 16.0336 16.0336 17.4541 17.4541 17.9112 17.9112 18.1505 18.1505 k = 0.4874 0.3101 0.0253 ( 3846 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6010 -35.6010 -35.5078 -35.5078 -31.8121 -31.8121 -31.6153 -31.6153 -31.6109 -31.6109 -31.5841 -31.5841 -26.6938 -26.6938 -7.9991 -7.9991 -7.6326 -7.6326 -7.6160 -7.6160 4.3096 4.3096 4.4260 4.4260 7.8340 7.8340 9.0879 9.0879 9.1369 9.1369 9.2291 9.2291 9.9815 9.9815 10.9124 10.9124 10.9468 10.9468 11.1910 11.1910 12.4545 12.4545 13.3747 13.3747 13.3902 13.3902 13.7807 13.7807 14.6707 14.6707 16.0436 16.0436 17.4501 17.4501 17.9023 17.9023 18.1430 18.1430 k = 0.4810 0.3211 0.0379 ( 3842 PWs) bands (ev): -64.9553 -64.9553 -64.9229 -64.9229 -35.6008 -35.6008 -35.5080 -35.5080 -31.8117 -31.8117 -31.6152 -31.6152 -31.6113 -31.6113 -31.5842 -31.5842 -26.6938 -26.6938 -7.9992 -7.9992 -7.6329 -7.6329 -7.6160 -7.6160 4.3129 4.3129 4.4324 4.4324 7.8405 7.8405 9.0835 9.0835 9.1439 9.1439 9.2336 9.2336 9.9861 9.9861 10.8934 10.8934 10.9345 10.9345 11.2048 11.2048 12.4463 12.4463 13.3263 13.3263 13.3430 13.3430 13.8247 13.8247 14.7010 14.7010 16.0600 16.0600 17.4437 17.4437 17.8853 17.8853 18.1292 18.1292 k = 0.4747 0.3321 0.0506 ( 3840 PWs) bands (ev): -64.9552 -64.9552 -64.9229 -64.9229 -35.6005 -35.6005 -35.5082 -35.5082 -31.8112 -31.8112 -31.6152 -31.6152 -31.6119 -31.6119 -31.5843 -31.5843 -26.6938 -26.6938 -7.9994 -7.9994 -7.6332 -7.6332 -7.6160 -7.6160 4.3175 4.3175 4.4414 4.4414 7.8497 7.8497 9.0794 9.0794 9.1510 9.1510 9.2406 9.2406 9.9924 9.9924 10.8666 10.8666 10.9208 10.9208 11.2206 11.2206 12.4348 12.4348 13.2693 13.2693 13.2830 13.2830 13.8739 13.8739 14.7393 14.7393 16.0828 16.0828 17.4356 17.4356 17.8576 17.8576 18.1125 18.1125 k = 0.4684 0.3430 0.0632 ( 3826 PWs) bands (ev): -64.9551 -64.9551 -64.9230 -64.9230 -35.6002 -35.6002 -35.5085 -35.5085 -31.8105 -31.8105 -31.6151 -31.6151 -31.6126 -31.6126 -31.5844 -31.5844 -26.6937 -26.6937 -7.9997 -7.9997 -7.6337 -7.6337 -7.6160 -7.6160 4.3233 4.3233 4.4530 4.4530 7.8613 7.8613 9.0763 9.0763 9.1572 9.1572 9.2506 9.2506 10.0004 10.0004 10.8340 10.8340 10.9054 10.9054 11.2370 11.2370 12.4200 12.4200 13.2038 13.2038 13.2163 13.2163 13.9252 13.9252 14.7825 14.7825 16.1115 16.1115 17.4266 17.4266 17.8166 17.8166 18.0969 18.0969 k = 0.4621 0.3540 0.0759 ( 3828 PWs) bands (ev): -64.9549 -64.9549 -64.9232 -64.9232 -35.5998 -35.5998 -35.5089 -35.5089 -31.8097 -31.8097 -31.6150 -31.6150 -31.6135 -31.6135 -31.5845 -31.5845 -26.6937 -26.6937 -8.0000 -8.0000 -7.6344 -7.6344 -7.6160 -7.6160 4.3303 4.3303 4.4671 4.4671 7.8754 7.8754 9.0741 9.0741 9.1622 9.1622 9.2638 9.2638 10.0099 10.0099 10.7969 10.7969 10.8877 10.8877 11.2530 11.2530 12.4019 12.4019 13.1266 13.1266 13.1507 13.1507 13.9767 13.9767 14.8285 14.8285 16.1459 16.1459 17.4176 17.4176 17.7615 17.7615 18.0690 18.0690 k = 0.4558 0.3649 0.0885 ( 3831 PWs) bands (ev): -64.9548 -64.9548 -64.9233 -64.9233 -35.5993 -35.5993 -35.5094 -35.5094 -31.8087 -31.8087 -31.6150 -31.6150 -31.6144 -31.6144 -31.5847 -31.5847 -26.6936 -26.6936 -8.0004 -8.0004 -7.6351 -7.6351 -7.6159 -7.6159 4.3385 4.3385 4.4836 4.4836 7.8920 7.8920 9.0732 9.0732 9.1661 9.1661 9.2800 9.2800 10.0210 10.0210 10.7563 10.7563 10.8675 10.8675 11.2679 11.2679 12.3806 12.3806 13.0419 13.0419 13.0852 13.0852 14.0274 14.0274 14.8752 14.8752 16.1854 16.1854 17.4095 17.4095 17.6934 17.6934 17.9887 17.9887 k = 0.4495 0.3759 0.1012 ( 3827 PWs) bands (ev): -64.9546 -64.9546 -64.9235 -64.9235 -35.5988 -35.5988 -35.5100 -35.5100 -31.8076 -31.8076 -31.6159 -31.6159 -31.6146 -31.6146 -31.5849 -31.5849 -26.6936 -26.6936 -8.0008 -8.0008 -7.6359 -7.6359 -7.6158 -7.6158 4.3478 4.3478 4.5026 4.5026 7.9111 7.9111 9.0736 9.0736 9.1691 9.1691 9.2991 9.2991 10.0334 10.0334 10.7127 10.7127 10.8448 10.8448 11.2812 11.2812 12.3561 12.3561 12.9534 12.9534 13.0189 13.0189 14.0766 14.0766 14.9212 14.9212 16.2295 16.2295 17.4030 17.4030 17.6147 17.6147 17.8938 17.8938 k = 0.4431 0.3868 0.1138 ( 3829 PWs) bands (ev): -64.9543 -64.9543 -64.9237 -64.9237 -35.5982 -35.5982 -35.5106 -35.5106 -31.8063 -31.8063 -31.6173 -31.6173 -31.6144 -31.6144 -31.5852 -31.5852 -26.6935 -26.6935 -8.0013 -8.0013 -7.6369 -7.6369 -7.6157 -7.6157 4.3581 4.3581 4.5240 4.5240 7.9326 7.9326 9.0752 9.0752 9.1717 9.1717 9.3205 9.3205 10.0471 10.0471 10.6662 10.6662 10.8198 10.8198 11.2926 11.2926 12.3284 12.3284 12.8628 12.8628 12.9518 12.9518 14.1239 14.1239 14.9655 14.9655 16.2776 16.2776 17.3988 17.3988 17.5276 17.5276 17.7903 17.7903 k = 0.4368 0.3978 0.1265 ( 3833 PWs) bands (ev): -64.9541 -64.9541 -64.9240 -64.9240 -35.5975 -35.5975 -35.5113 -35.5113 -31.8049 -31.8049 -31.6188 -31.6188 -31.6142 -31.6142 -31.5854 -31.5854 -26.6934 -26.6934 -8.0018 -8.0018 -7.6380 -7.6380 -7.6156 -7.6156 4.3695 4.3695 4.5478 4.5478 7.9565 7.9565 9.0782 9.0782 9.1742 9.1742 9.3441 9.3441 10.0619 10.0619 10.6170 10.6170 10.7924 10.7924 11.3019 11.3019 12.2975 12.2975 12.7718 12.7718 12.8840 12.8840 14.1688 14.1688 15.0074 15.0074 16.3291 16.3291 17.3946 17.3946 17.4371 17.4371 17.6824 17.6824 k = 0.4305 0.4088 0.1391 ( 3835 PWs) bands (ev): -64.9538 -64.9538 -64.9243 -64.9243 -35.5968 -35.5968 -35.5121 -35.5121 -31.8034 -31.8034 -31.6205 -31.6205 -31.6140 -31.6140 -31.5857 -31.5857 -26.6933 -26.6933 -8.0024 -8.0024 -7.6392 -7.6392 -7.6154 -7.6154 4.3818 4.3818 4.5739 4.5739 7.9826 7.9826 9.0825 9.0825 9.1770 9.1770 9.3698 9.3698 10.0776 10.0776 10.5653 10.5653 10.7629 10.7629 11.3089 11.3089 12.2634 12.2634 12.6815 12.6815 12.8157 12.8157 14.2111 14.2111 15.0461 15.0461 16.3832 16.3832 17.3295 17.3295 17.4059 17.4059 17.5739 17.5739 k = 0.4242 0.4197 0.1518 ( 3845 PWs) bands (ev): -64.9536 -64.9536 -64.9246 -64.9246 -35.5960 -35.5960 -35.5129 -35.5129 -31.8017 -31.8017 -31.6224 -31.6224 -31.6138 -31.6138 -31.5860 -31.5860 -26.6932 -26.6932 -8.0031 -8.0031 -7.6404 -7.6404 -7.6153 -7.6153 4.3949 4.3949 4.6022 4.6022 8.0110 8.0110 9.0881 9.0881 9.1803 9.1803 9.3973 9.3973 10.0940 10.0940 10.5112 10.5112 10.7315 10.7315 11.3134 11.3134 12.2261 12.2261 12.5930 12.5930 12.7470 12.7470 14.2505 14.2505 15.0811 15.0811 16.4390 16.4390 17.2276 17.2276 17.4087 17.4087 17.4708 17.4708 k = 0.4179 0.4307 0.1644 ( 3845 PWs) bands (ev): -64.9533 -64.9533 -64.9249 -64.9249 -35.5951 -35.5951 -35.5138 -35.5138 -31.7999 -31.7999 -31.6243 -31.6243 -31.6136 -31.6136 -31.5864 -31.5864 -26.6931 -26.6931 -8.0038 -8.0038 -7.6418 -7.6418 -7.6150 -7.6150 4.4087 4.4087 4.6327 4.6327 8.0414 8.0414 9.0949 9.0949 9.1845 9.1845 9.4265 9.4265 10.1110 10.1110 10.4547 10.4547 10.6983 10.6983 11.3154 11.3154 12.1857 12.1857 12.5071 12.5071 12.6778 12.6778 14.2870 14.2870 15.1118 15.1118 16.4954 16.4954 17.1217 17.1217 17.3569 17.3569 17.4339 17.4339 k = 0.4116 0.4416 0.1771 ( 3845 PWs) bands (ev): -64.9529 -64.9529 -64.9252 -64.9252 -35.5942 -35.5942 -35.5148 -35.5148 -31.7979 -31.7979 -31.6265 -31.6265 -31.6133 -31.6133 -31.5867 -31.5867 -26.6930 -26.6930 -8.0045 -8.0045 -7.6432 -7.6432 -7.6148 -7.6148 4.4232 4.4232 4.6653 4.6653 8.0740 8.0740 9.1029 9.1029 9.1897 9.1897 9.4573 9.4573 10.1282 10.1282 10.3961 10.3961 10.6636 10.6636 11.3149 11.3149 12.1422 12.1422 12.4245 12.4245 12.6083 12.6083 14.3204 14.3204 15.1376 15.1376 16.5507 16.5507 17.0133 17.0133 17.2661 17.2661 17.4500 17.4500 k = 0.4052 0.4526 0.1897 ( 3847 PWs) bands (ev): -64.9526 -64.9526 -64.9256 -64.9256 -35.5932 -35.5932 -35.5158 -35.5158 -31.7959 -31.7959 -31.6288 -31.6288 -31.6130 -31.6130 -31.5871 -31.5871 -26.6929 -26.6929 -8.0052 -8.0052 -7.6447 -7.6447 -7.6145 -7.6145 4.4381 4.4381 4.7000 4.7000 8.1084 8.1084 9.1122 9.1122 9.1962 9.1962 9.4896 9.4896 10.1448 10.1448 10.3360 10.3360 10.6277 10.6277 11.3117 11.3117 12.0958 12.0958 12.3456 12.3456 12.5385 12.5385 14.3506 14.3506 15.1578 15.1578 16.6021 16.6021 16.9033 16.9033 17.1857 17.1857 17.4743 17.4743 k = 0.3989 0.4636 0.2024 ( 3843 PWs) bands (ev): -64.9522 -64.9522 -64.9259 -64.9259 -35.5921 -35.5921 -35.5169 -35.5169 -31.7937 -31.7937 -31.6312 -31.6312 -31.6127 -31.6127 -31.5875 -31.5875 -26.6928 -26.6928 -8.0060 -8.0060 -7.6462 -7.6462 -7.6141 -7.6141 4.4535 4.4535 4.7365 4.7365 8.1447 8.1447 9.1225 9.1225 9.2042 9.2042 9.5233 9.5233 10.1588 10.1588 10.2764 10.2764 10.5909 10.5909 11.3061 11.3061 12.0467 12.0467 12.2708 12.2708 12.4684 12.4684 14.3779 14.3779 15.1715 15.1715 16.6451 16.6451 16.7923 16.7923 17.1236 17.1236 17.5048 17.5048 k = 0.3926 0.4745 0.2150 ( 3847 PWs) bands (ev): -64.9518 -64.9518 -64.9263 -64.9263 -35.5910 -35.5910 -35.5180 -35.5180 -31.7913 -31.7913 -31.6337 -31.6337 -31.6123 -31.6123 -31.5879 -31.5879 -26.6927 -26.6927 -8.0069 -8.0069 -7.6478 -7.6478 -7.6138 -7.6138 4.4690 4.4690 4.7749 4.7749 8.1826 8.1826 9.1339 9.1339 9.2138 9.2138 9.5583 9.5583 10.1592 10.1592 10.2281 10.2281 10.5535 10.5535 11.2981 11.2981 11.9950 11.9950 12.2000 12.2000 12.3981 12.3981 14.4022 14.4022 15.1779 15.1779 16.6657 16.6657 16.6886 16.6886 17.0876 17.0876 17.5415 17.5415 k = 0.3863 0.4855 0.2277 ( 3853 PWs) bands (ev): -64.9514 -64.9514 -64.9268 -64.9268 -35.5899 -35.5899 -35.5192 -35.5192 -31.7889 -31.7889 -31.6364 -31.6364 -31.6120 -31.6120 -31.5884 -31.5884 -26.6926 -26.6926 -8.0077 -8.0077 -7.6494 -7.6494 -7.6134 -7.6134 4.4847 4.4847 4.8151 4.8151 8.2221 8.2221 9.1462 9.1462 9.2251 9.2251 9.5945 9.5945 10.1183 10.1183 10.2184 10.2184 10.5164 10.5164 11.2879 11.2879 11.9416 11.9416 12.1330 12.1330 12.3275 12.3275 14.4236 14.4236 15.1762 15.1762 16.5649 16.5649 16.6870 16.6870 17.0837 17.0837 17.5839 17.5839 k = 0.3800 0.4964 0.2403 ( 3857 PWs) bands (ev): -64.9509 -64.9509 -64.9272 -64.9272 -35.5886 -35.5886 -35.5205 -35.5205 -31.7863 -31.7863 -31.6392 -31.6392 -31.6116 -31.6116 -31.5888 -31.5888 -26.6925 -26.6925 -8.0086 -8.0086 -7.6510 -7.6510 -7.6131 -7.6131 4.5004 4.5004 4.8569 4.8569 8.2628 8.2628 9.1597 9.1597 9.2385 9.2385 9.6317 9.6317 10.0556 10.0556 10.2276 10.2276 10.4804 10.4804 11.2757 11.2757 11.8866 11.8866 12.0694 12.0694 12.2567 12.2567 14.4425 14.4425 15.1658 15.1658 16.4519 16.4519 16.6818 16.6818 17.1096 17.1096 17.6321 17.6321 k = 0.3737 0.5074 0.2530 ( 3857 PWs) bands (ev): -64.9505 -64.9505 -64.9277 -64.9277 -35.5874 -35.5874 -35.5218 -35.5218 -31.7836 -31.7836 -31.6421 -31.6421 -31.6112 -31.6112 -31.5893 -31.5893 -26.6923 -26.6923 -8.0095 -8.0095 -7.6526 -7.6526 -7.6127 -7.6127 4.5158 4.5158 4.9002 4.9002 8.3047 8.3047 9.1742 9.1742 9.2538 9.2538 9.6694 9.6694 9.9885 9.9885 10.2372 10.2372 10.4475 10.4475 11.2618 11.2618 11.8307 11.8307 12.0088 12.0088 12.1858 12.1858 14.4589 14.4589 15.1465 15.1465 16.3384 16.3384 16.6710 16.6710 17.1567 17.1567 17.6860 17.6860 k = 0.3673 0.5184 0.2656 ( 3863 PWs) bands (ev): -64.9500 -64.9500 -64.9281 -64.9281 -35.5860 -35.5860 -35.5231 -35.5231 -31.7808 -31.7808 -31.6451 -31.6451 -31.6108 -31.6108 -31.5898 -31.5898 -26.6922 -26.6922 -8.0105 -8.0105 -7.6542 -7.6542 -7.6123 -7.6123 4.5308 4.5308 4.9448 4.9448 8.3474 8.3474 9.1899 9.1899 9.2710 9.2710 9.7062 9.7062 9.9215 9.9215 10.2413 10.2413 10.4207 10.4207 11.2466 11.2466 11.7744 11.7744 11.9506 11.9506 12.1147 12.1147 14.4732 14.4732 15.1184 15.1184 16.2247 16.2247 16.6624 16.6624 17.2167 17.2167 17.7451 17.7451 k = 0.3610 0.5293 0.2783 ( 3863 PWs) bands (ev): -64.9495 -64.9495 -64.9286 -64.9286 -35.5846 -35.5846 -35.5246 -35.5246 -31.7779 -31.7779 -31.6483 -31.6483 -31.6104 -31.6104 -31.5903 -31.5903 -26.6921 -26.6921 -8.0114 -8.0114 -7.6558 -7.6558 -7.6119 -7.6119 4.5452 4.5452 4.9908 4.9908 8.3907 8.3907 9.2069 9.2069 9.2903 9.2903 9.7366 9.7366 9.8614 9.8614 10.2352 10.2352 10.4040 10.4040 11.2303 11.2303 11.7179 11.7179 11.8947 11.8947 12.0436 12.0436 14.4856 14.4856 15.0823 15.0823 16.1112 16.1112 16.6608 16.6608 17.2846 17.2846 17.8094 17.8094 k = 0.3547 0.5403 0.2909 ( 3859 PWs) bands (ev): -64.9490 -64.9490 -64.9291 -64.9291 -35.5832 -35.5832 -35.5260 -35.5260 -31.7749 -31.7749 -31.6515 -31.6515 -31.6099 -31.6099 -31.5908 -31.5908 -26.6920 -26.6920 -8.0123 -8.0123 -7.6573 -7.6573 -7.6114 -7.6114 4.5588 4.5588 5.0378 5.0378 8.4342 8.4342 9.2253 9.2253 9.3115 9.3115 9.7333 9.7333 9.8363 9.8363 10.2167 10.2167 10.3996 10.3996 11.2133 11.2133 11.6614 11.6614 11.8407 11.8407 11.9726 11.9726 14.4964 14.4964 15.0391 15.0391 15.9981 15.9981 16.6679 16.6679 17.3574 17.3574 17.8783 17.8783 k = 0.3484 0.5512 0.3036 ( 3845 PWs) bands (ev): -64.9484 -64.9484 -64.9297 -64.9297 -35.5817 -35.5817 -35.5275 -35.5275 -31.7718 -31.7718 -31.6548 -31.6548 -31.6095 -31.6095 -31.5913 -31.5913 -26.6919 -26.6919 -8.0132 -8.0132 -7.6588 -7.6588 -7.6110 -7.6110 4.5715 4.5715 5.0858 5.0858 8.4773 8.4773 9.2453 9.2453 9.3346 9.3346 9.6824 9.6824 9.8606 9.8606 10.1883 10.1883 10.4050 10.4050 11.1959 11.1959 11.6054 11.6054 11.7888 11.7888 11.9016 11.9016 14.5059 14.5059 14.9902 14.9902 15.8853 15.8853 16.6842 16.6842 17.4335 17.4335 17.9514 17.9514 k = 0.3421 0.5622 0.3162 ( 3845 PWs) bands (ev): -64.9479 -64.9479 -64.9302 -64.9302 -35.5802 -35.5802 -35.5290 -35.5290 -31.7686 -31.7686 -31.6582 -31.6582 -31.6090 -31.6090 -31.5919 -31.5919 -26.6918 -26.6918 -8.0141 -8.0141 -7.6603 -7.6603 -7.6106 -7.6106 4.5829 4.5829 5.1345 5.1345 8.5198 8.5198 9.2668 9.2668 9.3594 9.3594 9.6195 9.6195 9.8990 9.8990 10.1544 10.1544 10.4160 10.4160 11.1781 11.1781 11.5498 11.5498 11.7387 11.7387 11.8308 11.8308 14.5144 14.5144 14.9370 14.9370 15.7731 15.7731 16.7094 16.7094 17.5119 17.5119 17.9553 17.9553 k = 0.3358 0.5732 0.3289 ( 3845 PWs) bands (ev): -64.9473 -64.9473 -64.9307 -64.9307 -35.5787 -35.5787 -35.5306 -35.5306 -31.7653 -31.7653 -31.6617 -31.6617 -31.6085 -31.6085 -31.5925 -31.5925 -26.6917 -26.6917 -8.0150 -8.0150 -7.6616 -7.6616 -7.6102 -7.6102 4.5930 4.5930 5.1839 5.1839 8.5608 8.5608 9.2900 9.2900 9.3857 9.3857 9.5565 9.5565 9.9396 9.9396 10.1191 10.1191 10.4297 10.4297 11.1600 11.1600 11.4949 11.4949 11.6908 11.6908 11.7602 11.7602 14.5220 14.5220 14.8808 14.8808 15.6616 15.6616 16.7425 16.7425 17.5918 17.5918 17.8998 17.8998 k = 0.3294 0.5841 0.3415 ( 3841 PWs) bands (ev): -64.9468 -64.9468 -64.9313 -64.9313 -35.5771 -35.5771 -35.5323 -35.5323 -31.7619 -31.7619 -31.6652 -31.6652 -31.6080 -31.6080 -31.5930 -31.5930 -26.6916 -26.6916 -8.0158 -8.0158 -7.6630 -7.6630 -7.6098 -7.6098 4.6014 4.6014 5.2337 5.2337 8.5996 8.5996 9.3146 9.3146 9.4125 9.4125 9.4978 9.4978 9.9752 9.9752 10.0889 10.0889 10.4444 10.4444 11.1418 11.1418 11.4411 11.4411 11.6453 11.6453 11.6901 11.6901 14.5290 14.5290 14.8228 14.8228 15.5507 15.5507 16.7826 16.7826 17.6727 17.6727 17.8390 17.8390 k = 0.3231 0.5951 0.3542 ( 3839 PWs) bands (ev): -64.9462 -64.9462 -64.9319 -64.9319 -35.5754 -35.5754 -35.5339 -35.5339 -31.7584 -31.7584 -31.6689 -31.6689 -31.6075 -31.6075 -31.5936 -31.5936 -26.6915 -26.6915 -8.0167 -8.0167 -7.6642 -7.6642 -7.6094 -7.6094 4.6080 4.6080 5.2838 5.2838 8.6351 8.6351 9.3393 9.3393 9.4260 9.4260 9.4602 9.4602 9.9865 9.9865 10.0837 10.0837 10.4588 10.4588 11.1233 11.1233 11.3889 11.3889 11.6023 11.6023 11.6208 11.6208 14.5356 14.5356 14.7642 14.7642 15.4406 15.4406 16.8289 16.8289 17.7531 17.7531 17.7750 17.7750 k = 0.3168 0.6060 0.3668 ( 3847 PWs) bands (ev): -64.9456 -64.9456 -64.9324 -64.9324 -35.5738 -35.5738 -35.5356 -35.5356 -31.7549 -31.7549 -31.6726 -31.6726 -31.6069 -31.6069 -31.5942 -31.5942 -26.6914 -26.6914 -8.0174 -8.0174 -7.6654 -7.6654 -7.6091 -7.6091 4.6126 4.6126 5.3340 5.3340 8.6660 8.6660 9.3525 9.3525 9.4015 9.4015 9.4815 9.4815 9.9626 9.9626 10.1142 10.1142 10.4720 10.4720 11.1043 11.1043 11.3388 11.3388 11.5494 11.5494 11.5653 11.5653 14.5417 14.5417 14.7061 14.7061 15.3314 15.3314 16.8804 16.8804 17.7045 17.7045 17.8365 17.8365 k = 0.3105 0.6170 0.3795 ( 3859 PWs) bands (ev): -64.9451 -64.9451 -64.9330 -64.9330 -35.5721 -35.5721 -35.5374 -35.5374 -31.7513 -31.7513 -31.6764 -31.6764 -31.6064 -31.6064 -31.5949 -31.5949 -26.6913 -26.6913 -8.0182 -8.0182 -7.6665 -7.6665 -7.6087 -7.6087 4.6149 4.6149 5.3840 5.3840 8.6911 8.6911 9.3267 9.3267 9.4161 9.4161 9.5137 9.5137 9.9256 9.9256 10.1585 10.1585 10.4834 10.4834 11.0847 11.0847 11.2916 11.2916 11.4819 11.4819 11.5293 11.5293 14.5467 14.5467 14.6499 14.6499 15.2230 15.2230 16.9364 16.9364 17.6327 17.6327 17.9181 17.9181 k = 0.3042 0.6279 0.3921 ( 3847 PWs) bands (ev): -64.9444 -64.9444 -64.9336 -64.9336 -35.5703 -35.5703 -35.5391 -35.5391 -31.7476 -31.7476 -31.6802 -31.6802 -31.6058 -31.6058 -31.5955 -31.5955 -26.6913 -26.6913 -8.0189 -8.0189 -7.6674 -7.6674 -7.6084 -7.6084 4.6148 4.6148 5.4337 5.4337 8.7087 8.7087 9.2940 9.2940 9.4476 9.4476 9.5485 9.5485 9.8854 9.8854 10.2071 10.2071 10.4925 10.4925 11.0643 11.0643 11.2484 11.2484 11.4148 11.4148 11.4985 11.4985 14.5464 14.5464 14.6007 14.6007 15.1157 15.1157 16.9961 16.9961 17.5585 17.5585 17.9992 17.9992 k = 0.2979 0.6389 0.4048 ( 3843 PWs) bands (ev): -64.9438 -64.9438 -64.9342 -64.9342 -35.5686 -35.5686 -35.5409 -35.5409 -31.7439 -31.7439 -31.6841 -31.6841 -31.6052 -31.6052 -31.5961 -31.5961 -26.6912 -26.6912 -8.0195 -8.0195 -7.6683 -7.6683 -7.6080 -7.6080 4.6122 4.6122 5.4828 5.4828 8.7179 8.7179 9.2682 9.2682 9.4834 9.4834 9.5852 9.5852 9.8442 9.8442 10.2572 10.2572 10.4985 10.4985 11.0428 11.0428 11.2098 11.2098 11.3492 11.3492 11.4728 11.4728 14.5199 14.5199 14.5798 14.5798 15.0092 15.0092 17.0586 17.0586 17.4824 17.4824 18.0794 18.0794 k = 0.2915 0.6499 0.4174 ( 3825 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5668 -35.5668 -35.5427 -35.5427 -31.7401 -31.7401 -31.6880 -31.6880 -31.6046 -31.6046 -31.5967 -31.5967 -26.6912 -26.6912 -8.0200 -8.0200 -7.6691 -7.6691 -7.6077 -7.6077 4.6067 4.6067 5.5312 5.5312 8.7183 8.7183 9.2511 9.2511 9.5222 9.5222 9.6237 9.6237 9.8029 9.8029 10.3074 10.3074 10.5017 10.5017 11.0197 11.0197 11.1771 11.1771 11.2859 11.2859 11.4526 11.4526 14.4722 14.4722 14.5826 14.5826 14.9037 14.9037 17.1230 17.1230 17.4052 17.4052 18.1580 18.1580 k = 0.2915 0.6499 0.4174 ( 3825 PWs) bands (ev): -64.9432 -64.9432 -64.9348 -64.9348 -35.5668 -35.5668 -35.5427 -35.5427 -31.7401 -31.7401 -31.6880 -31.6880 -31.6046 -31.6046 -31.5967 -31.5967 -26.6912 -26.6912 -8.0200 -8.0200 -7.6691 -7.6691 -7.6077 -7.6077 4.6067 4.6067 5.5312 5.5312 8.7183 8.7183 9.2511 9.2511 9.5222 9.5222 9.6237 9.6237 9.8029 9.8029 10.3074 10.3074 10.5017 10.5017 11.0197 11.0197 11.1771 11.1771 11.2859 11.2859 11.4526 11.4526 14.4722 14.4722 14.5826 14.5826 14.9037 14.9037 17.1230 17.1230 17.4052 17.4052 18.1580 18.1580 k = 0.2744 0.6456 0.4223 ( 3828 PWs) bands (ev): -64.9429 -64.9429 -64.9350 -64.9350 -35.5661 -35.5661 -35.5434 -35.5434 -31.7386 -31.7386 -31.6895 -31.6895 -31.6044 -31.6044 -31.5969 -31.5969 -26.6911 -26.6911 -8.0202 -8.0202 -7.6694 -7.6694 -7.6076 -7.6076 4.6029 4.6029 5.5506 5.5506 8.7172 8.7172 9.2440 9.2440 9.5394 9.5394 9.6382 9.6382 9.7890 9.7890 10.3265 10.3265 10.5009 10.5009 11.0109 11.0109 11.1664 11.1664 11.2621 11.2621 11.4477 11.4477 14.4223 14.4223 14.5843 14.5843 14.8960 14.8960 17.1430 17.1430 17.3778 17.3778 18.1856 18.1856 k = 0.2572 0.6414 0.4272 ( 3834 PWs) bands (ev): -64.9427 -64.9427 -64.9353 -64.9353 -35.5654 -35.5654 -35.5441 -35.5441 -31.7371 -31.7371 -31.6910 -31.6910 -31.6042 -31.6042 -31.5972 -31.5972 -26.6911 -26.6911 -8.0204 -8.0204 -7.6696 -7.6696 -7.6075 -7.6075 4.5973 4.5973 5.5714 5.5714 8.7168 8.7168 9.2342 9.2342 9.5583 9.5583 9.6507 9.6507 9.7801 9.7801 10.3450 10.3450 10.4974 10.4974 11.0027 11.0027 11.1573 11.1573 11.2388 11.2388 11.4470 11.4470 14.3254 14.3254 14.5863 14.5863 14.9381 14.9381 17.1530 17.1530 17.3557 17.3557 18.2092 18.2092 k = 0.2401 0.6371 0.4321 ( 3834 PWs) bands (ev): -64.9425 -64.9425 -64.9355 -64.9355 -35.5647 -35.5647 -35.5448 -35.5448 -31.7356 -31.7356 -31.6925 -31.6925 -31.6040 -31.6040 -31.5974 -31.5974 -26.6911 -26.6911 -8.0206 -8.0206 -7.6699 -7.6699 -7.6074 -7.6074 4.5904 4.5904 5.5929 5.5929 8.7174 8.7174 9.2227 9.2227 9.5765 9.5765 9.6609 9.6609 9.7776 9.7776 10.3619 10.3619 10.4922 10.4922 10.9944 10.9944 11.1496 11.1496 11.2161 11.2161 11.4513 11.4513 14.2070 14.2070 14.5886 14.5886 15.0049 15.0049 17.1531 17.1531 17.3388 17.3388 18.2292 18.2292 k = 0.2229 0.6329 0.4370 ( 3836 PWs) bands (ev): -64.9422 -64.9422 -64.9358 -64.9358 -35.5640 -35.5640 -35.5455 -35.5455 -31.7341 -31.7341 -31.6941 -31.6941 -31.6037 -31.6037 -31.5977 -31.5977 -26.6911 -26.6911 -8.0207 -8.0207 -7.6701 -7.6701 -7.6073 -7.6073 4.5825 4.5825 5.6147 5.6147 8.7188 8.7188 9.2107 9.2107 9.5906 9.5906 9.6706 9.6706 9.7820 9.7820 10.3757 10.3757 10.4872 10.4872 10.9854 10.9854 11.1429 11.1429 11.1944 11.1944 11.4609 11.4609 14.0812 14.0812 14.5908 14.5908 15.0831 15.0831 17.1438 17.1438 17.3270 17.3270 18.2464 18.2464 k = 0.2058 0.6287 0.4419 ( 3838 PWs) bands (ev): -64.9420 -64.9420 -64.9360 -64.9360 -35.5633 -35.5633 -35.5462 -35.5462 -31.7326 -31.7326 -31.6956 -31.6956 -31.6035 -31.6035 -31.5979 -31.5979 -26.6911 -26.6911 -8.0209 -8.0209 -7.6703 -7.6703 -7.6071 -7.6071 4.5740 4.5740 5.6362 5.6362 8.7212 8.7212 9.1986 9.1986 9.5973 9.5973 9.6832 9.6832 9.7924 9.7924 10.3831 10.3831 10.4858 10.4858 10.9750 10.9750 11.1367 11.1367 11.1740 11.1740 11.4762 11.4762 13.9538 13.9538 14.5926 14.5926 15.1672 15.1672 17.1253 17.1253 17.3203 17.3203 18.2606 18.2606 k = 0.1886 0.6244 0.4468 ( 3840 PWs) bands (ev): -64.9417 -64.9417 -64.9363 -64.9363 -35.5626 -35.5626 -35.5469 -35.5469 -31.7311 -31.7311 -31.6972 -31.6972 -31.6033 -31.6033 -31.5981 -31.5981 -26.6911 -26.6911 -8.0210 -8.0210 -7.6705 -7.6705 -7.6070 -7.6070 4.5653 4.5653 5.6571 5.6571 8.7244 8.7244 9.1869 9.1869 9.5967 9.5967 9.6997 9.6997 9.8071 9.8071 10.3815 10.3815 10.4912 10.4912 10.9630 10.9630 11.1306 11.1306 11.1551 11.1551 11.4972 11.4972 13.8278 13.8278 14.5939 14.5939 15.2549 15.2549 17.0981 17.0981 17.3190 17.3190 18.2716 18.2716 k = 0.1715 0.6202 0.4517 ( 3843 PWs) bands (ev): -64.9415 -64.9415 -64.9365 -64.9365 -35.5619 -35.5619 -35.5476 -35.5476 -31.7296 -31.7296 -31.6987 -31.6987 -31.6031 -31.6031 -31.5984 -31.5984 -26.6911 -26.6911 -8.0212 -8.0212 -7.6707 -7.6707 -7.6069 -7.6069 4.5566 4.5566 5.6771 5.6771 8.7284 8.7284 9.1757 9.1757 9.5913 9.5913 9.7184 9.7184 9.8249 9.8249 10.3709 10.3709 10.5038 10.5038 10.9492 10.9492 11.1238 11.1238 11.1384 11.1384 11.5237 11.5237 13.7050 13.7050 14.5949 14.5949 15.3446 15.3446 17.0625 17.0625 17.3231 17.3231 18.2765 18.2765 k = 0.1543 0.6160 0.4566 ( 3840 PWs) bands (ev): -64.9413 -64.9413 -64.9368 -64.9368 -35.5612 -35.5612 -35.5483 -35.5483 -31.7281 -31.7281 -31.7002 -31.7002 -31.6028 -31.6028 -31.5986 -31.5986 -26.6911 -26.6911 -8.0213 -8.0213 -7.6709 -7.6709 -7.6068 -7.6068 4.5481 4.5481 5.6958 5.6958 8.7330 8.7330 9.1653 9.1653 9.5837 9.5837 9.7373 9.7373 9.8450 9.8450 10.3542 10.3542 10.5212 10.5212 10.9337 10.9337 11.1155 11.1155 11.1250 11.1250 11.5551 11.5551 13.5866 13.5866 14.5953 14.5953 15.4356 15.4356 17.0194 17.0194 17.3327 17.3327 18.2242 18.2242 k = 0.1372 0.6117 0.4615 ( 3840 PWs) bands (ev): -64.9410 -64.9410 -64.9370 -64.9370 -35.5605 -35.5605 -35.5490 -35.5490 -31.7265 -31.7265 -31.7018 -31.7018 -31.6026 -31.6026 -31.5989 -31.5989 -26.6911 -26.6911 -8.0214 -8.0214 -7.6710 -7.6710 -7.6067 -7.6067 4.5401 4.5401 5.7130 5.7130 8.7381 8.7381 9.1556 9.1556 9.5752 9.5752 9.7551 9.7551 9.8669 9.8669 10.3337 10.3337 10.5414 10.5414 10.9164 10.9164 11.1049 11.1049 11.1155 11.1155 11.5903 11.5903 13.4736 13.4736 14.5954 14.5954 15.5271 15.5271 16.9696 16.9696 17.3476 17.3476 18.1543 18.1543 k = 0.1200 0.6075 0.4664 ( 3844 PWs) bands (ev): -64.9408 -64.9408 -64.9373 -64.9373 -35.5598 -35.5598 -35.5497 -35.5497 -31.7250 -31.7250 -31.7033 -31.7033 -31.6024 -31.6024 -31.5991 -31.5991 -26.6911 -26.6911 -8.0215 -8.0215 -7.6712 -7.6712 -7.6066 -7.6066 4.5327 4.5327 5.7286 5.7286 8.7434 8.7434 9.1468 9.1468 9.5667 9.5667 9.7711 9.7711 9.8901 9.8901 10.3111 10.3111 10.5632 10.5632 10.8976 10.8976 11.0945 11.0945 11.1078 11.1078 11.6283 11.6283 13.3671 13.3671 14.5952 14.5952 15.6183 15.6183 16.9142 16.9142 17.3677 17.3677 18.0848 18.0848 k = 0.1029 0.6032 0.4712 ( 3846 PWs) bands (ev): -64.9405 -64.9405 -64.9375 -64.9375 -35.5590 -35.5590 -35.5505 -35.5505 -31.7235 -31.7235 -31.7049 -31.7049 -31.6021 -31.6021 -31.5993 -31.5993 -26.6911 -26.6911 -8.0216 -8.0216 -7.6713 -7.6713 -7.6065 -7.6065 4.5261 4.5261 5.7423 5.7423 8.7488 8.7488 9.1390 9.1390 9.5588 9.5588 9.7850 9.7850 9.9142 9.9142 10.2873 10.2873 10.5859 10.5859 10.8775 10.8775 11.0857 11.0857 11.1007 11.1007 11.6678 11.6678 13.2685 13.2685 14.5948 14.5948 15.7086 15.7086 16.8542 16.8542 17.3926 17.3926 18.0168 18.0168 k = 0.0857 0.5990 0.4761 ( 3851 PWs) bands (ev): -64.9403 -64.9403 -64.9378 -64.9378 -35.5583 -35.5583 -35.5512 -35.5512 -31.7219 -31.7219 -31.7064 -31.7064 -31.6019 -31.6019 -31.5996 -31.5996 -26.6911 -26.6911 -8.0216 -8.0216 -7.6714 -7.6714 -7.6065 -7.6065 4.5203 4.5203 5.7541 5.7541 8.7540 8.7540 9.1322 9.1322 9.5518 9.5518 9.7966 9.7966 9.9386 9.9386 10.2631 10.2631 10.6092 10.6092 10.8564 10.8564 11.0787 11.0787 11.0939 11.0939 11.7073 11.7073 13.1792 13.1792 14.5942 14.5942 15.7969 15.7969 16.7910 16.7910 17.4220 17.4220 17.9508 17.9508 k = 0.0686 0.5948 0.4810 ( 3850 PWs) bands (ev): -64.9400 -64.9400 -64.9380 -64.9380 -35.5576 -35.5576 -35.5519 -35.5519 -31.7204 -31.7204 -31.7080 -31.7080 -31.6017 -31.6017 -31.5998 -31.5998 -26.6911 -26.6911 -8.0217 -8.0217 -7.6715 -7.6715 -7.6064 -7.6064 4.5155 4.5155 5.7638 5.7638 8.7587 8.7587 9.1265 9.1265 9.5459 9.5459 9.8061 9.8061 9.9626 9.9626 10.2393 10.2393 10.6326 10.6326 10.8346 10.8346 11.0736 11.0736 11.0877 11.0877 11.7447 11.7447 13.1011 13.1011 14.5936 14.5936 15.8815 15.8815 16.7266 16.7266 17.4556 17.4556 17.8873 17.8873 k = 0.0514 0.5905 0.4859 ( 3850 PWs) bands (ev): -64.9398 -64.9398 -64.9383 -64.9383 -35.5569 -35.5569 -35.5526 -35.5526 -31.7189 -31.7189 -31.7096 -31.7096 -31.6014 -31.6014 -31.6000 -31.6000 -26.6911 -26.6911 -8.0217 -8.0217 -7.6715 -7.6715 -7.6064 -7.6064 4.5116 4.5116 5.7715 5.7715 8.7626 8.7626 9.1220 9.1220 9.5412 9.5412 9.8134 9.8134 9.9852 9.9852 10.2168 10.2168 10.6559 10.6559 10.8124 10.8124 11.0703 11.0703 11.0822 11.0822 11.7779 11.7779 13.0363 13.0363 14.5931 14.5931 15.9599 15.9599 16.6637 16.6637 17.4925 17.4925 17.8271 17.8271 k = 0.0343 0.5863 0.4908 ( 3855 PWs) bands (ev): -64.9395 -64.9395 -64.9385 -64.9385 -35.5562 -35.5562 -35.5533 -35.5533 -31.7173 -31.7173 -31.7111 -31.7111 -31.6012 -31.6012 -31.6003 -31.6003 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.5088 4.5088 5.7770 5.7770 8.7656 8.7656 9.1187 9.1187 9.5378 9.5378 9.8186 9.8186 10.0048 10.0048 10.1973 10.1973 10.6784 10.6784 10.7907 10.7907 11.0685 11.0685 11.0776 11.0776 11.8043 11.8043 12.9874 12.9874 14.5926 14.5926 16.0275 16.0275 16.6071 16.6071 17.5314 17.5314 17.7716 17.7716 k = 0.0171 0.5820 0.4957 ( 3863 PWs) bands (ev): -64.9393 -64.9393 -64.9388 -64.9388 -35.5555 -35.5555 -35.5540 -35.5540 -31.7158 -31.7158 -31.7127 -31.7127 -31.6010 -31.6010 -31.6005 -31.6005 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.5072 4.5072 5.7803 5.7803 8.7675 8.7675 9.1167 9.1167 9.5356 9.5356 9.8216 9.8216 10.0189 10.0189 10.1833 10.1833 10.6980 10.6980 10.7715 10.7715 11.0680 11.0680 11.0742 11.0742 11.8213 11.8213 12.9567 12.9567 14.5923 14.5923 16.0760 16.0760 16.5650 16.5650 17.5678 17.5678 17.7251 17.7251 k = 0.0000 0.5778 0.5006 ( 3864 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7142 -31.7142 -31.7142 -31.7142 -31.6008 -31.6008 -31.6007 -31.6007 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.5066 4.5066 5.7814 5.7814 8.7682 8.7682 9.1160 9.1160 9.5349 9.5349 9.8227 9.8227 10.0242 10.0242 10.1780 10.1780 10.7075 10.7075 10.7621 10.7621 11.0681 11.0681 11.0728 11.0728 11.8272 11.8272 12.9462 12.9462 14.5922 14.5922 16.0943 16.0943 16.5489 16.5489 17.5864 17.5864 17.7033 17.7033 k = 0.0000 0.5778 0.5006 ( 3864 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7142 -31.7142 -31.7142 -31.7142 -31.6008 -31.6008 -31.6007 -31.6007 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.5066 4.5066 5.7814 5.7814 8.7682 8.7682 9.1160 9.1160 9.5349 9.5349 9.8227 9.8227 10.0242 10.0242 10.1780 10.1780 10.7075 10.7075 10.7621 10.7621 11.0681 11.0681 11.0728 11.0728 11.8272 11.8272 12.9462 12.9462 14.5922 14.5922 16.0943 16.0943 16.5489 16.5489 17.5864 17.5864 17.7033 17.7033 k = 0.0064 0.5667 0.5134 ( 3862 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7144 -31.7144 -31.7142 -31.7142 -31.6007 -31.6007 -31.6006 -31.6006 -26.6911 -26.6911 -8.0218 -8.0218 -7.6716 -7.6716 -7.6063 -7.6063 4.5070 4.5070 5.7824 5.7824 8.7671 8.7671 9.1146 9.1146 9.5330 9.5330 9.8237 9.8237 10.0269 10.0269 10.1797 10.1797 10.7027 10.7027 10.7602 10.7602 11.0669 11.0669 11.0832 11.0832 11.8259 11.8259 12.9463 12.9463 14.5880 14.5880 16.0930 16.0930 16.5481 16.5481 17.5646 17.5646 17.7071 17.7071 k = 0.0128 0.5556 0.5263 ( 3856 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7146 -31.7146 -31.7144 -31.7144 -31.6006 -31.6006 -31.6004 -31.6004 -26.6910 -26.6910 -8.0219 -8.0219 -7.6717 -7.6717 -7.6064 -7.6064 4.5083 4.5083 5.7854 5.7854 8.7640 8.7640 9.1103 9.1103 9.5276 9.5276 9.8265 9.8265 10.0346 10.0346 10.1847 10.1847 10.6898 10.6898 10.7543 10.7543 11.0736 11.0736 11.1031 11.1031 11.8218 11.8218 12.9464 12.9464 14.5754 14.5754 16.0889 16.0889 16.5454 16.5454 17.5060 17.5060 17.7183 17.7183 k = 0.0192 0.5444 0.5391 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7150 -31.7150 -31.7146 -31.7146 -31.6003 -31.6003 -31.5999 -31.5999 -26.6910 -26.6910 -8.0219 -8.0219 -7.6718 -7.6718 -7.6066 -7.6066 4.5105 4.5105 5.7904 5.7904 8.7589 8.7589 9.1030 9.1030 9.5202 9.5202 9.8303 9.8303 10.0472 10.0472 10.1926 10.1926 10.6716 10.6716 10.7445 10.7445 11.0890 11.0890 11.1286 11.1286 11.8150 11.8150 12.9466 12.9466 14.5548 14.5548 16.0817 16.0817 16.5402 16.5402 17.4236 17.4236 17.7364 17.7364 k = 0.0256 0.5333 0.5519 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5548 -35.5548 -35.5548 -35.5548 -31.7156 -31.7156 -31.7151 -31.7151 -31.5998 -31.5998 -31.5994 -31.5994 -26.6910 -26.6910 -8.0220 -8.0220 -7.6720 -7.6720 -7.6068 -7.6068 4.5135 4.5135 5.7974 5.7974 8.7517 8.7517 9.0921 9.0921 9.5124 9.5124 9.8345 9.8345 10.0639 10.0639 10.2027 10.2027 10.6510 10.6510 10.7322 10.7322 11.1113 11.1113 11.1580 11.1580 11.8057 11.8057 12.9468 12.9468 14.5268 14.5268 16.0711 16.0711 16.5314 16.5314 17.3292 17.3292 17.7612 17.7612 k = 0.0321 0.5222 0.5648 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5549 -35.5549 -35.5548 -35.5548 -31.7162 -31.7162 -31.7156 -31.7156 -31.5993 -31.5993 -31.5988 -31.5988 -26.6909 -26.6909 -8.0222 -8.0222 -7.6722 -7.6722 -7.6071 -7.6071 4.5173 4.5173 5.8063 5.8063 8.7427 8.7427 9.0775 9.0775 9.5058 9.5058 9.8387 9.8387 10.0837 10.0837 10.2143 10.2143 10.6299 10.6299 10.7192 10.7192 11.1382 11.1382 11.1898 11.1898 11.7941 11.7941 12.9470 12.9470 14.4921 14.4921 16.0563 16.0563 16.5168 16.5168 17.2314 17.2314 17.7922 17.7922 k = 0.0385 0.5111 0.5776 ( 3848 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5549 -35.5549 -35.5549 -35.5549 -31.7170 -31.7170 -31.7163 -31.7163 -31.5986 -31.5986 -31.5980 -31.5980 -26.6909 -26.6909 -8.0224 -8.0224 -7.6724 -7.6724 -7.6074 -7.6074 4.5219 4.5219 5.8172 5.8172 8.7318 8.7318 9.0590 9.0590 9.5018 9.5018 9.8431 9.8431 10.1050 10.1050 10.2264 10.2264 10.6101 10.6101 10.7075 10.7075 11.1681 11.1681 11.2232 11.2232 11.7805 11.7805 12.9471 12.9471 14.4514 14.4514 16.0370 16.0370 16.4936 16.4936 17.1376 17.1376 17.8287 17.8287 k = 0.0449 0.5000 0.5904 ( 3842 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5550 -35.5550 -35.5549 -35.5549 -31.7178 -31.7178 -31.7170 -31.7170 -31.5978 -31.5978 -31.5971 -31.5971 -26.6908 -26.6908 -8.0226 -8.0226 -7.6727 -7.6727 -7.6077 -7.6077 4.5273 4.5273 5.8299 5.8299 8.7192 8.7192 9.0366 9.0366 9.5013 9.5013 9.8477 9.8477 10.1263 10.1263 10.2382 10.2382 10.5932 10.5932 10.6986 10.6986 11.1993 11.1993 11.2572 11.2572 11.7653 11.7653 12.9472 12.9472 14.4056 14.4056 16.0126 16.0126 16.4578 16.4578 17.0542 17.0542 17.8700 17.8700 k = 0.0513 0.4888 0.6033 ( 3842 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5551 -35.5551 -35.5549 -35.5549 -31.7188 -31.7188 -31.7179 -31.7179 -31.5969 -31.5969 -31.5961 -31.5961 -26.6908 -26.6908 -8.0228 -8.0228 -7.6731 -7.6731 -7.6081 -7.6081 4.5335 4.5335 5.8444 5.8444 8.7050 8.7050 9.0105 9.0105 9.5047 9.5047 9.8529 9.8529 10.1459 10.1459 10.2486 10.2486 10.5807 10.5807 10.6938 10.6938 11.2306 11.2306 11.2913 11.2913 11.7490 11.7490 12.9472 12.9472 14.3554 14.3554 15.9829 15.9829 16.4059 16.4059 16.9868 16.9868 17.9151 17.9151 k = 0.0577 0.4777 0.6161 ( 3842 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5551 -35.5551 -35.5550 -35.5550 -31.7199 -31.7199 -31.7189 -31.7189 -31.5959 -31.5959 -31.5950 -31.5950 -26.6907 -26.6907 -8.0231 -8.0231 -7.6735 -7.6735 -7.6086 -7.6086 4.5404 4.5404 5.8607 5.8607 8.6893 8.6893 8.9812 8.9812 9.5121 9.5121 9.8589 9.8589 10.1623 10.1623 10.2565 10.2565 10.5745 10.5745 10.6939 10.6939 11.2605 11.2605 11.3251 11.3251 11.7325 11.7325 12.9469 12.9469 14.3017 14.3017 15.9477 15.9477 16.3364 16.3364 16.9380 16.9380 17.9629 17.9629 k = 0.0641 0.4666 0.6290 ( 3838 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5552 -35.5552 -35.5551 -35.5551 -31.7210 -31.7210 -31.7199 -31.7199 -31.5948 -31.5948 -31.5939 -31.5939 -26.6906 -26.6906 -8.0234 -8.0234 -7.6740 -7.6740 -7.6090 -7.6090 4.5479 4.5479 5.8786 5.8786 8.6723 8.6723 8.9492 8.9492 9.5234 9.5234 9.8658 9.8658 10.1744 10.1744 10.2609 10.2609 10.5759 10.5759 10.6995 10.6995 11.2878 11.2878 11.3580 11.3580 11.7166 11.7166 12.9465 12.9465 14.2451 14.2451 15.9068 15.9068 16.2515 16.2515 16.9067 16.9067 18.0122 18.0122 k = 0.0705 0.4555 0.6418 ( 3846 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5553 -35.5553 -35.5551 -35.5551 -31.7222 -31.7222 -31.7211 -31.7211 -31.5937 -31.5937 -31.5927 -31.5927 -26.6905 -26.6905 -8.0237 -8.0237 -7.6745 -7.6745 -7.6095 -7.6095 4.5561 4.5561 5.8981 5.8981 8.6540 8.6540 8.9151 8.9151 9.5384 9.5384 9.8737 9.8737 10.1820 10.1820 10.2612 10.2612 10.5856 10.5856 10.7103 10.7103 11.3108 11.3108 11.3899 11.3899 11.7027 11.7027 12.9456 12.9456 14.1862 14.1862 15.8605 15.8605 16.1553 16.1553 16.8894 16.8894 18.0618 18.0618 k = 0.0769 0.4444 0.6546 ( 3844 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5554 -35.5554 -35.5552 -35.5552 -31.7234 -31.7234 -31.7223 -31.7223 -31.5924 -31.5924 -31.5914 -31.5914 -26.6904 -26.6904 -8.0240 -8.0240 -7.6750 -7.6750 -7.6100 -7.6100 4.5648 4.5648 5.9192 5.9192 8.6348 8.6348 8.8793 8.8793 9.5568 9.5568 9.8827 9.8827 10.1856 10.1856 10.2575 10.2575 10.6034 10.6034 10.7262 10.7262 11.3277 11.3277 11.4205 11.4205 11.6923 11.6923 12.9444 12.9444 14.1256 14.1256 15.8090 15.8090 16.0524 16.0524 16.8825 16.8825 18.1107 18.1107 k = 0.0833 0.4332 0.6675 ( 3846 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5554 -35.5554 -35.5553 -35.5553 -31.7247 -31.7247 -31.7235 -31.7235 -31.5912 -31.5912 -31.5901 -31.5901 -26.6903 -26.6903 -8.0244 -8.0244 -7.6757 -7.6757 -7.6104 -7.6104 4.5741 4.5741 5.9416 5.9416 8.6147 8.6147 8.8425 8.8425 9.5784 9.5784 9.8926 9.8926 10.1858 10.1858 10.2507 10.2507 10.6282 10.6282 10.7464 10.7464 11.3368 11.3368 11.4496 11.4496 11.6869 11.6869 12.9427 12.9427 14.0638 14.0638 15.7524 15.7524 15.9464 15.9464 16.8827 16.8827 18.1581 18.1581 k = 0.0897 0.4221 0.6803 ( 3842 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5555 -35.5555 -35.5554 -35.5554 -31.7260 -31.7260 -31.7248 -31.7248 -31.5899 -31.5899 -31.5888 -31.5888 -26.6902 -26.6902 -8.0248 -8.0248 -7.6763 -7.6763 -7.6109 -7.6109 4.5839 4.5839 5.9654 5.9654 8.5938 8.5938 8.8049 8.8049 9.6030 9.6030 9.9033 9.9033 10.1838 10.1838 10.2419 10.2419 10.6585 10.6585 10.7700 10.7700 11.3372 11.3372 11.4771 11.4771 11.6876 11.6876 12.9405 12.9405 14.0011 14.0011 15.6912 15.6912 15.8401 15.8401 16.8880 16.8880 18.2034 18.2034 k = 0.0962 0.4110 0.6931 ( 3848 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5556 -35.5556 -35.5555 -35.5555 -31.7273 -31.7273 -31.7261 -31.7261 -31.5885 -31.5885 -31.5874 -31.5874 -26.6901 -26.6901 -8.0253 -8.0253 -7.6770 -7.6770 -7.6113 -7.6113 4.5940 4.5940 5.9903 5.9903 8.5724 8.5724 8.7669 8.7669 9.6302 9.6302 9.9147 9.9147 10.1803 10.1803 10.2321 10.2321 10.6928 10.6928 10.7962 10.7962 11.3289 11.3289 11.5027 11.5027 11.6940 11.6940 12.9375 12.9375 13.9379 13.9379 15.6252 15.6252 15.7358 15.7358 16.8969 16.8969 18.2464 18.2464 k = 0.1026 0.3999 0.7060 ( 3844 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5557 -35.5557 -35.5555 -35.5555 -31.7287 -31.7287 -31.7274 -31.7274 -31.5872 -31.5872 -31.5861 -31.5861 -26.6899 -26.6899 -8.0257 -8.0257 -7.6778 -7.6778 -7.6118 -7.6118 4.6046 4.6046 6.0163 6.0163 8.5505 8.5505 8.7289 8.7289 9.6599 9.6599 9.9266 9.9266 10.1762 10.1762 10.2225 10.2225 10.7297 10.7297 10.8241 10.8241 11.3131 11.3131 11.5266 11.5266 11.7053 11.7053 12.9339 12.9339 13.8745 13.8745 15.5543 15.5543 15.6359 15.6359 16.9081 16.9081 18.2874 18.2874 k = 0.1090 0.3888 0.7188 ( 3840 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5558 -35.5558 -35.5556 -35.5556 -31.7300 -31.7300 -31.7287 -31.7287 -31.5858 -31.5858 -31.5847 -31.5847 -26.6898 -26.6898 -8.0262 -8.0262 -7.6786 -7.6786 -7.6121 -7.6121 4.6154 4.6154 6.0432 6.0432 8.5283 8.5283 8.6912 8.6912 9.6919 9.6919 9.9388 9.9388 10.1721 10.1721 10.2141 10.2141 10.7681 10.7681 10.8528 10.8528 11.2916 11.2916 11.5485 11.5485 11.7199 11.7199 12.9295 12.9295 13.8110 13.8110 15.4774 15.4774 15.5430 15.5430 16.9210 16.9210 18.3266 18.3266 k = 0.1154 0.3776 0.7316 ( 3844 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5559 -35.5559 -35.5557 -35.5557 -31.7313 -31.7313 -31.7300 -31.7300 -31.5845 -31.5845 -31.5833 -31.5833 -26.6897 -26.6897 -8.0267 -8.0267 -7.6794 -7.6794 -7.6125 -7.6125 4.6264 4.6264 6.0709 6.0709 8.5060 8.5060 8.6538 8.6538 9.7259 9.7259 9.9509 9.9509 10.1682 10.1682 10.2075 10.2075 10.8070 10.8070 10.8815 10.8815 11.2662 11.2662 11.5686 11.5686 11.7362 11.7362 12.9242 12.9242 13.7476 13.7476 15.3947 15.3947 15.4584 15.4584 16.9347 16.9347 18.3647 18.3647 k = 0.1218 0.3665 0.7445 ( 3854 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5560 -35.5560 -35.5558 -35.5558 -31.7327 -31.7327 -31.7314 -31.7314 -31.5831 -31.5831 -31.5820 -31.5820 -26.6896 -26.6896 -8.0273 -8.0273 -7.6803 -7.6803 -7.6129 -7.6129 4.6376 4.6376 6.0992 6.0992 8.4836 8.4836 8.6171 8.6171 9.7619 9.7619 9.9629 9.9629 10.1645 10.1645 10.2037 10.2037 10.8452 10.8452 10.9093 10.9093 11.2390 11.2390 11.5869 11.5869 11.7531 11.7531 12.9179 12.9179 13.6845 13.6845 15.3095 15.3095 15.3801 15.3801 16.9489 16.9489 18.4021 18.4021 k = 0.1282 0.3554 0.7573 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5561 -35.5561 -35.5559 -35.5559 -31.7340 -31.7340 -31.7327 -31.7327 -31.5818 -31.5818 -31.5807 -31.5807 -26.6894 -26.6894 -8.0278 -8.0278 -7.6812 -7.6812 -7.6132 -7.6132 4.6489 4.6489 6.1279 6.1279 8.4614 8.4614 8.5813 8.5813 9.7995 9.7995 9.9747 9.9747 10.1613 10.1613 10.2031 10.2031 10.8811 10.8811 10.9352 10.9352 11.2121 11.2121 11.6040 11.6040 11.7696 11.7696 12.9107 12.9107 13.6217 13.6217 15.2257 15.2257 15.3056 15.3056 16.9629 16.9629 18.4393 18.4393 k = 0.1346 0.3443 0.7702 ( 3846 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5562 -35.5562 -35.5560 -35.5560 -31.7352 -31.7352 -31.7339 -31.7339 -31.5805 -31.5805 -31.5793 -31.5793 -26.6893 -26.6893 -8.0283 -8.0283 -7.6821 -7.6821 -7.6134 -7.6134 4.6602 4.6602 6.1570 6.1570 8.4394 8.4394 8.5464 8.5464 9.8385 9.8385 9.9862 9.9862 10.1588 10.1588 10.2061 10.2061 10.9122 10.9122 10.9582 10.9582 11.1885 11.1885 11.6202 11.6202 11.7852 11.7852 12.9023 12.9023 13.5593 13.5593 15.1454 15.1454 15.2336 15.2336 16.9763 16.9763 18.4766 18.4766 k = 0.1410 0.3332 0.7830 ( 3850 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5563 -35.5563 -35.5561 -35.5561 -31.7365 -31.7365 -31.7352 -31.7352 -31.5792 -31.5792 -31.5781 -31.5781 -26.6892 -26.6892 -8.0289 -8.0289 -7.6830 -7.6830 -7.6137 -7.6137 4.6714 4.6714 6.1861 6.1861 8.4177 8.4177 8.5127 8.5127 9.8787 9.8787 9.9977 9.9977 10.1572 10.1572 10.2122 10.2122 10.9347 10.9347 10.9774 10.9774 11.1722 11.1722 11.6362 11.6362 11.7993 11.7993 12.8929 12.8929 13.4972 13.4972 15.0699 15.0699 15.1638 15.1638 16.9887 16.9887 18.5143 18.5143 k = 0.1474 0.3220 0.7958 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5564 -35.5564 -35.5562 -35.5562 -31.7377 -31.7377 -31.7364 -31.7364 -31.5780 -31.5780 -31.5769 -31.5769 -26.6891 -26.6891 -8.0294 -8.0294 -7.6839 -7.6839 -7.6139 -7.6139 4.6825 4.6825 6.2151 6.2151 8.3964 8.3964 8.4802 8.4802 9.9194 9.9194 10.0094 10.0094 10.1571 10.1571 10.2212 10.2212 10.9433 10.9433 10.9924 10.9924 11.1682 11.1682 11.6524 11.6524 11.8118 11.8118 12.8823 12.8823 13.4356 13.4356 14.9996 14.9996 15.0965 15.0965 16.9996 16.9996 18.5527 18.5527 k = 0.1538 0.3109 0.8087 ( 3848 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5565 -35.5565 -35.5563 -35.5563 -31.7388 -31.7388 -31.7376 -31.7376 -31.5768 -31.5768 -31.5757 -31.5757 -26.6889 -26.6889 -8.0300 -8.0300 -7.6848 -7.6848 -7.6141 -7.6141 4.6934 4.6934 6.2438 6.2438 8.3758 8.3758 8.4491 8.4491 9.9601 9.9601 10.0219 10.0219 10.1589 10.1589 10.2326 10.2326 10.9360 10.9360 11.0028 11.0028 11.1780 11.1780 11.6696 11.6696 11.8229 11.8229 12.8705 12.8705 13.3744 13.3744 14.9350 14.9350 15.0322 15.0322 17.0086 17.0086 18.5919 18.5919 k = 0.1603 0.2998 0.8215 ( 3840 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5566 -35.5566 -35.5564 -35.5564 -31.7399 -31.7399 -31.7387 -31.7387 -31.5756 -31.5756 -31.5745 -31.5745 -26.6888 -26.6888 -8.0305 -8.0305 -7.6856 -7.6856 -7.6142 -7.6142 4.7041 4.7041 6.2720 6.2720 8.3558 8.3558 8.4196 8.4196 9.9988 9.9988 10.0367 10.0367 10.1630 10.1630 10.2461 10.2461 10.9164 10.9164 11.0074 11.0074 11.1984 11.1984 11.6883 11.6883 11.8329 11.8329 12.8576 12.8576 13.3136 13.3136 14.8760 14.8760 14.9711 14.9711 17.0155 17.0155 18.6318 18.6318 k = 0.1667 0.2887 0.8343 ( 3846 PWs) bands (ev): -64.9390 -64.9390 -64.9390 -64.9390 -35.5567 -35.5567 -35.5565 -35.5565 -31.7409 -31.7409 -31.7397 -31.7397 -31.5745 -31.5745 -31.5735 -31.5735 -26.6887 -26.6887 -8.0310 -8.0310 -7.6865 -7.6865 -7.6143 -7.6143 4.7143 4.7143 6.2995 6.2995 8.3366 8.3366 8.3916 8.3916 10.0299 10.0299 10.0586 10.0586 10.1700 10.1700 10.2613 10.2613 10.8894 10.8894 11.0058 11.0058 11.2243 11.2243 11.7086 11.7086 11.8419 11.8419 12.8436 12.8436 13.2532 13.2532 14.8227 14.8227 14.9138 14.9138 17.0201 17.0201 18.6162 18.6162 k = 0.1731 0.2776 0.8472 ( 3842 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5568 -35.5568 -35.5566 -35.5566 -31.7419 -31.7419 -31.7407 -31.7407 -31.5735 -31.5735 -31.5725 -31.5725 -26.6886 -26.6886 -8.0316 -8.0316 -7.6873 -7.6873 -7.6144 -7.6144 4.7241 4.7241 6.3261 6.3261 8.3183 8.3183 8.3653 8.3653 10.0500 10.0500 10.0899 10.0899 10.1807 10.1807 10.2782 10.2782 10.8588 10.8588 10.9977 10.9977 11.2517 11.2517 11.7309 11.7309 11.8510 11.8510 12.8286 12.8286 13.1934 13.1934 14.7749 14.7749 14.8605 14.8605 17.0223 17.0223 18.5804 18.5804 k = 0.1795 0.2664 0.8600 ( 3842 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5568 -35.5568 -35.5567 -35.5567 -31.7428 -31.7428 -31.7417 -31.7417 -31.5726 -31.5726 -31.5715 -31.5715 -26.6885 -26.6885 -8.0321 -8.0321 -7.6881 -7.6881 -7.6145 -7.6145 4.7335 4.7335 6.3516 6.3516 8.3009 8.3009 8.3409 8.3409 10.0662 10.0662 10.1216 10.1216 10.1965 10.1965 10.2968 10.2968 10.8268 10.8268 10.9835 10.9835 11.2779 11.2779 11.7547 11.7547 11.8607 11.8607 12.8125 12.8125 13.1342 13.1342 14.7324 14.7324 14.8115 14.8115 17.0221 17.0221 18.5512 18.5512 k = 0.1859 0.2553 0.8728 ( 3842 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5569 -35.5569 -35.5568 -35.5568 -31.7436 -31.7436 -31.7426 -31.7426 -31.5717 -31.5717 -31.5707 -31.5707 -26.6884 -26.6884 -8.0325 -8.0325 -7.6889 -7.6889 -7.6146 -7.6146 4.7422 4.7422 6.3757 6.3757 8.2846 8.2846 8.3183 8.3183 10.0819 10.0819 10.1486 10.1486 10.2178 10.2178 10.3172 10.3172 10.7946 10.7946 10.9637 10.9637 11.3012 11.3012 11.7797 11.7797 11.8721 11.8721 12.7957 12.7957 13.0758 13.0758 14.6950 14.6950 14.7669 14.7669 17.0197 17.0197 18.5283 18.5283 k = 0.1923 0.2442 0.8857 ( 3842 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5570 -35.5570 -35.5568 -35.5568 -31.7444 -31.7444 -31.7434 -31.7434 -31.5709 -31.5709 -31.5699 -31.5699 -26.6883 -26.6883 -8.0330 -8.0330 -7.6896 -7.6896 -7.6146 -7.6146 4.7504 4.7504 6.3983 6.3983 8.2694 8.2694 8.2976 8.2976 10.0977 10.0977 10.1708 10.1708 10.2430 10.2430 10.3397 10.3397 10.7635 10.7635 10.9391 10.9391 11.3203 11.3203 11.8056 11.8056 11.8858 11.8858 12.7782 12.7782 13.0186 13.0186 14.6624 14.6624 14.7270 14.7270 17.0154 17.0154 18.5115 18.5115 k = 0.1987 0.2331 0.8985 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5570 -35.5570 -35.5569 -35.5569 -31.7451 -31.7451 -31.7441 -31.7441 -31.5701 -31.5701 -31.5691 -31.5691 -26.6882 -26.6882 -8.0334 -8.0334 -7.6902 -7.6902 -7.6146 -7.6146 4.7578 4.7578 6.4191 6.4191 8.2555 8.2555 8.2790 8.2790 10.1137 10.1137 10.1900 10.1900 10.2690 10.2690 10.3639 10.3639 10.7341 10.7341 10.9106 10.9106 11.3343 11.3343 11.8318 11.8318 11.9022 11.9022 12.7604 12.7604 12.9631 12.9631 14.6342 14.6342 14.6917 14.6917 17.0096 17.0096 18.4999 18.4999 k = 0.2051 0.2220 0.9113 ( 3848 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5571 -35.5571 -35.5570 -35.5570 -31.7457 -31.7457 -31.7447 -31.7447 -31.5695 -31.5695 -31.5685 -31.5685 -26.6882 -26.6882 -8.0338 -8.0338 -7.6908 -7.6908 -7.6147 -7.6147 4.7646 4.7646 6.4380 6.4380 8.2429 8.2429 8.2625 8.2625 10.1297 10.1297 10.2076 10.2076 10.2940 10.2940 10.3889 10.3889 10.7075 10.7075 10.8794 10.8794 11.3430 11.3430 11.8582 11.8582 11.9208 11.9208 12.7424 12.7424 12.9097 12.9097 14.6102 14.6102 14.6609 14.6609 17.0029 17.0029 18.4929 18.4929 k = 0.2115 0.2108 0.9242 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5571 -35.5571 -35.5570 -35.5570 -31.7462 -31.7462 -31.7453 -31.7453 -31.5689 -31.5689 -31.5679 -31.5679 -26.6881 -26.6881 -8.0341 -8.0341 -7.6913 -7.6913 -7.6147 -7.6147 4.7705 4.7705 6.4548 6.4548 8.2317 8.2317 8.2482 8.2482 10.1456 10.1456 10.2240 10.2240 10.3179 10.3179 10.4126 10.4126 10.6843 10.6843 10.8469 10.8469 11.3467 11.3467 11.8848 11.8848 11.9407 11.9407 12.7249 12.7249 12.8593 12.8593 14.5901 14.5901 14.6348 14.6348 16.9957 16.9957 18.4894 18.4894 k = 0.2179 0.1997 0.9370 ( 3838 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5571 -35.5571 -31.7467 -31.7467 -31.7458 -31.7458 -31.5684 -31.5684 -31.5675 -31.5675 -26.6881 -26.6881 -8.0344 -8.0344 -7.6917 -7.6917 -7.6147 -7.6147 4.7756 4.7756 6.4694 6.4694 8.2221 8.2221 8.2361 8.2361 10.1610 10.1610 10.2383 10.2383 10.3415 10.3415 10.4328 10.4328 10.6651 10.6651 10.8145 10.8145 11.3462 11.3462 11.9112 11.9112 11.9605 11.9605 12.7081 12.7081 12.8130 12.8130 14.5736 14.5736 14.6130 14.6130 16.9885 16.9885 18.4887 18.4887 k = 0.2244 0.1886 0.9499 ( 3842 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5571 -35.5571 -31.7471 -31.7471 -31.7462 -31.7462 -31.5680 -31.5680 -31.5671 -31.5671 -26.6880 -26.6880 -8.0346 -8.0346 -7.6921 -7.6921 -7.6147 -7.6147 4.7798 4.7798 6.4814 6.4814 8.2139 8.2139 8.2262 8.2262 10.1755 10.1755 10.2499 10.2499 10.3654 10.3654 10.4474 10.4474 