Program PWSCF v.5.1.1 starts on 12Jun2016 at 12:46: 9 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./AlCuSe2.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 58 46 13 1410 958 147 Max 59 47 14 1413 977 148 Sum 2829 2211 627 67783 46397 7075 bravais-lattice index = 14 lattice parameter (alat) = 12.6291 a.u. unit-cell volume = 1100.4433 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 237.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.629104 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.665037 celldm(5)= -0.665037 celldm(6)= 0.330073 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.330073 0.943955 0.000000 ) a(3) = ( -0.665037 -0.471978 0.578760 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.349671 0.863916 ) b(2) = ( 0.000000 1.059372 0.863916 ) b(3) = ( 0.000000 0.000000 1.727831 ) PseudoPot. # 1 for Se read from file: /home/autes/Pseudo/Se_MT_PBE.UPF MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1211 points, 3 beta functions with: l(1) = 0 l(2) = 1 l(3) = 1 PseudoPot. # 2 for Cu read from file: /home/autes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Al read from file: /home/autes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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 Se 6.00 78.96000 Se( 1.00) Cu 11.00 63.54600 Cu( 1.00) Al 3.00 26.98150 Al( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) f =( 0.2500000 ) ( 0 1 0 ) ( -0.2500000 ) ( -1 -1 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 0.0000000 0.0000000 ) f =( -0.1650367 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.4719776 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.2893801 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 282 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0000000 0.0000000 0.0210711), wk = 0.0035461 k( 3) = ( 0.0000000 0.0000000 0.0421422), wk = 0.0035461 k( 4) = ( 0.0000000 0.0000000 0.0632134), wk = 0.0035461 k( 5) = ( 0.0000000 0.0000000 0.0842845), wk = 0.0035461 k( 6) = ( 0.0000000 0.0000000 0.1053556), wk = 0.0035461 k( 7) = ( 0.0000000 0.0000000 0.1264267), wk = 0.0035461 k( 8) = ( 0.0000000 0.0000000 0.1474978), wk = 0.0035461 k( 9) = ( 0.0000000 0.0000000 0.1685689), wk = 0.0035461 k( 10) = ( 0.0000000 0.0000000 0.1896400), wk = 0.0035461 k( 11) = ( 0.0000000 0.0000000 0.2107112), wk = 0.0035461 k( 12) = ( 0.0000000 0.0000000 0.2317823), wk = 0.0035461 k( 13) = ( 0.0000000 0.0000000 0.2528534), wk = 0.0035461 k( 14) = ( 0.0000000 0.0000000 0.2739245), wk = 0.0035461 k( 15) = ( 0.0000000 0.0000000 0.2949956), wk = 0.0035461 k( 16) = ( 0.0000000 0.0000000 0.3160667), wk = 0.0035461 k( 17) = ( 0.0000000 0.0000000 0.3371378), wk = 0.0035461 k( 18) = ( 0.0000000 0.0000000 0.3582090), wk = 0.0035461 k( 19) = ( 0.0000000 0.0000000 0.3792801), wk = 0.0035461 k( 20) = ( 0.0000000 0.0000000 0.4003512), wk = 0.0035461 k( 21) = ( 0.0000000 0.0000000 0.4214223), wk = 0.0035461 k( 22) = ( 0.0000000 0.0000000 0.4424934), wk = 0.0035461 k( 23) = ( 0.0000000 0.0000000 0.4635645), wk = 0.0035461 k( 24) = ( 0.0000000 0.0000000 0.4846356), wk = 0.0035461 k( 25) = ( 0.0000000 0.0000000 0.5057068), wk = 0.0035461 k( 26) = ( 0.0000000 0.0000000 0.5267779), wk = 0.0035461 k( 27) = ( 0.0000000 0.0000000 0.5478490), wk = 0.0035461 k( 28) = ( 0.0000000 0.0000000 0.5689201), wk = 0.0035461 k( 29) = ( 0.0000000 0.0000000 0.5899912), wk = 0.0035461 k( 30) = ( 0.0000000 0.0000000 0.6110623), wk = 0.0035461 k( 31) = ( 0.0000000 0.0000000 0.6321335), wk = 0.0035461 k( 32) = ( 0.0000000 0.0000000 0.6532046), wk = 0.0035461 k( 33) = ( 0.0000000 0.0000000 0.6742757), wk = 0.0035461 k( 34) = ( 0.0000000 0.0000000 0.6953468), wk = 0.0035461 k( 35) = ( 0.0000000 0.0000000 0.7164179), wk = 0.0035461 k( 36) = ( 0.0000000 0.0000000 0.7374890), wk = 0.0035461 k( 37) = ( 0.0000000 0.0000000 0.7585601), wk = 0.0035461 k( 38) = ( 0.0000000 0.0000000 0.7796313), wk = 0.0035461 k( 39) = ( 0.0000000 0.0000000 0.8007024), wk = 0.0035461 k( 40) = ( 0.0000000 0.0000000 0.8217735), wk = 0.0035461 k( 41) = ( 0.0000000 0.0000000 0.8428446), wk = 0.0035461 k( 42) = ( 0.0000000 0.0000000 0.8639157), wk = 0.0035461 k( 43) = ( 0.0000000 0.0000000 0.8639157), wk = 0.0035461 k( 44) = ( -0.0114472 0.0161296 0.8639157), wk = 0.0035461 k( 45) = ( -0.0228944 0.0322592 0.8639157), wk = 0.0035461 k( 46) = ( -0.0343416 0.0483888 0.8639157), wk = 0.0035461 k( 47) = ( -0.0457888 0.0645183 0.8639157), wk = 0.0035461 k( 48) = ( -0.0572360 0.0806479 0.8639157), wk = 0.0035461 k( 49) = ( -0.0686831 0.0967775 0.8639157), wk = 0.0035461 k( 50) = ( -0.0801304 0.1129071 0.8639157), wk = 0.0035461 k( 51) = ( -0.0915775 0.1290367 0.8639157), wk = 0.0035461 k( 52) = ( -0.1030247 0.1451663 0.8639157), wk = 0.0035461 k( 53) = ( -0.1144719 0.1612958 0.8639157), wk = 0.0035461 k( 54) = ( -0.1259191 0.1774254 0.8639157), wk = 0.0035461 k( 55) = ( -0.1259191 0.1774254 0.8639157), wk = 0.0035461 k( 56) = ( -0.1344210 0.1894049 0.8492260), wk = 0.0035461 k( 57) = ( -0.1429228 0.2013843 0.8345362), wk = 0.0035461 k( 58) = ( -0.1514246 0.2133638 0.8198465), wk = 0.0035461 k( 59) = ( -0.1599265 0.2253432 0.8051568), wk = 0.0035461 k( 60) = ( -0.1684283 0.2373227 0.7904670), wk = 0.0035461 k( 61) = ( -0.1769301 0.2493021 0.7757773), wk = 0.0035461 k( 62) = ( -0.1854320 0.2612816 0.7610875), wk = 0.0035461 k( 63) = ( -0.1939338 0.2732610 0.7463978), wk = 0.0035461 k( 64) = ( -0.2024357 0.2852405 0.7317080), wk = 0.0035461 k( 65) = ( -0.2109375 0.2972200 0.7170183), wk = 0.0035461 k( 66) = ( -0.2194393 0.3091994 0.7023285), wk = 0.0035461 k( 67) = ( -0.2279412 0.3211789 0.6876388), wk = 0.0035461 k( 68) = ( -0.2364430 0.3331583 0.6729491), wk = 0.0035461 k( 69) = ( -0.2449448 0.3451378 0.6582593), wk = 0.0035461 k( 70) = ( -0.2534467 0.3571172 0.6435696), wk = 0.0035461 k( 71) = ( -0.2619485 0.3690967 0.6288798), wk = 0.0035461 k( 72) = ( -0.2704504 0.3810761 0.6141901), wk = 0.0035461 k( 73) = ( -0.2789522 0.3930556 0.5995003), wk = 0.0035461 k( 74) = ( -0.2874540 0.4050350 0.5848106), wk = 0.0035461 k( 75) = ( -0.2959559 0.4170145 0.5701208), wk = 0.0035461 k( 76) = ( -0.3044577 0.4289939 0.5554311), wk = 0.0035461 k( 77) = ( -0.3129596 0.4409734 0.5407414), wk = 0.0035461 k( 78) = ( -0.3129596 0.4409734 0.5407414), wk = 0.0035461 k( 79) = ( -0.3042662 0.4287241 0.5257208), wk = 0.0035461 k( 80) = ( -0.2955729 0.4164749 0.5107002), wk = 0.0035461 k( 81) = ( -0.2868796 0.4042256 0.4956796), wk = 0.0035461 k( 82) = ( -0.2781863 0.3919764 0.4806590), wk = 0.0035461 k( 83) = ( -0.2694930 0.3797271 0.4656384), wk = 0.0035461 k( 84) = ( -0.2607996 0.3674778 0.4506178), wk = 0.0035461 k( 85) = ( -0.2521063 0.3552286 0.4355972), wk = 0.0035461 k( 86) = ( -0.2434130 0.3429793 0.4205766), wk = 0.0035461 k( 87) = ( -0.2347197 0.3307301 0.4055560), wk = 0.0035461 k( 88) = ( -0.2260263 0.3184808 0.3905354), wk = 0.0035461 k( 89) = ( -0.2173330 0.3062315 0.3755148), wk = 0.0035461 k( 90) = ( -0.2086397 