10.6499 10.6499 10.7846 10.7846 11.3428 11.3428 11.9366 11.9366 11.9785 11.9785 12.6925 12.6925 12.7721 12.7721 14.5604 14.5604 14.5955 14.5955 16.9819 16.9819 18.4897 18.4897 k = 0.2308 0.1775 0.9627 ( 3848 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5571 -35.5571 -31.7474 -31.7474 -31.7465 -31.7465 -31.5677 -31.5677 -31.5668 -31.5668 -26.6880 -26.6880 -8.0348 -8.0348 -7.6924 -7.6924 -7.6147 -7.6147 4.7832 4.7832 6.4910 6.4910 8.2075 8.2075 8.2185 8.2185 10.1885 10.1885 10.2582 10.2582 10.3894 10.3894 10.4557 10.4557 10.6371 10.6371 10.7598 10.7598 11.3379 11.3379 11.9599 11.9599 11.9934 11.9934 12.6788 12.6788 12.7383 12.7383 14.5503 14.5503 14.5821 14.5821 16.9763 16.9763 18.4915 18.4915 k = 0.2372 0.1663 0.9755 ( 3852 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7476 -31.7476 -31.7467 -31.7467 -31.5675 -31.5675 -31.5665 -31.5665 -26.6879 -26.6879 -8.0349 -8.0349 -7.6926 -7.6926 -7.6147 -7.6147 4.7855 4.7855 6.4978 6.4978 8.2028 8.2028 8.2131 8.2131 10.1992 10.1992 10.2632 10.2632 10.4125 10.4125 10.4583 10.4583 10.6253 10.6253 10.7425 10.7425 11.3331 11.3331 11.9795 11.9795 12.0038 12.0038 12.6674 12.6674 12.7132 12.7132 14.5432 14.5432 14.5726 14.5726 16.9720 16.9720 18.4934 18.4934 k = 0.2436 0.1552 0.9884 ( 3852 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7870 4.7870 6.5020 6.5020 8.1999 8.1999 8.2099 8.2099 10.2065 10.2065 10.2656 10.2656 10.4321 10.4321 10.4562 10.4562 10.6151 10.6151 10.7333 10.7333 11.3296 11.3296 11.9936 11.9936 12.0090 12.0090 12.6594 12.6594 12.6982 12.6982 14.5390 14.5390 14.5670 14.5670 16.9694 16.9694 18.4948 18.4948 k = 0.2500 0.1441 1.0012 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7875 4.7875 6.5034 6.5034 8.1990 8.1990 8.2088 8.2088 10.2091 10.2091 10.2662 10.2662 10.4427 10.4427 10.4521 10.4521 10.6108 10.6108 10.7306 10.7306 11.3284 11.3284 11.9994 11.9994 12.0100 12.0100 12.6565 12.6565 12.6932 12.6932 14.5375 14.5375 14.5652 14.5652 16.9685 16.9685 18.4954 18.4954 k = 0.2500 0.1441 1.0012 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7875 4.7875 6.5034 6.5034 8.1990 8.1990 8.2088 8.2088 10.2091 10.2091 10.2662 10.2662 10.4427 10.4427 10.4521 10.4521 10.6108 10.6108 10.7306 10.7306 11.3284 11.3284 11.9994 11.9994 12.0100 12.0100 12.6565 12.6565 12.6932 12.6932 14.5375 14.5375 14.5652 14.5652 16.9685 16.9685 18.4954 18.4954 k = 0.2632 0.1517 0.9924 ( 3849 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7874 4.7874 6.5031 6.5031 8.1972 8.1972 8.2111 8.2111 10.2081 10.2081 10.2661 10.2661 10.4264 10.4264 10.4677 10.4677 10.6114 10.6114 10.7323 10.7323 11.3275 11.3275 11.9979 11.9979 12.0099 12.0099 12.6256 12.6256 12.7269 12.7269 14.5320 14.5320 14.5707 14.5707 16.9698 16.9698 18.4950 18.4950 k = 0.2763 0.1593 0.9837 ( 3851 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5571 -35.5571 -31.7478 -31.7478 -31.7468 -31.7468 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5019 6.5019 8.1932 8.1932 8.2168 8.2168 10.2050 10.2050 10.2660 10.2660 10.4085 10.4085 10.4829 10.4829 10.6128 10.6128 10.7382 10.7382 11.3248 11.3248 11.9945 11.9945 12.0089 12.0089 12.5838 12.5838 12.7768 12.7768 14.5208 14.5208 14.5820 14.5820 16.9737 16.9737 18.4942 18.4942 k = 0.2895 0.1669 0.9749 ( 3851 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5571 -35.5571 -31.7478 -31.7478 -31.7467 -31.7467 -31.5673 -31.5673 -31.5665 -31.5665 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7867 4.7867 6.4999 6.4999 8.1897 8.1897 8.2233 8.2233 10.1995 10.1995 10.2664 10.2664 10.3933 10.3933 10.4935 10.4935 10.6142 10.6142 10.7487 10.7487 11.3196 11.3196 11.9891 11.9891 12.0072 12.0072 12.5435 12.5435 12.8312 12.8312 14.5075 14.5075 14.5953 14.5953 16.9801 16.9801 18.4934 18.4934 k = 0.3026 0.1744 0.9662 ( 3843 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5574 -35.5574 -35.5570 -35.5570 -31.7478 -31.7478 -31.7465 -31.7465 -31.5673 -31.5673 -31.5666 -31.5666 -26.6879 -26.6879 -8.0349 -8.0349 -7.6926 -7.6926 -7.6147 -7.6147 4.7862 4.7862 6.4969 6.4969 8.1872 8.1872 8.2302 8.2302 10.1915 10.1915 10.2674 10.2674 10.3810 10.3810 10.5001 10.5001 10.6150 10.6150 10.7638 10.7638 11.3116 11.3116 11.9819 11.9819 12.0053 12.0053 12.5063 12.5063 12.8888 12.8888 14.4932 14.4932 14.6097 14.6097 16.9887 16.9887 18.4927 18.4927 k = 0.3158 0.1820 0.9574 ( 3842 PWs) bands (ev): -64.9390 -64.9390 -64.9388 -64.9388 -35.5574 -35.5574 -35.5569 -35.5569 -31.7479 -31.7479 -31.7462 -31.7462 -31.5674 -31.5674 -31.5668 -31.5668 -26.6880 -26.6880 -8.0349 -8.0349 -7.6925 -7.6925 -7.6147 -7.6147 4.7857 4.7857 6.4927 6.4927 8.1857 8.1857 8.2376 8.2376 10.1812 10.1812 10.2690 10.2690 10.3711 10.3711 10.5038 10.5038 10.6148 10.6148 10.7823 10.7823 11.3002 11.3002 11.9725 11.9725 12.0033 12.0033 12.4733 12.4733 12.9489 12.9489 14.4782 14.4782 14.6247 14.6247 16.9995 16.9995 18.4925 18.4925 k = 0.3289 0.1896 0.9487 ( 3840 PWs) bands (ev): -64.9391 -64.9391 -64.9388 -64.9388 -35.5575 -35.5575 -35.5568 -35.5568 -31.7480 -31.7480 -31.7460 -31.7460 -31.5674 -31.5674 -31.5669 -31.5669 -26.6880 -26.6880 -8.0348 -8.0348 -7.6924 -7.6924 -7.6147 -7.6147 4.7852 4.7852 6.4874 6.4874 8.1854 8.1854 8.2454 8.2454 10.1690 10.1690 10.2711 10.2711 10.3635 10.3635 10.5059 10.5059 10.6139 10.6139 10.8027 10.8027 11.2848 11.2848 11.9613 11.9613 12.0016 12.0016 12.4454 12.4454 13.0111 13.0111 14.4627 14.4627 14.6403 14.6403 17.0122 17.0122 18.4930 18.4930 k = 0.3421 0.1972 0.9399 ( 3850 PWs) bands (ev): -64.9391 -64.9391 -64.9388 -64.9388 -35.5576 -35.5576 -35.5567 -35.5567 -31.7480 -31.7480 -31.7456 -31.7456 -31.5675 -31.5675 -31.5671 -31.5671 -26.6880 -26.6880 -8.0347 -8.0347 -7.6923 -7.6923 -7.6147 -7.6147 4.7848 4.7848 6.4807 6.4807 8.1862 8.1862 8.2537 8.2537 10.1553 10.1553 10.2736 10.2736 10.3577 10.3577 10.5073 10.5073 10.6125 10.6125 10.8235 10.8235 11.2651 11.2651 11.9483 11.9483 11.9997 11.9997 12.4235 12.4235 13.0749 13.0749 14.4467 14.4467 14.6563 14.6563 17.0267 17.0267 18.4940 18.4940 k = 0.3553 0.2048 0.9312 ( 3850 PWs) bands (ev): -64.9392 -64.9392 -64.9387 -64.9387 -35.5578 -35.5578 -35.5566 -35.5566 -31.7481 -31.7481 -31.7452 -31.7452 -31.5676 -31.5676 -31.5673 -31.5673 -26.6880 -26.6880 -8.0346 -8.0346 -7.6921 -7.6921 -7.6147 -7.6147 4.7844 4.7844 6.4726 6.4726 8.1883 8.1883 8.2626 8.2626 10.1407 10.1407 10.2760 10.2760 10.3536 10.3536 10.5087 10.5087 10.6113 10.6113 10.8437 10.8437 11.2407 11.2407 11.9338 11.9338 11.9982 11.9982 12.4083 12.4083 13.1400 13.1400 14.4305 14.4305 14.6727 14.6727 17.0428 17.0428 18.4957 18.4957 k = 0.3684 0.2124 0.9224 ( 3848 PWs) bands (ev): -64.9392 -64.9392 -64.9387 -64.9387 -35.5579 -35.5579 -35.5564 -35.5564 -31.7482 -31.7482 -31.7448 -31.7448 -31.5678 -31.5678 -31.5675 -31.5675 -26.6880 -26.6880 -8.0345 -8.0345 -7.6919 -7.6919 -7.6147 -7.6147 4.7841 4.7841 6.4632 6.4632 8.1915 8.1915 8.2719 8.2719 10.1252 10.1252 10.2783 10.2783 10.3511 10.3511 10.5104 10.5104 10.6107 10.6107 10.8622 10.8622 11.2115 11.2115 11.9179 11.9179 11.9967 11.9967 12.4004 12.4004 13.2059 13.2059 14.4141 14.4141 14.6893 14.6893 17.0603 17.0603 18.4978 18.4978 k = 0.3816 0.2200 0.9137 ( 3848 PWs) bands (ev): -64.9393 -64.9393 -64.9386 -64.9386 -35.5580 -35.5580 -35.5562 -35.5562 -31.7483 -31.7483 -31.7443 -31.7443 -31.5680 -31.5680 -31.5677 -31.5677 -26.6880 -26.6880 -8.0344 -8.0344 -7.6918 -7.6918 -7.6148 -7.6148 4.7840 4.7840 6.4524 6.4524 8.1960 8.1960 8.2818 8.2818 10.1091 10.1091 10.2803 10.2803 10.3502 10.3502 10.5125 10.5125 10.6113 10.6113 10.8785 10.8785 11.1775 11.1775 11.9009 11.9009 11.9952 11.9952 12.3999 12.3999 13.2722 13.2722 14.3976 14.3976 14.7062 14.7062 17.0789 17.0789 18.5000 18.5000 k = 0.3947 0.2275 0.9049 ( 3851 PWs) bands (ev): -64.9393 -64.9393 -64.9386 -64.9386 -35.5582 -35.5582 -35.5560 -35.5560 -31.7485 -31.7485 -31.7438 -31.7438 -31.5684 -31.5684 -31.5678 -31.5678 -26.6881 -26.6881 -8.0343 -8.0343 -7.6916 -7.6916 -7.6148 -7.6148 4.7839 4.7839 6.4402 6.4402 8.2018 8.2018 8.2920 8.2920 10.0924 10.0924 10.2820 10.2820 10.3508 10.3508 10.5149 10.5149 10.6136 10.6136 10.8919 10.8919 11.1390 11.1390 11.8827 11.8827 11.9937 11.9937 12.4068 12.4068 13.3384 13.3384 14.3813 14.3813 14.7233 14.7233 17.0985 17.0985 18.5017 18.5017 k = 0.4079 0.2351 0.8961 ( 3859 PWs) bands (ev): -64.9394 -64.9394 -64.9385 -64.9385 -35.5584 -35.5584 -35.5558 -35.5558 -31.7486 -31.7486 -31.7432 -31.7432 -31.5687 -31.5687 -31.5679 -31.5679 -26.6881 -26.6881 -8.0341 -8.0341 -7.6913 -7.6913 -7.6148 -7.6148 4.7839 4.7839 6.4267 6.4267 8.2088 8.2088 8.3026 8.3026 10.0751 10.0751 10.2836 10.2836 10.3530 10.3530 10.5173 10.5173 10.6179 10.6179 10.9023 10.9023 11.0966 11.0966 11.8635 11.8635 11.9921 11.9921 12.4209 12.4209 13.4041 13.4041 14.3652 14.3652 14.7405 14.7405 17.1185 17.1185 18.5023 18.5023 k = 0.4211 0.2427 0.8874 ( 3861 PWs) bands (ev): -64.9395 -64.9395 -64.9384 -64.9384 -35.5586 -35.5586 -35.5556 -35.5556 -31.7487 -31.7487 -31.7426 -31.7426 -31.5691 -31.5691 -31.5680 -31.5680 -26.6881 -26.6881 -8.0340 -8.0340 -7.6911 -7.6911 -7.6148 -7.6148 4.7840 4.7840 6.4120 6.4120 8.2171 8.2171 8.3134 8.3134 10.0571 10.0571 10.2854 10.2854 10.3565 10.3565 10.5194 10.5194 10.6248 10.6248 10.9090 10.9090 11.0511 11.0511 11.8434 11.8434 11.9906 11.9906 12.4415 12.4415 13.4688 13.4688 14.3498 14.3498 14.7580 14.7580 17.1387 17.1387 18.5014 18.5014 k = 0.4342 0.2503 0.8786 ( 3861 PWs) bands (ev): -64.9396 -64.9396 -64.9384 -64.9384 -35.5588 -35.5588 -35.5553 -35.5553 -31.7489 -31.7489 -31.7419 -31.7419 -31.5696 -31.5696 -31.5681 -31.5681 -26.6881 -26.6881 -8.0338 -8.0338 -7.6908 -7.6908 -7.6149 -7.6149 4.7842 4.7842 6.3961 6.3961 8.2268 8.2268 8.3243 8.3243 10.0386 10.0386 10.2877 10.2877 10.3611 10.3611 10.5211 10.5211 10.6344 10.6344 10.9111 10.9111 11.0043 11.0043 11.8227 11.8227 11.9890 11.9890 12.4679 12.4679 13.5319 13.5319 14.3352 14.3352 14.7758 14.7758 17.1587 17.1587 18.4984 18.4984 k = 0.4474 0.2579 0.8699 ( 3863 PWs) bands (ev): -64.9397 -64.9397 -64.9383 -64.9383 -35.5590 -35.5590 -35.5550 -35.5550 -31.7491 -31.7491 -31.7411 -31.7411 -31.5700 -31.5700 -31.5682 -31.5682 -26.6882 -26.6882 -8.0336 -8.0336 -7.6906 -7.6906 -7.6149 -7.6149 4.7844 4.7844 6.3792 6.3792 8.2378 8.2378 8.3352 8.3352 10.0194 10.0194 10.2910 10.2910 10.3665 10.3665 10.5223 10.5223 10.6468 10.6468 10.9042 10.9042 10.9615 10.9615 11.8013 11.8013 11.9874 11.9874 12.4993 12.4993 13.5928 13.5928 14.3219 14.3219 14.7940 14.7940 17.1778 17.1778 18.4931 18.4931 k = 0.4605 0.2655 0.8611 ( 3861 PWs) bands (ev): -64.9398 -64.9398 -64.9382 -64.9382 -35.5593 -35.5593 -35.5547 -35.5547 -31.7493 -31.7493 -31.7404 -31.7404 -31.5705 -31.5705 -31.5684 -31.5684 -26.6882 -26.6882 -8.0334 -8.0334 -7.6903 -7.6903 -7.6149 -7.6149 4.7845 4.7845 6.3614 6.3614 8.2501 8.2501 8.3458 8.3458 9.9996 9.9996 10.2953 10.2953 10.3724 10.3724 10.5231 10.5231 10.6617 10.6617 10.8758 10.8758 10.9363 10.9363 11.7794 11.7794 11.9859 11.9859 12.5349 12.5349 13.6508 13.6508 14.3103 14.3103 14.8127 14.8127 17.1955 17.1955 18.4857 18.4857 k = 0.4737 0.2730 0.8524 ( 3867 PWs) bands (ev): -64.9399 -64.9399 -64.9381 -64.9381 -35.5595 -35.5595 -35.5544 -35.5544 -31.7495 -31.7495 -31.7395 -31.7395 -31.5710 -31.5710 -31.5685 -31.5685 -26.6882 -26.6882 -8.0332 -8.0332 -7.6899 -7.6899 -7.6149 -7.6149 4.7845 4.7845 6.3430 6.3430 8.2637 8.2637 8.3560 8.3560 9.9793 9.9793 10.3007 10.3007 10.3785 10.3785 10.5235 10.5235 10.6786 10.6786 10.8299 10.8299 10.9260 10.9260 11.7573 11.7573 11.9842 11.9842 12.5737 12.5737 13.7048 13.7048 14.3011 14.3011 14.8320 14.8320 17.2111 17.2111 18.4766 18.4766 k = 0.4868 0.2806 0.8436 ( 3863 PWs) bands (ev): -64.9400 -64.9400 -64.9380 -64.9380 -35.5598 -35.5598 -35.5541 -35.5541 -31.7497 -31.7497 -31.7387 -31.7387 -31.5715 -31.5715 -31.5686 -31.5686 -26.6883 -26.6883 -8.0330 -8.0330 -7.6896 -7.6896 -7.6150 -7.6150 4.7844 4.7844 6.3240 6.3240 8.2787 8.2787 8.3655 8.3655 9.9585 9.9585 10.3073 10.3073 10.3846 10.3846 10.5236 10.5236 10.6956 10.6956 10.7819 10.7819 10.9183 10.9183 11.7350 11.7350 11.9827 11.9827 12.6148 12.6148 13.7539 13.7539 14.2952 14.2952 14.8522 14.8522 17.2239 17.2239 18.4669 18.4669 k = 0.5000 0.2882 0.8349 ( 3862 PWs) bands (ev): -64.9401 -64.9401 -64.9379 -64.9379 -35.5601 -35.5601 -35.5538 -35.5538 -31.7499 -31.7499 -31.7377 -31.7377 -31.5721 -31.5721 -31.5688 -31.5688 -26.6883 -26.6883 -8.0328 -8.0328 -7.6892 -7.6892 -7.6150 -7.6150 4.7840 4.7840 6.3047 6.3047 8.2951 8.2951 8.3743 8.3743 9.9373 9.9373 10.3146 10.3146 10.3903 10.3903 10.5232 10.5232 10.6990 10.6990 10.7499 10.7499 10.9102 10.9102 11.7127 11.7127 11.9812 11.9812 12.6575 12.6575 13.7969 13.7969 14.2933 14.2933 14.8735 14.8735 17.2332 17.2332 18.4576 18.4576 k = 0.5000 0.2882 0.8349 ( 3862 PWs) bands (ev): -64.9401 -64.9401 -64.9379 -64.9379 -35.5601 -35.5601 -35.5538 -35.5538 -31.7499 -31.7499 -31.7377 -31.7377 -31.5721 -31.5721 -31.5688 -31.5688 -26.6883 -26.6883 -8.0328 -8.0328 -7.6892 -7.6892 -7.6150 -7.6150 4.7840 4.7840 6.3047 6.3047 8.2951 8.2951 8.3743 8.3743 9.9373 9.9373 10.3146 10.3146 10.3903 10.3903 10.5232 10.5232 10.6990 10.6990 10.7499 10.7499 10.9102 10.9102 11.7127 11.7127 11.9812 11.9812 12.6575 12.6575 13.7969 13.7969 14.2933 14.2933 14.8735 14.8735 17.2332 17.2332 18.4576 18.4576 k = 0.5000 0.2882 0.8167 ( 3866 PWs) bands (ev): -64.9403 -64.9403 -64.9376 -64.9376 -35.5607 -35.5607 -35.5530 -35.5530 -31.7504 -31.7504 -31.7357 -31.7357 -31.5733 -31.5733 -31.5691 -31.5691 -26.6884 -26.6884 -8.0323 -8.0323 -7.6885 -7.6885 -7.6151 -7.6151 4.7826 4.7826 6.2629 6.2629 8.3320 8.3320 8.3919 8.3919 9.8911 9.8911 10.3292 10.3292 10.4020 10.4020 10.5205 10.5205 10.6655 10.6655 10.7304 10.7304 10.8920 10.8920 11.6674 11.6674 11.9780 11.9780 12.7487 12.7487 13.8806 13.8806 14.2944 14.2944 14.9214 14.9214 17.2486 17.2486 18.4359 18.4359 k = 0.5000 0.2882 0.7986 ( 3854 PWs) bands (ev): -64.9406 -64.9406 -64.9373 -64.9373 -35.5614 -35.5614 -35.5522 -35.5522 -31.7510 -31.7510 -31.7334 -31.7334 -31.5747 -31.5747 -31.5695 -31.5695 -26.6885 -26.6885 -8.0317 -8.0317 -7.6876 -7.6876 -7.6151 -7.6151 4.7808 4.7808 6.2184 6.2184 8.3722 8.3722 8.4108 8.4108 9.8413 9.8413 10.3408 10.3408 10.4141 10.4141 10.5161 10.5161 10.6360 10.6360 10.7127 10.7127 10.8730 10.8730 11.6247 11.6247 11.9746 11.9746 12.8432 12.8432 13.9674 13.9674 14.2958 14.2958 14.9743 14.9743 17.2650 17.2650 18.4067 18.4067 k = 0.5000 0.2882 0.7804 ( 3850 PWs) bands (ev): -64.9409 -64.9409 -64.9371 -64.9371 -35.5621 -35.5621 -35.5513 -35.5513 -31.7516 -31.7516 -31.7310 -31.7310 -31.5761 -31.5761 -31.5699 -31.5699 -26.6886 -26.6886 -8.0311 -8.0311 -7.6866 -7.6866 -7.6152 -7.6152 4.7786 4.7786 6.1713 6.1713 8.4134 8.4134 8.4327 8.4327 9.7877 9.7877 10.3474 10.3474 10.4257 10.4257 10.5099 10.5099 10.6120 10.6120 10.6981 10.6981 10.8534 10.8534 11.5853 11.5853 11.9710 11.9710 12.9406 12.9406 14.0568 14.0568 14.2975 14.2975 15.0321 15.0321 17.2821 17.2821 18.3702 18.3702 k = 0.5000 0.2882 0.7623 ( 3854 PWs) bands (ev): -64.9412 -64.9412 -64.9368 -64.9368 -35.5629 -35.5629 -35.5503 -35.5503 -31.7523 -31.7523 -31.7284 -31.7284 -31.5776 -31.5776 -31.5703 -31.5703 -26.6887 -26.6887 -8.0305 -8.0305 -7.6856 -7.6856 -7.6152 -7.6152 4.7759 4.7759 6.1221 6.1221 8.4436 8.4436 8.4692 8.4692 9.7309 9.7309 10.3476 10.3476 10.4346 10.4346 10.5022 10.5022 10.5934 10.5934 10.6894 10.6894 10.8338 10.8338 11.5504 11.5504 11.9672 11.9672 13.0403 13.0403 14.1480 14.1480 14.2999 14.2999 15.0948 15.0948 17.2998 17.2998 18.3266 18.3266 k = 0.5000 0.2882 0.7441 ( 3850 PWs) bands (ev): -64.9415 -64.9415 -64.9364 -64.9364 -35.5637 -35.5637 -35.5493 -35.5493 -31.7531 -31.7531 -31.7257 -31.7257 -31.5791 -31.5791 -31.5707 -31.5707 -26.6888 -26.6888 -8.0298 -8.0298 -7.6845 -7.6845 -7.6153 -7.6153 4.7725 4.7725 6.0709 6.0709 8.4650 8.4650 8.5182 8.5182 9.6714 9.6714 10.3412 10.3412 10.4374 10.4374 10.4928 10.4928 10.5809 10.5809 10.6890 10.6890 10.8147 10.8147 11.5206 11.5206 11.9634 11.9634 13.1421 13.1421 14.2378 14.2378 14.3059 14.3059 15.1624 15.1624 17.3179 17.3179 18.2762 18.2762 k = 0.5000 0.2882 0.7260 ( 3838 PWs) bands (ev): -64.9418 -64.9418 -64.9361 -64.9361 -35.5646 -35.5646 -35.5482 -35.5482 -31.7540 -31.7540 -31.7227 -31.7227 -31.5807 -31.5807 -31.5712 -31.5712 -26.6889 -26.6889 -8.0290 -8.0290 -7.6834 -7.6834 -7.6154 -7.6154 4.7686 4.7686 6.0181 6.0181 8.4853 8.4853 8.5716 8.5716 9.6094 9.6094 10.3299 10.3299 10.4309 10.4309 10.4786 10.4786 10.5780 10.5780 10.6969 10.6969 10.7981 10.7981 11.4965 11.4965 11.9595 11.9595 13.2458 13.2458 14.2903 14.2903 14.3512 14.3512 15.2346 15.2346 17.3364 17.3364 18.2196 18.2196 k = 0.5000 0.2882 0.7078 ( 3848 PWs) bands (ev): -64.9422 -64.9422 -64.9358 -64.9358 -35.5656 -35.5656 -35.5471 -35.5471 -31.7549 -31.7549 -31.7197 -31.7197 -31.5824 -31.5824 -31.5717 -31.5717 -26.6891 -26.6891 -8.0282 -8.0282 -7.6822 -7.6822 -7.6155 -7.6155 4.7639 4.7639 5.9638 5.9638 8.5054 8.5054 8.6281 8.6281 9.5455 9.5455 10.3152 10.3152 10.4155 10.4155 10.4557 10.4557 10.5866 10.5866 10.7075 10.7075 10.7884 10.7884 11.4786 11.4786 11.9556 11.9556 13.3509 13.3509 14.2975 14.2975 14.4435 14.4435 15.3114 15.3114 17.3551 17.3551 18.1571 18.1571 k = 0.5000 0.2882 0.6897 ( 3850 PWs) bands (ev): -64.9426 -64.9426 -64.9354 -64.9354 -35.5666 -35.5666 -35.5459 -35.5459 -31.7559 -31.7559 -31.7165 -31.7165 -31.5840 -31.5840 -31.5722 -31.5722 -26.6892 -26.6892 -8.0274 -8.0274 -7.6809 -7.6809 -7.6155 -7.6155 4.7585 4.7585 5.9084 5.9084 8.5254 8.5254 8.6876 8.6876 9.4801 9.4801 10.2990 10.2990 10.3933 10.3933 10.4255 10.4255 10.6039 10.6039 10.7097 10.7097 10.7955 10.7955 11.4670 11.4670 11.9518 11.9518 13.4574 13.4574 14.3003 14.3003 14.5417 14.5417 15.3927 15.3927 17.3739 17.3739 18.0894 18.0894 k = 0.5000 0.2882 0.6715 ( 3842 PWs) bands (ev): -64.9430 -64.9430 -64.9350 -64.9350 -35.5676 -35.5676 -35.5447 -35.5447 -31.7570 -31.7570 -31.7131 -31.7131 -31.5857 -31.5857 -31.5727 -31.5727 -26.6894 -26.6894 -8.0266 -8.0266 -7.6795 -7.6795 -7.6156 -7.6156 4.7523 4.7523 5.8521 5.8521 8.5453 8.5453 8.7496 8.7496 9.4137 9.4137 10.2822 10.2822 10.3659 10.3659 10.3908 10.3908 10.6260 10.6260 10.6999 10.6999 10.8218 10.8218 11.4616 11.4616 11.9481 11.9481 13.5650 13.5650 14.3024 14.3024 14.6421 14.6421 15.4783 15.4783 17.3928 17.3928 18.0172 18.0172 k = 0.5000 0.2882 0.6534 ( 3846 PWs) bands (ev): -64.9434 -64.9434 -64.9346 -64.9346 -35.5687 -35.5687 -35.5434 -35.5434 -31.7582 -31.7582 -31.7097 -31.7097 -31.5874 -31.5874 -31.5732 -31.5732 -26.6895 -26.6895 -8.0257 -8.0257 -7.6781 -7.6781 -7.6157 -7.6157 4.7453 4.7453 5.7949 5.7949 8.5651 8.5651 8.8139 8.8139 9.3465 9.3465 10.2645 10.2645 10.3337 10.3337 10.3546 10.3546 10.6474 10.6474 10.6880 10.6880 10.8600 10.8600 11.4622 11.4622 11.9448 11.9448 13.6735 13.6735 14.3044 14.3044 14.7440 14.7440 15.5679 15.5679 17.4116 17.4116 17.9409 17.9409 k = 0.5000 0.2882 0.6352 ( 3846 PWs) bands (ev): -64.9438 -64.9438 -64.9342 -64.9342 -35.5698 -35.5698 -35.5421 -35.5421 -31.7595 -31.7595 -31.7061 -31.7061 -31.5891 -31.5891 -31.5738 -31.5738 -26.6897 -26.6897 -8.0248 -8.0248 -7.6767 -7.6767 -7.6158 -7.6158 4.7374 4.7374 5.7373 5.7373 8.5848 8.5848 8.8803 8.8803 9.2791 9.2791 10.2442 10.2442 10.2964 10.2964 10.3217 10.3217 10.6486 10.6486 10.6967 10.6967 10.9052 10.9052 11.4684 11.4684 11.9418 11.9418 13.7824 13.7824 14.3064 14.3064 14.8472 14.8472 15.6615 15.6615 17.4305 17.4305 17.8614 17.8614 k = 0.5000 0.2882 0.6171 ( 3842 PWs) bands (ev): -64.9442 -64.9442 -64.9337 -64.9337 -35.5709 -35.5709 -35.5408 -35.5408 -31.7608 -31.7608 -31.7024 -31.7024 -31.5908 -31.5908 -31.5743 -31.5743 -26.6898 -26.6898 -8.0239 -8.0239 -7.6752 -7.6752 -7.6158 -7.6158 4.7286 4.7286 5.6793 5.6793 8.6043 8.6043 8.9480 8.9480 9.2122 9.2122 10.2182 10.2182 10.2544 10.2544 10.2965 10.2965 10.6314 10.6314 10.7251 10.7251 10.9554 10.9554 11.4797 11.4797 11.9393 11.9393 13.8916 13.8916 14.3088 14.3088 14.9516 14.9516 15.7587 15.7587 17.4492 17.4492 17.7793 17.7793 k = 0.5000 0.2882 0.5989 ( 3846 PWs) bands (ev): -64.9447 -64.9447 -64.9333 -64.9333 -35.5720 -35.5720 -35.5394 -35.5394 -31.7623 -31.7623 -31.6987 -31.6987 -31.5924 -31.5924 -31.5749 -31.5749 -26.6900 -26.6900 -8.0229 -8.0229 -7.6736 -7.6736 -7.6159 -7.6159 4.7190 4.7190 5.6212 5.6212 8.6235 8.6235 9.0149 9.0149 9.1481 9.1481 10.1846 10.1846 10.2096 10.2096 10.2803 10.2803 10.6106 10.6106 10.7587 10.7587 11.0095 11.0095 11.4954 11.4954 11.9374 11.9374 14.0000 14.0000 14.3122 14.3122 15.0570 15.0570 15.8593 15.8593 17.4679 17.4679 17.6951 17.6951 k = 0.5000 0.2882 0.5808 ( 3854 PWs) bands (ev): -64.9451 -64.9451 -64.9329 -64.9329 -35.5732 -35.5732 -35.5381 -35.5381 -31.7638 -31.7638 -31.6949 -31.6949 -31.5940 -31.5940 -31.5755 -31.5755 -26.6901 -26.6901 -8.0219 -8.0219 -7.6721 -7.6721 -7.6160 -7.6160 4.7084 4.7084 5.5631 5.5631 8.6425 8.6425 9.0511 9.0511 9.1166 9.1166 10.1450 10.1450 10.1632 10.1632 10.2713 10.2713 10.5889 10.5889 10.7949 10.7949 11.0672 11.0672 11.5152 11.5152 11.9363 11.9363 14.1056 14.1056 14.3182 14.3182 15.1632 15.1632 15.9630 15.9630 17.4866 17.4866 17.6096 17.6096 k = 0.5000 0.2882 0.5626 ( 3850 PWs) bands (ev): -64.9456 -64.9456 -64.9324 -64.9324 -35.5744 -35.5744 -35.5367 -35.5367 -31.7654 -31.7654 -31.6910 -31.6910 -31.5956 -31.5956 -31.5761 -31.5761 -26.6903 -26.6903 -8.0209 -8.0209 -7.6704 -7.6704 -7.6160 -7.6160 4.6970 4.6970 5.5051 5.5051 8.6612 8.6612 9.0005 9.0005 9.1740 9.1740 10.1017 10.1017 10.1161 10.1161 10.2674 10.2674 10.5671 10.5671 10.8333 10.8333 11.1280 11.1280 11.5384 11.5384 11.9364 11.9364 14.2012 14.2012 14.3343 14.3343 15.2704 15.2704 16.0696 16.0696 17.5046 17.5046 17.5240 17.5240 k = 0.5000 0.2882 0.5445 ( 3858 PWs) bands (ev): -64.9461 -64.9461 -64.9320 -64.9320 -35.5757 -35.5757 -35.5353 -35.5353 -31.7671 -31.7671 -31.6871 -31.6871 -31.5972 -31.5972 -31.5767 -31.5767 -26.6905 -26.6905 -8.0199 -8.0199 -7.6688 -7.6688 -7.6161 -7.6161 4.6848 4.6848 5.4474 5.4474 8.6795 8.6795 8.9372 8.9372 9.2461 9.2461 10.0561 10.0561 10.0686 10.0686 10.2671 10.2671 10.5455 10.5455 10.8732 10.8732 11.1916 11.1916 11.5646 11.5646 11.9378 11.9378 14.2616 14.2616 14.3848 14.3848 15.3784 15.3784 16.1786 16.1786 17.4364 17.4364 17.5243 17.5243 k = 0.5000 0.2882 0.5263 ( 3862 PWs) bands (ev): -64.9465 -64.9465 -64.9315 -64.9315 -35.5769 -35.5769 -35.5339 -35.5339 -31.7688 -31.7688 -31.6831 -31.6831 -31.5986 -31.5986 -31.5773 -31.5773 -26.6906 -26.6906 -8.0189 -8.0189 -7.6671 -7.6671 -7.6161 -7.6161 4.6717 4.6717 5.3903 5.3903 8.6969 8.6969 8.8739 8.8739 9.3204 9.3204 10.0091 10.0091 10.0212 10.0212 10.2698 10.2698 10.5244 10.5244 10.9144 10.9144 11.2579 11.2579 11.5934 11.5934 11.9408 11.9408 14.2812 14.2812 14.4752 14.4752 15.4873 15.4873 16.2898 16.2898 17.3503 17.3503 17.5431 17.5431 k = 0.5000 0.2882 0.5082 ( 3868 PWs) bands (ev): -64.9470 -64.9470 -64.9311 -64.9311 -35.5782 -35.5782 -35.5325 -35.5325 -31.7707 -31.7707 -31.6792 -31.6792 -31.6001 -31.6001 -31.5779 -31.5779 -26.6908 -26.6908 -8.0179 -8.0179 -7.6654 -7.6654 -7.6162 -7.6162 4.6578 4.6578 5.3337 5.3337 8.7121 8.7121 8.8134 8.8134 9.3956 9.3956 9.9615 9.9615 9.9741 9.9741 10.2746 10.2746 10.5044 10.5044 10.9568 10.9568 11.3266 11.3266 11.6242 11.6242 11.9460 11.9460 14.2870 14.2870 14.5780 14.5780 15.5967 15.5967 16.4027 16.4027 17.2653 17.2653 17.5622 17.5622 k = 0.5000 0.2882 0.4900 ( 3864 PWs) bands (ev): -64.9475 -64.9475 -64.9306 -64.9306 -35.5794 -35.5794 -35.5311 -35.5311 -31.7725 -31.7725 -31.6752 -31.6752 -31.6014 -31.6014 -31.5785 -31.5785 -26.6910 -26.6910 -8.0169 -8.0169 -7.6637 -7.6637 -7.6162 -7.6162 4.6433 4.6433 5.2779 5.2779 8.7142 8.7142 8.7669 8.7669 