0.2939823 0.3604942), wk = 0.0035461 k( 91) = ( -0.1999464 0.2817330 0.3454736), wk = 0.0035461 k( 92) = ( -0.1912531 0.2694837 0.3304531), wk = 0.0035461 k( 93) = ( -0.1825597 0.2572345 0.3154325), wk = 0.0035461 k( 94) = ( -0.1738664 0.2449852 0.3004119), wk = 0.0035461 k( 95) = ( -0.1651731 0.2327360 0.2853913), wk = 0.0035461 k( 96) = ( -0.1564798 0.2204867 0.2703707), wk = 0.0035461 k( 97) = ( -0.1477865 0.2082374 0.2553501), wk = 0.0035461 k( 98) = ( -0.1390931 0.1959882 0.2403295), wk = 0.0035461 k( 99) = ( -0.1303998 0.1837389 0.2253089), wk = 0.0035461 k( 100) = ( -0.1217065 0.1714896 0.2102883), wk = 0.0035461 k( 101) = ( -0.1130132 0.1592404 0.1952677), wk = 0.0035461 k( 102) = ( -0.1043199 0.1469911 0.1802471), wk = 0.0035461 k( 103) = ( -0.0956265 0.1347419 0.1652265), wk = 0.0035461 k( 104) = ( -0.0869332 0.1224926 0.1502059), wk = 0.0035461 k( 105) = ( -0.0782399 0.1102434 0.1351853), wk = 0.0035461 k( 106) = ( -0.0695466 0.0979941 0.1201648), wk = 0.0035461 k( 107) = ( -0.0608532 0.0857448 0.1051442), wk = 0.0035461 k( 108) = ( -0.0521599 0.0734956 0.0901236), wk = 0.0035461 k( 109) = ( -0.0434666 0.0612463 0.0751030), wk = 0.0035461 k( 110) = ( -0.0347733 0.0489970 0.0600824), wk = 0.0035461 k( 111) = ( -0.0260800 0.0367478 0.0450618), wk = 0.0035461 k( 112) = ( -0.0173866 0.0244985 0.0300412), wk = 0.0035461 k( 113) = ( -0.0086933 0.0122493 0.0150206), wk = 0.0035461 k( 114) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 116) = ( 0.0172414 0.0122362 0.0000000), wk = 0.0035461 k( 117) = ( 0.0344828 0.0244725 0.0000000), wk = 0.0035461 k( 118) = ( 0.0517241 0.0367087 0.0000000), wk = 0.0035461 k( 119) = ( 0.0689655 0.0489449 0.0000000), wk = 0.0035461 k( 120) = ( 0.0862069 0.0611812 0.0000000), wk = 0.0035461 k( 121) = ( 0.1034483 0.0734174 0.0000000), wk = 0.0035461 k( 122) = ( 0.1206897 0.0856537 0.0000000), wk = 0.0035461 k( 123) = ( 0.1379310 0.0978899 0.0000000), wk = 0.0035461 k( 124) = ( 0.1551724 0.1101261 0.0000000), wk = 0.0035461 k( 125) = ( 0.1724138 0.1223624 0.0000000), wk = 0.0035461 k( 126) = ( 0.1896552 0.1345986 0.0000000), wk = 0.0035461 k( 127) = ( 0.2068966 0.1468348 0.0000000), wk = 0.0035461 k( 128) = ( 0.2241379 0.1590711 0.0000000), wk = 0.0035461 k( 129) = ( 0.2413793 0.1713073 0.0000000), wk = 0.0035461 k( 130) = ( 0.2586207 0.1835435 0.0000000), wk = 0.0035461 k( 131) = ( 0.2758621 0.1957798 0.0000000), wk = 0.0035461 k( 132) = ( 0.2931034 0.2080160 0.0000000), wk = 0.0035461 k( 133) = ( 0.3103448 0.2202522 0.0000000), wk = 0.0035461 k( 134) = ( 0.3275862 0.2324885 0.0000000), wk = 0.0035461 k( 135) = ( 0.3448276 0.2447247 0.0000000), wk = 0.0035461 k( 136) = ( 0.3620690 0.2569610 0.0000000), wk = 0.0035461 k( 137) = ( 0.3793103 0.2691972 0.0000000), wk = 0.0035461 k( 138) = ( 0.3965517 0.2814334 0.0000000), wk = 0.0035461 k( 139) = ( 0.4137931 0.2936697 0.0000000), wk = 0.0035461 k( 140) = ( 0.4310345 0.3059059 0.0000000), wk = 0.0035461 k( 141) = ( 0.4482759 0.3181421 0.0000000), wk = 0.0035461 k( 142) = ( 0.4655172 0.3303784 0.0000000), wk = 0.0035461 k( 143) = ( 0.4827586 0.3426146 0.0000000), wk = 0.0035461 k( 144) = ( 0.5000000 0.3548508 0.0000000), wk = 0.0035461 k( 145) = ( 0.5000000 0.3548508 0.0000000), wk = 0.0035461 k( 146) = ( 0.4914982 0.3668303 0.0146897), wk = 0.0035461 k( 147) = ( 0.4829963 0.3788097 0.0293795), wk = 0.0035461 k( 148) = ( 0.4744945 0.3907892 0.0440692), wk = 0.0035461 k( 149) = ( 0.4659927 0.4027686 0.0587590), wk = 0.0035461 k( 150) = ( 0.4574908 0.4147481 0.0734487), wk = 0.0035461 k( 151) = ( 0.4489890 0.4267276 0.0881385), wk = 0.0035461 k( 152) = ( 0.4404871 0.4387070 0.1028282), wk = 0.0035461 k( 153) = ( 0.4319853 0.4506865 0.1175180), wk = 0.0035461 k( 154) = ( 0.4234835 0.4626659 0.1322077), wk = 0.0035461 k( 155) = ( 0.4149816 0.4746454 0.1468974), wk = 0.0035461 k( 156) = ( 0.4064798 0.4866248 0.1615872), wk = 0.0035461 k( 157) = ( 0.3979779 0.4986043 0.1762769), wk = 0.0035461 k( 158) = ( 0.3894761 0.5105837 0.1909667), wk = 0.0035461 k( 159) = ( 0.3809743 0.5225632 0.2056564), wk = 0.0035461 k( 160) = ( 0.3724724 0.5345426 0.2203461), wk = 0.0035461 k( 161) = ( 0.3639706 0.5465221 0.2350359), wk = 0.0035461 k( 162) = ( 0.3554688 0.5585015 0.2497256), wk = 0.0035461 k( 163) = ( 0.3469669 0.5704810 0.2644154), wk = 0.0035461 k( 164) = ( 0.3384651 0.5824605 0.2791051), wk = 0.0035461 k( 165) = ( 0.3299632 0.5944399 0.2937949), wk = 0.0035461 k( 166) = ( 0.3214614 0.6064194 0.3084846), wk = 0.0035461 k( 167) = ( 0.3129596 0.6183988 0.3231744), wk = 0.0035461 k( 168) = ( 0.3129596 0.6183988 0.3231744), wk = 0.0035461 k( 169) = ( 0.2945502 0.6131804 0.3295734), wk = 0.0035461 k( 170) = ( 0.2761408 0.6079620 0.3359724), wk = 0.0035461 k( 171) = ( 0.2577314 0.6027436 0.3423715), wk = 0.0035461 k( 172) = ( 0.2393220 0.5975252 0.3487705), wk = 0.0035461 k( 173) = ( 0.2209126 0.5923068 0.3551695), wk = 0.0035461 k( 174) = ( 0.2025032 0.5870885 0.3615685), wk = 0.0035461 k( 175) = ( 0.1840939 0.5818701 0.3679676), wk = 0.0035461 k( 176) = ( 0.1656845 0.5766517 0.3743666), wk = 0.0035461 k( 177) = ( 0.1472751 0.5714333 0.3807656), wk = 0.0035461 k( 178) = ( 0.1288657 0.5662149 0.3871647), wk = 0.0035461 k( 179) = ( 0.1104563 0.5609965 0.3935637), wk = 0.0035461 k( 180) = ( 0.0920469 0.5557781 0.3999627), wk = 0.0035461 k( 181) = ( 0.0736375 0.5505597 0.4063617), wk = 0.0035461 k( 182) = ( 0.0552282 0.5453413 0.4127608), wk = 0.0035461 k( 183) = ( 0.0368188 0.5401229 0.4191598), wk = 0.0035461 k( 184) = ( 0.0184094 0.5349045 0.4255588), wk = 0.0035461 k( 185) = ( 0.0000000 0.5296861 0.4319579), wk = 0.0035461 k( 186) = ( 0.0000000 0.5296861 0.4319579), wk = 0.0035461 k( 187) = ( 0.0086207 0.5175392 0.4468530), wk = 0.0035461 k( 188) = ( 0.0172414 0.5053923 0.4617481), wk = 0.0035461 k( 189) = ( 0.0258621 0.4932453 0.4766432), wk = 0.0035461 k( 190) = ( 0.0344828 0.4810984 0.4915383), wk = 0.0035461 k( 191) = ( 0.0431035 0.4689515 0.5064334), wk = 0.0035461 k( 192) = ( 0.0517241 0.4568046 0.5213285), wk = 0.0035461 k( 193) = ( 0.0603448 0.4446577 0.5362236), wk = 0.0035461 k( 194) = ( 0.0689655 0.4325107 0.5511187), wk = 0.0035461 k( 195) = ( 0.0775862 0.4203638 0.5660138), wk = 0.0035461 k( 196) = ( 0.0862069 0.4082169 0.5809089), wk = 0.0035461 k( 197) = ( 0.0948276 0.3960700 0.5958040), wk = 0.0035461 k( 198) = ( 0.1034483 0.3839231 0.6106991), wk = 0.0035461 k( 199) = ( 0.1120690 0.3717761 0.6255942), wk = 0.0035461 k( 200) = ( 0.1206897 0.3596292 0.6404893), wk = 0.0035461 k( 201) = ( 0.1293103 0.3474823 0.6553843), wk = 0.0035461 k( 202) = ( 0.1379310 0.3353354 0.6702794), wk = 0.0035461 k( 203) = ( 0.1465517 0.3231885 0.6851745), wk = 0.0035461 k( 204) = ( 0.1551724 0.3110415 0.7000696), wk = 0.0035461 k( 205) = ( 0.1637931 0.2988946 0.7149647), wk = 0.0035461 k( 206) = ( 0.1724138 0.2867477 0.7298598), wk = 0.0035461 k( 207) = ( 0.1810345 0.2746008 0.7447549), wk = 0.0035461 k( 208) = ( 0.1896552 0.2624539 0.7596500), wk = 0.0035461 k( 209) = ( 0.1982759 0.2503069 0.7745451), wk = 0.0035461 k( 210) = ( 0.2068966 0.2381600 0.7894402), wk = 0.0035461 k( 211) = ( 0.2155172 0.2260131 0.8043353), wk = 0.0035461 k( 212) = ( 0.2241379 0.2138662 0.8192304), wk = 0.0035461 k( 213) = ( 0.2327586 0.2017193 0.8341255), wk = 0.0035461 k( 214) = ( 0.2413793 0.1895723 0.8490206), wk = 0.0035461 k( 215) = ( 0.2500000 0.1774254 0.8639157), wk = 0.0035461 k( 216) = ( 0.2500000 0.1774254 0.8639157), wk = 0.0035461 k( 217) = ( 0.2638889 0.1872824 0.8518287), wk = 0.0035461 k( 218) = ( 0.2777778 0.1971394 0.8397416), wk = 0.0035461 k( 219) = ( 0.2916667 0.2069963 0.8276546), wk = 0.0035461 k( 220) = ( 0.3055556 0.2168533 0.8155675), wk = 0.0035461 k( 221) = ( 0.3194444 0.2267103 0.8034804), wk = 0.0035461 k( 222) = ( 0.3333333 0.2365672 0.7913934), wk = 0.0035461 k( 223) = ( 0.3472222 0.2464242 0.7793063), wk = 0.0035461 k( 224) = ( 0.3611111 0.2562812 0.7672193), wk = 0.0035461 k( 225) = ( 0.3750000 0.2661381 0.7551322), wk = 0.0035461 k( 226) = ( 0.3888889 0.2759951 0.7430452), wk = 0.0035461 k( 227) = ( 0.4027778 0.2858521 0.7309581), wk = 0.0035461 k( 228) = ( 0.4166667 0.2957090 0.7188711), wk = 0.0035461 k( 229) = ( 0.4305556 0.3055660 0.7067840), wk = 0.0035461 k( 230) = ( 0.4444444 0.3154230 0.6946969), wk = 0.0035461 k( 231) = ( 0.4583333 0.3252799 0.6826099), wk = 0.0035461 k( 232) = ( 0.4722222 0.3351369 0.6705228), wk = 0.0035461 k( 233) = ( 0.4861111 0.3449939 0.6584358), wk = 0.0035461 k( 234) = ( 0.5000000 0.3548508 0.6463487), wk = 0.0035461 k( 235) = ( 0.5000000 0.3548508 0.6463487), wk = 0.0035461 k( 236) = ( 0.5000000 0.3548508 0.6254988), wk = 0.0035461 k( 237) = ( 0.5000000 0.3548508 0.6046488), wk = 0.0035461 k( 238) = ( 0.5000000 0.3548508 0.5837988), wk = 0.0035461 k( 239) = ( 0.5000000 0.3548508 0.5629489), wk = 0.0035461 k( 240) = ( 0.5000000 0.3548508 0.5420989), wk = 0.0035461 k( 241) = ( 0.5000000 0.3548508 0.5212490), wk = 0.0035461 k( 242) = ( 0.5000000 0.3548508 0.5003990), wk = 0.0035461 k( 243) = ( 0.5000000 0.3548508 0.4795490), wk = 0.0035461 k( 244) = ( 0.5000000 0.3548508 0.4586991), wk = 0.0035461 k( 245) = ( 0.5000000 0.3548508 0.4378491), wk = 0.0035461 k( 246) = ( 0.5000000 0.3548508 0.4169992), wk = 0.0035461 k( 247) = ( 0.5000000 0.3548508 0.3961492), wk = 0.0035461 k( 248) = ( 0.5000000 0.3548508 0.3752993), wk = 0.0035461 k( 249) = ( 0.5000000 0.3548508 0.3544493), wk = 0.0035461 k( 250) = ( 0.5000000 0.3548508 0.3335993), wk = 0.0035461 k( 251) = ( 0.5000000 0.3548508 0.3127494), wk = 0.0035461 k( 252) = ( 0.5000000 0.3548508 0.2918994), wk = 0.0035461 k( 253) = ( 0.5000000 0.3548508 0.2710495), wk = 0.0035461 k( 254) = ( 0.5000000 0.3548508 0.2501995), wk = 0.0035461 k( 255) = ( 0.5000000 0.3548508 0.2293495), wk = 0.0035461 k( 256) = ( 0.5000000 0.3548508 0.2084996), wk = 0.0035461 k( 257) = ( 0.5000000 0.3548508 0.1876496), wk = 0.0035461 k( 258) = ( 0.5000000 0.3548508 0.1667997), wk = 0.0035461 k( 259) = ( 0.5000000 0.3548508 0.1459497), wk = 0.0035461 k( 260) = ( 0.5000000 0.3548508 0.1250997), wk = 0.0035461 k( 261) = ( 0.5000000 0.3548508 0.1042498), wk = 0.0035461 k( 262) = ( 0.5000000 0.3548508 0.0833998), wk = 0.0035461 k( 263) = ( 0.5000000 0.3548508 0.0625499), wk = 0.0035461 k( 264) = ( 0.5000000 0.3548508 0.0416999), wk = 0.0035461 k( 265) = ( 0.5000000 0.3548508 0.0208500), wk = 0.0035461 k( 266) = ( 0.5000000 0.3548508 0.0000000), wk = 0.0035461 