9.4709 9.4709 9.9140 9.9140 9.9274 9.9274 10.2810 10.2810 10.4860 10.4860 10.9998 10.9998 11.3975 11.3975 11.6569 11.6569 11.9537 11.9537 14.2885 14.2885 14.6830 14.6830 15.7068 15.7068 16.5169 16.5169 17.1821 17.1821 17.5817 17.5817 k = 0.5000 0.2882 0.4719 ( 3852 PWs) bands (ev): -64.9479 -64.9479 -64.9301 -64.9301 -35.5807 -35.5807 -35.5296 -35.5296 -31.7745 -31.7745 -31.6712 -31.6712 -31.6027 -31.6027 -31.5790 -31.5790 -26.6911 -26.6911 -8.0158 -8.0158 -7.6620 -7.6620 -7.6163 -7.6163 4.6280 4.6280 5.2230 5.2230 8.6735 8.6735 8.7643 8.7643 9.5456 9.5456 9.8672 9.8672 9.8814 9.8814 10.2877 10.2877 10.4703 10.4703 11.0429 11.0429 11.4704 11.4704 11.6913 11.6913 11.9646 11.9646 14.2881 14.2881 14.7872 14.7872 15.8176 15.8176 16.6317 16.6317 17.1015 17.1015 17.6005 17.6005 k = 0.5000 0.2882 0.4537 ( 3848 PWs) bands (ev): -64.9484 -64.9484 -64.9297 -64.9297 -35.5819 -35.5819 -35.5282 -35.5282 -31.7765 -31.7765 -31.6672 -31.6672 -31.6039 -31.6039 -31.5796 -31.5796 -26.6913 -26.6913 -8.0148 -8.0148 -7.6602 -7.6602 -7.6163 -7.6163 4.6122 4.6122 5.1690 5.1690 8.6174 8.6174 8.7785 8.7785 9.6185 9.6185 9.8222 9.8222 9.8365 9.8365 10.2932 10.2932 10.4586 10.4586 11.0855 11.0855 11.5448 11.5448 11.7272 11.7272 11.9792 11.9792 14.2864 14.2864 14.8889 14.8889 15.9289 15.9289 16.7465 16.7465 17.0247 17.0247 17.5653 17.5653 k = 0.5000 0.2882 0.4356 ( 3848 PWs) bands (ev): -64.9488 -64.9488 -64.9292 -64.9292 -35.5831 -35.5831 -35.5269 -35.5269 -31.7785 -31.7785 -31.6633 -31.6633 -31.6051 -31.6051 -31.5801 -31.5801 -26.6915 -26.6915 -8.0138 -8.0138 -7.6585 -7.6585 -7.6163 -7.6163 4.5959 4.5959 5.1162 5.1162 8.5603 8.5603 8.7949 8.7949 9.6834 9.6834 9.7821 9.7821 9.7956 9.7956 10.2954 10.2954 10.4527 10.4527 11.1270 11.1270 11.6201 11.6201 11.7649 11.7649 11.9979 11.9979 14.2836 14.2836 14.9867 14.9867 16.0405 16.0405 16.8596 16.8596 16.9536 16.9536 17.4841 17.4841 k = 0.5000 0.2882 0.4174 ( 3854 PWs) bands (ev): -64.9493 -64.9493 -64.9288 -64.9288 -35.5844 -35.5844 -35.5255 -35.5255 -31.7805 -31.7805 -31.6594 -31.6594 -31.6061 -31.6061 -31.5807 -31.5807 -26.6916 -26.6916 -8.0127 -8.0127 -7.6568 -7.6568 -7.6163 -7.6163 4.5792 4.5792 5.0646 5.0646 8.5043 8.5043 8.8119 8.8119 9.7028 9.7028 9.7442 9.7442 9.7989 9.7989 10.2928 10.2928 10.4543 10.4543 11.1664 11.1664 11.6951 11.6951 11.8058 11.8058 12.0214 12.0214 14.2797 14.2797 15.0789 15.0789 16.1525 16.1525 16.8849 16.8849 16.9749 16.9749 17.4004 17.4004 k = 0.5000 0.2882 0.3993 ( 3850 PWs) bands (ev): -64.9497 -64.9497 -64.9283 -64.9283 -35.5856 -35.5856 -35.5242 -35.5242 -31.7826 -31.7826 -31.6556 -31.6556 -31.6071 -31.6071 -31.5812 -31.5812 -26.6918 -26.6918 -8.0117 -8.0117 -7.6551 -7.6551 -7.6164 -7.6164 4.5622 4.5622 5.0144 5.0144 8.4498 8.4498 8.8290 8.8290 9.6706 9.6706 9.7027 9.7027 9.8586 9.8586 10.2851 10.2851 10.4636 10.4636 11.2031 11.2031 11.7667 11.7667 11.8528 11.8528 12.0500 12.0500 14.2750 14.2750 15.1636 15.1636 16.2645 16.2645 16.8289 16.8289 17.0824 17.0824 17.3158 17.3158 k = 0.5000 0.2882 0.3811 ( 3852 PWs) bands (ev): -64.9502 -64.9502 -64.9279 -64.9279 -35.5868 -35.5868 -35.5229 -35.5229 -31.7847 -31.7847 -31.6518 -31.6518 -31.6080 -31.6080 -31.5817 -31.5817 -26.6919 -26.6919 -8.0108 -8.0108 -7.6534 -7.6534 -7.6164 -7.6164 4.5450 4.5450 4.9657 4.9657 8.3972 8.3972 8.8460 8.8460 9.6305 9.6305 9.6616 9.6616 9.9265 9.9265 10.2733 10.2733 10.4793 10.4793 11.2361 11.2361 11.8300 11.8300 11.9110 11.9110 12.0839 12.0839 14.2691 14.2691 15.2383 15.2383 16.3765 16.3765 16.7830 16.7830 17.1789 17.1789 17.2373 17.2373 k = 0.5000 0.2882 0.3630 ( 3844 PWs) bands (ev): -64.9506 -64.9506 -64.9275 -64.9275 -35.5879 -35.5879 -35.5216 -35.5216 -31.7868 -31.7868 -31.6482 -31.6482 -31.6089 -31.6089 -31.5822 -31.5822 -26.6921 -26.6921 -8.0098 -8.0098 -7.6517 -7.6517 -7.6164 -7.6164 4.5276 4.5276 4.9185 4.9185 8.3464 8.3464 8.8629 8.8629 9.5900 9.5900 9.6219 9.6219 9.9942 9.9942 10.2595 10.2595 10.5000 10.5000 11.2649 11.2649 11.8835 11.8835 11.9820 11.9820 12.1233 12.1233 14.2620 14.2620 15.3004 15.3004 16.4877 16.4877 16.7510 16.7510 17.1375 17.1375 17.2894 17.2894 k = 0.5000 0.2882 0.3448 ( 3844 PWs) bands (ev): -64.9510 -64.9510 -64.9271 -64.9271 -35.5891 -35.5891 -35.5204 -35.5204 -31.7888 -31.7888 -31.6447 -31.6447 -31.6097 -31.6097 -31.5826 -31.5826 -26.6923 -26.6923 -8.0088 -8.0088 -7.6501 -7.6501 -7.6164 -7.6164 4.5103 4.5103 4.8729 4.8729 8.2977 8.2977 8.8796 8.8796 9.5503 9.5503 9.5835 9.5835 10.0591 10.0591 10.2457 10.2457 10.5242 10.5242 11.2888 11.2888 11.9316 11.9316 12.0606 12.0606 12.1684 12.1684 14.2537 14.2537 15.3472 15.3472 16.5962 16.5962 16.7371 16.7371 17.0530 17.0530 17.3755 17.3755 k = 0.5000 0.2882 0.3267 ( 3844 PWs) bands (ev): -64.9514 -64.9514 -64.9267 -64.9267 -35.5902 -35.5902 -35.5192 -35.5192 -31.7909 -31.7909 -31.6412 -31.6412 -31.6104 -31.6104 -31.5830 -31.5830 -26.6924 -26.6924 -8.0079 -8.0079 -7.6485 -7.6485 -7.6164 -7.6164 4.4931 4.4931 4.8291 4.8291 8.2511 8.2511 8.8961 8.8961 9.5119 9.5119 9.5467 9.5467 10.1168 10.1168 10.2368 10.2368 10.5509 10.5509 11.3077 11.3077 11.9779 11.9779 12.1424 12.1424 12.2199 12.2199 14.2439 14.2439 15.3765 15.3765 16.6890 16.6890 16.7555 16.7555 16.9689 16.9689 17.4510 17.4510 k = 0.5000 0.2882 0.3085 ( 3844 PWs) bands (ev): -64.9518 -64.9518 -64.9263 -64.9263 -35.5913 -35.5913 -35.5180 -35.5180 -31.7929 -31.7929 -31.6379 -31.6379 -31.6110 -31.6110 -31.5834 -31.5834 -26.6925 -26.6925 -8.0070 -8.0070 -7.6469 -7.6469 -7.6163 -7.6163 4.4760 4.4760 4.7872 4.7872 8.2066 8.2066 8.9124 8.9124 9.4750 9.4750 9.5115 9.5115 10.1530 10.1530 10.2472 10.2472 10.5794 10.5794 11.3218 11.3218 12.0236 12.0236 12.2240 12.2240 12.2793 12.2793 14.2326 14.2326 15.3874 15.3874 16.7352 16.7352 16.8294 16.8294 16.8947 16.8947 17.5142 17.5142 k = 0.5000 0.2882 0.2904 ( 3846 PWs) bands (ev): -64.9522 -64.9522 -64.9259 -64.9259 -35.5923 -35.5923 -35.5169 -35.5169 -31.7948 -31.7948 -31.6348 -31.6348 -31.6116 -31.6116 -31.5837 -31.5837 -26.6927 -26.6927 -8.0062 -8.0062 -7.6454 -7.6454 -7.6163 -7.6163 4.4593 4.4593 4.7471 4.7471 8.1645 8.1645 8.9283 8.9283 9.4397 9.4397 9.4782 9.4782 10.1561 10.1561 10.2887 10.2887 10.6091 10.6091 11.3312 11.3312 12.0684 12.0684 12.3022 12.3022 12.3487 12.3487 14.2195 14.2195 15.3806 15.3806 16.7711 16.7711 16.7986 16.7986 16.9538 16.9538 17.5659 17.5659 k = 0.5000 0.2882 0.2722 ( 3844 PWs) bands (ev): -64.9526 -64.9526 -64.9256 -64.9256 -35.5933 -35.5933 -35.5158 -35.5158 -31.7967 -31.7967 -31.6318 -31.6318 -31.6122 -31.6122 -31.5840 -31.5840 -26.6928 -26.6928 -8.0054 -8.0054 -7.6440 -7.6440 -7.6163 -7.6163 4.4431 4.4431 4.7091 4.7091 8.1247 8.1247 8.9439 8.9439 9.4061 9.4061 9.4467 9.4467 10.1444 10.1444 10.3433 10.3433 10.6396 10.6396 11.3365 11.3365 12.1120 12.1120 12.3764 12.3764 12.4282 12.4282 14.2045 14.2045 15.3581 15.3581 16.7127 16.7127 16.8305 16.8305 17.0603 17.0603 17.6085 17.6085 k = 0.5000 0.2882 0.2541 ( 3834 PWs) bands (ev): -64.9529 -64.9529 -64.9252 -64.9252 -35.5942 -35.5942 -35.5148 -35.5148 -31.7985 -31.7985 -31.6290 -31.6290 -31.6126 -31.6126 -31.5842 -31.5842 -26.6929 -26.6929 -8.0046 -8.0046 -7.6426 -7.6426 -7.6163 -7.6163 4.4273 4.4273 4.6732 4.6732 8.0872 8.0872 8.9591 8.9591 9.3743 9.3743 9.4171 9.4171 10.1287 10.1287 10.4002 10.4002 10.6703 10.6703 11.3379 11.3379 12.1538 12.1538 12.4501 12.4501 12.5134 12.5134 14.1875 14.1875 15.3226 15.3226 16.6353 16.6353 16.8928 16.8928 17.1683 17.1683 17.6443 17.6443 k = 0.5000 0.2882 0.2359 ( 3836 PWs) bands (ev): -64.9532 -64.9532 -64.9249 -64.9249 -35.5951 -35.5951 -35.5139 -35.5139 -31.8003 -31.8003 -31.6264 -31.6264 -31.6131 -31.6131 -31.5844 -31.5844 -26.6931 -26.6931 -8.0038 -8.0038 -7.6413 -7.6413 -7.6163 -7.6163 4.4122 4.4122 4.6394 4.6394 8.0521 8.0521 8.9737 8.9737 9.3442 9.3442 9.3896 9.3896 10.1120 10.1120 10.4566 10.4566 10.7010 10.7010 11.3360 11.3360 12.1937 12.1937 12.5256 12.5256 12.6007 12.6007 14.1681 14.1681 15.2770 15.2770 16.5601 16.5601 16.9627 16.9627 17.2753 17.2753 17.6755 17.6755 k = 0.5000 0.2882 0.2178 ( 3836 PWs) bands (ev): -64.9535 -64.9535 -64.9246 -64.9246 -35.5960 -35.5960 -35.5130 -35.5130 -31.8020 -31.8020 -31.6239 -31.6239 -31.6134 -31.6134 -31.5845 -31.5845 -26.6932 -26.6932 -8.0031 -8.0031 -7.6400 -7.6400 -7.6162 -7.6162 4.3978 4.3978 4.6079 4.6079 8.0195 8.0195 8.9878 8.9878 9.3161 9.3161 9.3641 9.3641 10.0952 10.0952 10.5115 10.5115 10.7311 10.7311 11.3311 11.3311 12.2311 12.2311 12.6035 12.6035 12.6886 12.6886 14.1462 14.1462 15.2240 15.2240 16.4882 16.4882 17.0363 17.0363 17.3804 17.3804 17.7036 17.7036 k = 0.5000 0.2882 0.1996 ( 3826 PWs) bands (ev): -64.9538 -64.9538 -64.9243 -64.9243 -35.5968 -35.5968 -35.5121 -35.5121 -31.8035 -31.8035 -31.6217 -31.6217 -31.6138 -31.6138 -31.5846 -31.5846 -26.6933 -26.6933 -8.0025 -8.0025 -7.6388 -7.6388 -7.6162 -7.6162 4.3842 4.3842 4.5786 4.5786 7.9894 7.9894 9.0014 9.0014 9.2898 9.2898 9.3408 9.3408 10.0788 10.0788 10.5646 10.5646 10.7605 10.7605 11.3236 11.3236 12.2663 12.2663 12.6834 12.6834 12.7761 12.7761 14.1217 14.1217 15.1657 15.1657 16.4200 16.4200 17.1100 17.1100 17.4830 17.4830 17.7295 17.7295 k = 0.5000 0.2882 0.1815 ( 3832 PWs) bands (ev): -64.9541 -64.9541 -64.9240 -64.9240 -35.5975 -35.5975 -35.5114 -35.5114 -31.8050 -31.8050 -31.6197 -31.6197 -31.6141 -31.6141 -31.5847 -31.5847 -26.6934 -26.6934 -8.0019 -8.0019 -7.6378 -7.6378 -7.6162 -7.6162 4.3715 4.3715 4.5517 4.5517 7.9618 7.9618 9.0141 9.0141 9.2653 9.2653 9.3196 9.3196 10.0631 10.0631 10.6156 10.6156 10.7887 10.7887 11.3138 11.3138 12.2988 12.2988 12.7648 12.7648 12.8625 12.8625 14.0942 14.0942 15.1041 15.1041 16.3561 16.3561 17.1803 17.1803 17.5822 17.5822 17.7539 17.7539 k = 0.5000 0.2882 0.1633 ( 3836 PWs) bands (ev): -64.9543 -64.9543 -64.9238 -64.9238 -35.5982 -35.5982 -35.5107 -35.5107 -31.8063 -31.8063 -31.6179 -31.6179 -31.6143 -31.6143 -31.5847 -31.5847 -26.6935 -26.6935 -8.0014 -8.0014 -7.6368 -7.6368 -7.6161 -7.6161 4.3597 4.3597 4.5271 4.5271 7.9367 7.9367 9.0262 9.0262 9.2428 9.2428 9.3007 9.3007 10.0482 10.0482 10.6644 10.6644 10.8155 10.8155 11.3018 11.3018 12.3286 12.3286 12.8470 12.8470 12.9470 12.9470 14.0637 14.0637 15.0406 15.0406 16.2970 16.2970 17.2445 17.2445 17.6769 17.6769 17.7776 17.7776 k = 0.5000 0.2882 0.1452 ( 3834 PWs) bands (ev): -64.9546 -64.9546 -64.9235 -64.9235 -35.5988 -35.5988 -35.5100 -35.5100 -31.8076 -31.8076 -31.6163 -31.6163 -31.6145 -31.6145 -31.5847 -31.5847 -26.6935 -26.6935 -8.0009 -8.0009 -7.6359 -7.6359 -7.6161 -7.6161 4.3490 4.3490 4.5051 4.5051 7.9142 7.9142 9.0375 9.0375 9.2222 9.2222 9.2840 9.2840 10.0344 10.0344 10.7108 10.7108 10.8405 10.8405 11.2881 11.2881 12.3556 12.3556 12.9292 12.9292 13.0289 13.0289 14.0301 14.0301 14.9769 14.9769 16.2430 16.2430 17.3001 17.3001 17.7644 17.7644 17.8027 17.8027 k = 0.5000 0.2882 0.1270 ( 3822 PWs) bands (ev): -64.9547 -64.9547 -64.9233 -64.9233 -35.5993 -35.5993 -35.5095 -35.5095 -31.8087 -31.8087 -31.6151 -31.6151 -31.6145 -31.6145 -31.5846 -31.5846 -26.6936 -26.6936 -8.0004 -8.0004 -7.6350 -7.6350 -7.6161 -7.6161 4.3394 4.3394 4.4855 4.4855 7.8943 7.8943 9.0480 9.0480 9.2035 9.2035 9.2696 9.2696 10.0219 10.0219 10.7546 10.7546 10.8635 10.8635 11.2730 11.2730 12.3800 12.3800 13.0107 13.0107 13.1073 13.1073 13.9934 13.9934 14.9142 14.9142 16.1945 16.1945 17.3459 17.3459 17.8155 17.8155 17.8574 17.8574 k = 0.5000 0.2882 0.1089 ( 3826 PWs) bands (ev): -64.9549 -64.9549 -64.9232 -64.9232 -35.5998 -35.5998 -35.5090 -35.5090 -31.8096 -31.8096 -31.6149 -31.6149 -31.6136 -31.6136 -31.5845 -31.5845 -26.6937 -26.6937 -8.0000 -8.0000 -7.6343 -7.6343 -7.6161 -7.6161 4.3310 4.3310 4.4684 4.4684 7.8770 7.8770 9.0575 9.0575 9.1866 9.1866 9.2573 9.2573 10.0107 10.0107 10.7954 10.7954 10.8843 10.8843 11.2565 11.2565 12.4013 12.4013 13.0906 13.0906 13.1808 13.1808 