k( 267) = ( 0.0000000 0.0000000 0.8639157), wk = 0.0035461 k( 268) = ( 0.0166667 0.0118284 0.8639157), wk = 0.0035461 k( 269) = ( 0.0333333 0.0236567 0.8639157), wk = 0.0035461 k( 270) = ( 0.0500000 0.0354851 0.8639157), wk = 0.0035461 k( 271) = ( 0.0666667 0.0473134 0.8639157), wk = 0.0035461 k( 272) = ( 0.0833333 0.0591418 0.8639157), wk = 0.0035461 k( 273) = ( 0.1000000 0.0709702 0.8639157), wk = 0.0035461 k( 274) = ( 0.1166667 0.0827985 0.8639157), wk = 0.0035461 k( 275) = ( 0.1333333 0.0946269 0.8639157), wk = 0.0035461 k( 276) = ( 0.1500000 0.1064553 0.8639157), wk = 0.0035461 k( 277) = ( 0.1666667 0.1182836 0.8639157), wk = 0.0035461 k( 278) = ( 0.1833333 0.1301120 0.8639157), wk = 0.0035461 k( 279) = ( 0.2000000 0.1419403 0.8639157), wk = 0.0035461 k( 280) = ( 0.2166667 0.1537687 0.8639157), wk = 0.0035461 k( 281) = ( 0.2333333 0.1655971 0.8639157), wk = 0.0035461 k( 282) = ( 0.2500000 0.1774254 0.8639157), wk = 0.0035461 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0000000 0.0000000 0.0121951), wk = 0.0035461 k( 3) = ( 0.0000000 0.0000000 0.0243902), wk = 0.0035461 k( 4) = ( 0.0000000 0.0000000 0.0365854), wk = 0.0035461 k( 5) = ( 0.0000000 0.0000000 0.0487805), wk = 0.0035461 k( 6) = ( 0.0000000 0.0000000 0.0609756), wk = 0.0035461 k( 7) = ( 0.0000000 0.0000000 0.0731707), wk = 0.0035461 k( 8) = ( 0.0000000 0.0000000 0.0853659), wk = 0.0035461 k( 9) = ( 0.0000000 0.0000000 0.0975610), wk = 0.0035461 k( 10) = ( 0.0000000 0.0000000 0.1097561), wk = 0.0035461 k( 11) = ( 0.0000000 0.0000000 0.1219512), wk = 0.0035461 k( 12) = ( 0.0000000 0.0000000 0.1341463), wk = 0.0035461 k( 13) = ( 0.0000000 0.0000000 0.1463415), wk = 0.0035461 k( 14) = ( 0.0000000 0.0000000 0.1585366), wk = 0.0035461 k( 15) = ( 0.0000000 0.0000000 0.1707317), wk = 0.0035461 k( 16) = ( 0.0000000 0.0000000 0.1829268), wk = 0.0035461 k( 17) = ( 0.0000000 0.0000000 0.1951220), wk = 0.0035461 k( 18) = ( 0.0000000 0.0000000 0.2073171), wk = 0.0035461 k( 19) = ( 0.0000000 0.0000000 0.2195122), wk = 0.0035461 k( 20) = ( 0.0000000 0.0000000 0.2317073), wk = 0.0035461 k( 21) = ( 0.0000000 0.0000000 0.2439024), wk = 0.0035461 k( 22) = ( 0.0000000 0.0000000 0.2560976), wk = 0.0035461 k( 23) = ( 0.0000000 0.0000000 0.2682927), wk = 0.0035461 k( 24) = ( 0.0000000 0.0000000 0.2804878), wk = 0.0035461 k( 25) = ( 0.0000000 0.0000000 0.2926829), wk = 0.0035461 k( 26) = ( 0.0000000 0.0000000 0.3048781), wk = 0.0035461 k( 27) = ( 0.0000000 0.0000000 0.3170732), wk = 0.0035461 k( 28) = ( 0.0000000 0.0000000 0.3292683), wk = 0.0035461 k( 29) = ( 0.0000000 0.0000000 0.3414634), wk = 0.0035461 k( 30) = ( 0.0000000 0.0000000 0.3536585), wk = 0.0035461 k( 31) = ( 0.0000000 0.0000000 0.3658537), wk = 0.0035461 k( 32) = ( 0.0000000 0.0000000 0.3780488), wk = 0.0035461 k( 33) = ( 0.0000000 0.0000000 0.3902439), wk = 0.0035461 k( 34) = ( 0.0000000 0.0000000 0.4024390), wk = 0.0035461 k( 35) = ( 0.0000000 0.0000000 0.4146342), wk = 0.0035461 k( 36) = ( 0.0000000 0.0000000 0.4268293), wk = 0.0035461 k( 37) = ( 0.0000000 0.0000000 0.4390244), wk = 0.0035461 k( 38) = ( 0.0000000 0.0000000 0.4512195), wk = 0.0035461 k( 39) = ( 0.0000000 0.0000000 0.4634146), wk = 0.0035461 k( 40) = ( 0.0000000 0.0000000 0.4756098), wk = 0.0035461 k( 41) = ( 0.0000000 0.0000000 0.4878049), wk = 0.0035461 k( 42) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 43) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 44) = ( -0.0114472 0.0114472 0.5000000), wk = 