13.9537 13.9537 14.8539 14.8539 16.1518 16.1518 17.3817 17.3817 17.8382 17.8382 17.9321 17.9321 k = 0.5000 0.2882 0.0907 ( 3830 PWs) bands (ev): -64.9551 -64.9551 -64.9230 -64.9230 -35.6002 -35.6002 -35.5086 -35.5086 -31.8105 -31.8105 -31.6151 -31.6151 -31.6127 -31.6127 -31.5844 -31.5844 -26.6937 -26.6937 -7.9997 -7.9997 -7.6337 -7.6337 -7.6160 -7.6160 4.3237 4.3237 4.4539 4.4539 7.8623 7.8623 9.0662 9.0662 9.1715 9.1715 9.2473 9.2473 10.0009 10.0009 10.8327 10.8327 10.9028 10.9028 11.2394 11.2394 12.4194 12.4194 13.1680 13.1680 13.2482 13.2482 13.9113 13.9113 14.7976 14.7976 16.1152 16.1152 17.4085 17.4085 17.8579 17.8579 18.0000 18.0000 k = 0.5000 0.2882 0.0726 ( 3842 PWs) bands (ev): -64.9552 -64.9552 -64.9229 -64.9229 -35.6005 -35.6005 -35.5082 -35.5082 -31.8111 -31.8111 -31.6152 -31.6152 -31.6119 -31.6119 -31.5843 -31.5843 -26.6938 -26.6938 -7.9995 -7.9995 -7.6333 -7.6333 -7.6160 -7.6160 4.3178 4.3178 4.4420 4.4420 7.8502 7.8502 9.0740 9.0740 9.1583 9.1583 9.2393 9.2393 9.9928 9.9928 10.8657 10.8657 10.9191 10.9191 11.2221 11.2221 12.4343 12.4343 13.2416 13.2416 13.3079 13.3079 13.8670 13.8670 14.7471 14.7471 16.0848 16.0848 17.4278 17.4278 17.8757 17.8757 18.0578 18.0578 k = 0.5000 0.2882 0.0544 ( 3842 PWs) bands (ev): -64.9553 -64.9553 -64.9229 -64.9229 -35.6008 -35.6008 -35.5080 -35.5080 -31.8117 -31.8117 -31.6152 -31.6152 -31.6113 -31.6113 -31.5842 -31.5842 -26.6938 -26.6938 -7.9992 -7.9992 -7.6329 -7.6329 -7.6160 -7.6160 4.3131 4.3131 4.4328 4.4328 7.8409 7.8409 9.0810 9.0810 9.1470 9.1470 9.2333 9.2333 9.9863 9.9863 10.8928 10.8928 10.9335 10.9335 11.2056 11.2056 12.4460 12.4460 13.3093 13.3093 13.3578 13.3578 13.8224 13.8224 14.7045 14.7045 16.0611 16.0611 17.4409 17.4409 17.8911 17.8911 18.1036 18.1036 k = 0.5000 0.2882 0.0363 ( 3846 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6010 -35.6010 -35.5078 -35.5078 -31.8121 -31.8121 -31.6153 -31.6153 -31.6109 -31.6109 -31.5841 -31.5841 -26.6938 -26.6938 -7.9991 -7.9991 -7.6326 -7.6326 -7.6160 -7.6160 4.3097 4.3097 4.4261 4.4261 7.8342 7.8342 9.0871 9.0871 9.1378 9.1378 9.2291 9.2291 9.9816 9.9816 10.9121 10.9121 10.9463 10.9463 11.1914 11.1914 12.4545 12.4545 13.3673 13.3673 13.3961 13.3961 13.7807 13.7807 14.6718 14.6718 16.0440 16.0440 17.4494 17.4494 17.9033 17.9033 18.1354 18.1354 k = 0.5000 0.2882 0.0181 ( 3858 PWs) bands (ev): -64.9554 -64.9554 -64.9228 -64.9228 -35.6011 -35.6011 -35.5077 -35.5077 -31.8123 -31.8123 -31.6153 -31.6153 -31.6106 -31.6106 -31.5841 -31.5841 -26.6938 -26.6938 -7.9990 -7.9990 -7.6325 -7.6325 -7.6160 -7.6160 4.3077 4.3077 4.4221 4.4221 7.8302 7.8302 9.0915 9.0915 9.1313 9.1313 9.2267 9.2267 9.9787 9.9787 10.9228 10.9228 10.9563 10.9563 11.1814 11.1814 12.4593 12.4593 13.4076 13.4076 13.4219 13.4219 13.7483 13.7483 14.6512 14.6512 16.0337 16.0337 17.4540 17.4540 17.9112 17.9112 18.1502 18.1502 k = 0.5000 0.2882-0.0000 ( 3858 PWs) bands (ev): -64.9555 -64.9555 -64.9227 -64.9227 -35.6011 -35.6011 -35.5076 -35.5076 -31.8124 -31.8124 -31.6153 -31.6153 -31.6105 -31.6105 -31.5841 -31.5841 -26.6939 -26.6939 -7.9990 -7.9990 -7.6324 -7.6324 -7.6160 -7.6160 4.3070 4.3070 4.4208 4.4208 7.8288 7.8288 9.0933 9.0933 9.1289 9.1289 9.2258 9.2258 9.9778 9.9778 10.9262 10.9262 10.9602 10.9602 11.1778 11.1778 12.4610 12.4610 13.4206 13.4206 13.4333 13.4333 13.7354 13.7354 14.6441 14.6441 16.0303 16.0303 17.4555 17.4555 17.9139 17.9139 18.1526 18.1526 k = 0.0000 0.0000 1.0012 ( 3828 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5049 6.5049 8.1281 8.1281 8.2875 8.2875 10.1798 10.1798 10.1851 10.1851 10.3358 10.3358 10.5170 10.5170 10.8258 10.8258 10.9972 10.9972 11.0108 11.0108 11.9955 11.9955 12.0053 12.0053 12.1628 12.1628 13.3377 13.3377 14.2905 14.2905 14.6657 14.6657 17.1581 17.1581 18.4544 18.4544 k = 0.0156 0.0090 1.0012 ( 3836 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5049 6.5049 8.1285 8.1285 8.2871 8.2871 10.1807 10.1807 10.1853 10.1853 10.3355 10.3355 10.5176 10.5176 10.8248 10.8248 10.9691 10.9691 11.0383 11.0383 11.9952 11.9952 12.0057 12.0057 12.1650 12.1650 13.3334 13.3334 14.2928 14.2928 14.6653 14.6653 17.1560 17.1560 18.4548 18.4548 k = 0.0312 0.0180 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5048 6.5048 8.1295 8.1295 8.2858 8.2858 10.1830 10.1830 10.1861 10.1861 10.3348 10.3348 10.5192 10.5192 10.8220 10.8220 10.9348 10.9348 11.0707 11.0707 11.9945 11.9945 12.0068 12.0068 12.1717 12.1717 13.3207 13.3207 14.2996 14.2996 14.6639 14.6639 17.1500 17.1500 18.4561 18.4561 k = 0.0469 0.0270 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5048 6.5048 8.1311 8.1311 8.2838 8.2838 10.1857 10.1857 10.1886 10.1886 10.3337 10.3337 10.5220 10.5220 10.8171 10.8171 10.9004 10.9004 11.1022 11.1022 11.9941 11.9941 12.0082 12.0082 12.1830 12.1830 13.3002 13.3002 14.3102 14.3102 14.6619 14.6619 17.1402 17.1402 18.4582 18.4582 k = 0.0625 0.0360 1.0012 ( 3854 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7470 -31.7470 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7871 4.7871 6.5047 6.5047 8.1335 8.1335 8.2809 8.2809 10.1875 10.1875 10.1942 10.1942 10.3324 10.3324 10.5258 10.5258 10.8096 10.8096 10.8669 10.8669 11.1324 11.1324 11.9938 11.9938 12.0097 12.0097 12.1988 12.1988 13.2724 13.2724 14.3244 14.3244 14.6591 14.6591 17.1273 17.1273 18.4610 18.4610 k = 0.0781 0.0450 1.0012 ( 3854 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7470 -31.7470 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7872 4.7872 6.5046 6.5046 8.1365 8.1365 8.2773 8.2773 10.1892 10.1892 10.2017 10.2017 10.3311 10.3311 10.5304 10.5304 10.7974 10.7974 10.8369 10.8369 11.1612 11.1612 11.9937 11.9937 12.0108 12.0108 12.2192 12.2192 13.2385 13.2385 14.3411 14.3411 14.6554 14.6554 17.1118 17.1118 18.4643 18.4643 k = 0.0938 0.0540 1.0012 ( 3858 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7872 4.7872 6.5044 6.5044 8.1401 8.1401 8.2730 8.2730 10.1911 10.1911 10.2104 10.2104 10.3301 10.3301 10.5357 10.5357 10.7759 10.7759 10.8152 10.8152 11.1882 11.1882 11.9938 11.9938 12.0117 12.0117 12.2439 12.2439 13.1991 13.1991 14.3598 14.3598 14.6508 14.6508 17.0946 17.0946 18.4680 18.4680 k = 0.1094 0.0630 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7872 4.7872 6.5043 6.5043 8.1444 8.1444 8.2681 8.2681 10.1933 10.1933 10.2202 10.2202 10.3297 10.3297 10.5415 10.5415 10.7464 10.7464 10.8012 10.8012 11.2134 11.2134 11.9941 11.9941 12.0123 12.0123 12.2728 12.2728 13.1554 13.1554 14.3798 14.3798 14.6453 14.6453 17.0763 17.0763 18.4720 18.4720 k = 0.1250 0.0721 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7872 4.7872 6.5042 6.5042 8.1491 8.1491 8.2625 8.2625 10.1955 10.1955 10.2305 10.2305 10.3305 10.3305 10.5473 10.5473 10.7143 10.7143 10.7898 10.7898 11.2364 11.2364 11.9946 11.9946 12.0125 12.0125 12.3057 12.3057 13.1079 13.1079 14.4005 14.4005 14.6389 14.6389 17.0577 17.0577 18.4759 18.4759 k = 0.1406 0.0811 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7873 4.7873 6.5040 6.5040 8.1544 8.1544 8.2565 8.2565 10.1979 10.1979 10.2406 10.2406 10.3332 10.3332 10.5527 10.5527 10.6825 10.6825 10.7792 10.7792 11.2573 11.2573 11.9953 11.9953 12.0125 12.0125 12.3422 12.3422 13.0577 13.0577 14.4213 14.4213 14.6317 14.6317 17.0395 17.0395 18.4798 18.4798 k = 0.1562 0.0901 1.0012 ( 3852 PWs) bands (ev): -64.9390 -64.9390 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7873 4.7873 6.5039 6.5039 8.1602 8.1602 8.2499 8.2499 10.2003 10.2003 10.2495 10.2495 10.3388 10.3388 10.5565 10.5565 10.6527 10.6527 10.7691 10.7691 11.2756 11.2756 11.9961 11.9961 12.0122 12.0122 12.3821 12.3821 13.0052 13.0052 14.4419 14.4419 14.6235 14.6235 17.0224 17.0224 18.4836 18.4836 k = 0.1719 0.0991 1.0012 ( 3846 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7874 4.7874 6.5038 6.5038 8.1664 8.1664 8.2430 8.2430 10.2026 10.2026 10.2565 10.2565 10.3482 10.3482 10.5558 10.5558 10.6278 10.6278 10.7593 10.7593 11.2915 11.2915 11.9970 11.9970 12.0117 12.0117 12.4250 12.4250 12.9513 12.9513 14.4619 14.4619 14.6145 14.6145 17.0070 17.0070 18.4870 18.4870 k = 0.1875 0.1081 1.0012 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5672 -31.5672 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7874 4.7874 6.5037 6.5037 8.1730 8.1730 8.2359 8.2359 10.2048 10.2048 10.2612 10.2612 10.3617 10.3617 10.5457 10.5457 10.6128 10.6128 10.7504 10.7504 11.3046 11.3046 11.9979 11.9979 12.0112 12.0112 12.4706 12.4706 12.8963 12.8963 14.4812 14.4812 14.6045 14.6045 16.9937 16.9937 18.4899 18.4899 k = 0.2031 0.1171 1.0012 ( 3852 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7874 4.7874 6.5036 6.5036 8.1799 8.1799 8.2285 8.2285 10.2066 10.2066 10.2639 10.2639 10.3789 10.3789 10.5255 10.5255 10.6083 10.6083 10.7424 10.7424 11.3150 11.3150 11.9985 11.9985 12.0105 12.0105 12.5186 12.5186 12.8409 12.8409 14.4994 14.4994 14.5936 14.5936 16.9829 16.9829 18.4922 18.4922 k = 0.2188 0.1261 1.0012 ( 3852 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7874 4.7874 6.5035 6.5035 8.1869 8.1869 8.2211 8.2211 10.2080 10.2080 10.2653 10.2653 10.3992 10.3992 10.5003 10.5003 10.6088 10.6088 10.7362 10.7362 11.3224 11.3224 11.9991 11.9991 12.0101 12.0101 12.5684 12.5684 12.7857 12.7857 14.5162 14.5162 14.5822 14.5822 16.9750 16.9750 18.4940 18.4940 k = 0.2344 0.1351 1.0012 ( 3852 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5573 -35.5573 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0351 -8.0351 -7.6927 -7.6927 -7.6147 -7.6147 4.7875 4.7875 6.5034 6.5034 8.1939 8.1939 8.2139 8.2139 10.2088 10.2088 10.2660 10.2660 10.4218 10.4218 10.4741 10.4741 10.6102 10.6102 10.7321 10.7321 11.3269 11.3269 11.9994 11.9994 12.0099 12.0099 12.6190 12.6190 12.7318 12.7318 14.5306 14.5306 14.5711 14.5711 16.9701 16.9701 18.4950 18.4950 k = 0.2500 0.1441 1.0012 ( 3844 PWs) bands (ev): -64.9389 -64.9389 -64.9389 -64.9389 -35.5572 -35.5572 -35.5572 -35.5572 -31.7477 -31.7477 -31.7469 -31.7469 -31.5673 -31.5673 -31.5664 -31.5664 -26.6879 -26.6879 -8.0350 -8.0350 -7.6927 -7.6927 -7.6147 -7.6147 4.7875 4.7875 6.5034 6.5034 8.1990 8.1990 8.2088 8.2088 10.2091 10.2091 10.2662 10.2662 10.4427 10.4427 10.4521 10.4521 10.6108 10.6108 10.7306 10.7306 11.3284 11.3284 11.9994 11.9994 12.0100 12.0100 12.6565 12.6565 12.6932 12.6932 14.5375 14.5375 14.5652 14.5652 16.9685 16.9685 18.4954 18.4954 Writing output data file CaxSiRhx2.save init_run : 0.54s CPU 1.17s WALL ( 1 calls) electrons : 292.44s CPU 296.97s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.23s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 292.43s CPU 296.96s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.10s WALL ( 357 calls) cegterg : 267.54s CPU 270.30s WALL ( 424 calls) Called by sum_band: Called by *egterg: h_psi : 175.86s CPU 177.91s WALL ( 7507 calls) s_psi : 8.28s CPU 8.41s WALL ( 7507 calls) g_psi : 0.26s CPU 0.29s WALL ( 6726 calls) cdiaghg : 80.40s CPU 81.26s WALL ( 7083 calls) cegterg:over : 8.56s CPU 8.43s WALL ( 6726 calls) cegterg:upda : 7.29s CPU 7.37s WALL ( 6726 calls) cegterg:last : 3.64s CPU 3.71s WALL ( 1306 calls) cdiaghg:chol : 4.57s CPU 4.68s WALL ( 7083 calls) cdiaghg:inve : 3.42s CPU 3.39s WALL ( 7083 calls) cdiaghg:para : 5.77s CPU 5.88s WALL ( 14166 calls) Called by h_psi: h_psi:vloc : 157.80s CPU 159.90s WALL ( 7507 calls) h_psi:vnl : 17.80s CPU 17.71s WALL ( 7507 calls) add_vuspsi : 9.74s CPU 9.70s WALL ( 7507 calls) General routines calbec : 8.03s CPU 7.99s WALL ( 7507 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 147.90s CPU 150.04s WALL ( 1023872 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.25s WALL ( 714 calls) Parallel routines fft_scatter : 45.89s CPU 46.41s WALL ( 1023895 calls) PWSCF : 5m12.92s CPU 5m56.80s WALL This run was terminated on: 16:41:40 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=