0.0035461 k( 45) = ( -0.0228944 0.0228944 0.5000000), wk = 0.0035461 k( 46) = ( -0.0343416 0.0343416 0.5000000), wk = 0.0035461 k( 47) = ( -0.0457888 0.0457888 0.5000000), wk = 0.0035461 k( 48) = ( -0.0572360 0.0572360 0.5000000), wk = 0.0035461 k( 49) = ( -0.0686831 0.0686831 0.5000000), wk = 0.0035461 k( 50) = ( -0.0801304 0.0801304 0.5000000), wk = 0.0035461 k( 51) = ( -0.0915775 0.0915775 0.5000000), wk = 0.0035461 k( 52) = ( -0.1030247 0.1030247 0.5000000), wk = 0.0035461 k( 53) = ( -0.1144719 0.1144719 0.5000000), wk = 0.0035461 k( 54) = ( -0.1259191 0.1259191 0.5000000), wk = 0.0035461 k( 55) = ( -0.1259191 0.1259191 0.5000000), wk = 0.0035461 k( 56) = ( -0.1344210 0.1344210 0.4914982), wk = 0.0035461 k( 57) = ( -0.1429228 0.1429228 0.4829963), wk = 0.0035461 k( 58) = ( -0.1514246 0.1514246 0.4744945), wk = 0.0035461 k( 59) = ( -0.1599265 0.1599265 0.4659927), wk = 0.0035461 k( 60) = ( -0.1684283 0.1684283 0.4574908), wk = 0.0035461 k( 61) = ( -0.1769301 0.1769301 0.4489890), wk = 0.0035461 k( 62) = ( -0.1854320 0.1854320 0.4404871), wk = 0.0035461 k( 63) = ( -0.1939338 0.1939338 0.4319853), wk = 0.0035461 k( 64) = ( -0.2024357 0.2024357 0.4234835), wk = 0.0035461 k( 65) = ( -0.2109375 0.2109375 0.4149816), wk = 0.0035461 k( 66) = ( -0.2194393 0.2194393 0.4064798), wk = 0.0035461 k( 67) = ( -0.2279412 0.2279412 0.3979779), wk = 0.0035461 k( 68) = ( -0.2364430 0.2364430 0.3894761), wk = 0.0035461 k( 69) = ( -0.2449448 0.2449449 0.3809743), wk = 0.0035461 k( 70) = ( -0.2534467 0.2534467 0.3724724), wk = 0.0035461 k( 71) = ( -0.2619485 0.2619485 0.3639706), wk = 0.0035461 k( 72) = ( -0.2704504 0.2704504 0.3554688), wk = 0.0035461 k( 73) = ( -0.2789522 0.2789522 0.3469669), wk = 0.0035461 k( 74) = ( -0.2874540 0.2874540 0.3384651), wk = 0.0035461 k( 75) = ( -0.2959559 0.2959559 0.3299632), wk = 0.0035461 k( 76) = ( -0.3044577 0.3044577 0.3214614), wk = 0.0035461 k( 77) = ( -0.3129596 0.3129596 0.3129596), wk = 0.0035461 k( 78) = ( -0.3129596 0.3129596 0.3129596), wk = 0.0035461 k( 79) = ( -0.3042662 0.3042662 0.3042662), wk = 0.0035461 k( 80) = ( -0.2955729 0.2955729 0.2955729), wk = 0.0035461 k( 81) = ( -0.2868796 0.2868796 0.2868796), wk = 0.0035461 k( 82) = ( -0.2781863 0.2781863 0.2781863), wk = 0.0035461 k( 83) = ( -0.2694930 0.2694930 0.2694930), wk = 0.0035461 k( 84) = ( -0.2607996 0.2607996 0.2607996), wk = 0.0035461 k( 85) = ( -0.2521063 0.2521063 0.2521063), wk = 0.0035461 k( 86) = ( -0.2434130 0.2434130 0.2434130), wk = 0.0035461 k( 87) = ( -0.2347197 0.2347197 0.2347197), wk = 0.0035461 k( 88) = ( -0.2260263 0.2260263 0.2260263), wk = 0.0035461 k( 89) = ( -0.2173330 0.2173330 0.2173330), wk = 0.0035461 k( 90) = ( -0.2086397 0.2086397 0.2086397), wk = 0.0035461 k( 91) = ( -0.1999464 0.1999464 0.1999464), wk = 0.0035461 k( 92) = ( -0.1912531 0.1912531 0.1912531), wk = 0.0035461 k( 93) = ( -0.1825597 0.1825597 0.1825597), wk = 0.0035461 k( 94) = ( -0.1738664 0.1738664 0.1738664), wk = 0.0035461 k( 95) = ( -0.1651731 0.1651731 0.1651731), wk = 0.0035461 k( 96) = ( -0.1564798 0.1564798 0.1564798), wk = 0.0035461 k( 97) = ( -0.1477865 0.1477865 0.1477865), wk = 0.0035461 k( 98) = ( -0.1390931 0.1390931 0.1390931), wk = 0.0035461 k( 99) = ( -0.1303998 0.1303998 0.1303998), wk = 0.0035461 k( 100) = ( -0.1217065 0.1217065 0.1217065), wk = 0.0035461 k( 101) = ( -0.1130132 0.1130132 0.1130132), wk = 0.0035461 k( 102) = ( -0.1043199 0.1043199 0.1043199), wk = 0.0035461 k( 103) = ( -0.0956265 0.0956265 0.0956265), wk = 0.0035461 k( 104) = ( -0.0869332 0.0869332 0.0869332), wk = 0.0035461 k( 105) = ( -0.0782399 0.0782399 0.0782399), wk = 0.0035461 k( 106) = ( -0.0695466 0.0695466 0.0695466), wk = 0.0035461 k( 107) = ( -0.0608532 0.0608532 0.0608533), wk = 0.0035461 k( 108) = ( -0.0521599 0.0521599 0.0521599), wk = 0.0035461 k( 109) = ( -0.0434666 0.0434666 0.0434666), wk = 0.0035461 k( 110) = ( -0.0347733 0.0347733 0.0347733), wk = 0.0035461 k( 111) = ( -0.0260800 0.0260800 0.0260800), wk = 0.0035461 k( 112) = ( -0.0173866 0.0173866 0.0173866), wk = 0.0035461 k( 113) = ( -0.0086933 0.0086933 0.0086933), wk = 0.0035461 k( 114) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 116) = ( 0.0172414 0.0172414 -0.0172414), wk = 0.0035461 k( 117) = ( 0.0344828 0.0344828 -0.0344828), wk = 0.0035461 k( 118) = ( 0.0517241 0.0517241 -0.0517241), wk = 0.0035461 k( 119) = ( 0.0689655 0.0689655 -0.0689655), wk = 0.0035461 k( 120) = ( 0.0862069 0.0862069 -0.0862069), wk = 0.0035461 k( 121) = ( 0.1034483 0.1034483 -0.1034483), wk = 0.0035461 k( 122) = ( 0.1206897 0.1206897 -0.1206897), wk = 0.0035461 k( 123) = ( 0.1379310 0.1379310 -0.1379310), wk = 0.0035461 k( 124) = ( 0.1551724 0.1551724 -0.1551724), wk = 0.0035461 k( 125) = ( 0.1724138 0.1724138 -0.1724138), wk = 0.0035461 k( 126) = ( 0.1896552 0.1896552 -0.1896552), wk = 0.0035461 k( 127) = ( 0.2068966 0.2068966 -0.2068966), wk = 0.0035461 k( 128) = ( 0.2241379 0.2241379 -0.2241379), wk = 0.0035461 k( 129) = ( 0.2413793 0.2413793 -0.2413793), wk = 0.0035461 k( 130) = ( 0.2586207 0.2586207 -0.2586207), wk = 0.0035461 k( 131) = ( 0.2758621 0.2758621 -0.2758621), wk = 0.0035461 k( 132) = ( 0.2931034 0.2931034 -0.2931034), wk = 0.0035461 k( 133) = ( 0.3103448 0.3103448 -0.3103448), wk = 0.0035461 k( 134) = ( 0.3275862 0.3275862 -0.3275862), wk = 0.0035461 k( 135) = ( 0.3448276 0.3448276 -0.3448276), wk = 0.0035461 k( 136) = ( 0.3620690 0.3620690 -0.3620690), wk = 0.0035461 k( 137) = ( 0.3793103 0.3793103 -0.3793103), wk = 0.0035461 k( 138) = ( 0.3965517 0.3965517 -0.3965517), wk = 0.0035461 k( 139) = ( 0.4137931 0.4137931 -0.4137931), wk = 0.0035461 k( 140) = ( 0.4310345 0.4310345 -0.4310345), wk = 0.0035461 k( 141) = ( 0.4482759 0.4482759 -0.4482759), wk = 0.0035461 k( 142) = ( 0.4655172 0.4655172 -0.4655172), wk = 0.0035461 k( 143) = ( 0.4827586 0.4827586 -0.4827586), wk = 0.0035461 k( 144) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 145) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 146) = ( 0.4914982 0.5085018 -0.4914982), wk = 0.0035461 k( 147) = ( 0.4829963 0.5170037 -0.4829963), wk = 0.0035461 k( 148) = ( 0.4744945 0.5255055 -0.4744945), wk = 0.0035461 k( 149) = ( 0.4659927 0.5340073 -0.4659927), wk = 0.0035461 k( 150) = ( 0.4574908 0.5425092 -0.4574908), wk = 0.0035461 k( 151) = ( 0.4489890 0.5510110 -0.4489890), wk = 0.0035461 k( 152) = ( 0.4404871 0.5595129 -0.4404871), wk = 0.0035461 k( 153) = ( 0.4319853 0.5680147 -0.4319853), wk = 0.0035461 k( 154) = ( 0.4234835 0.5765165 -0.4234835), wk = 0.0035461 k( 155) = ( 0.4149816 0.5850184 -0.4149816), wk = 0.0035461 k( 156) = ( 0.4064798 0.5935202 -0.4064798), wk = 0.0035461 k( 157) = ( 0.3979779 0.6020221 -0.3979779), wk = 0.0035461 k( 158) = ( 0.3894761 0.6105239 -0.3894761), wk = 0.0035461 k( 159) = ( 0.3809743 0.6190257 -0.3809743), wk = 0.0035461 k( 160) = ( 0.3724724 0.6275276 -0.3724724), wk = 0.0035461 k( 161) = ( 0.3639706 0.6360294 -0.3639706), wk = 0.0035461 k( 162) = ( 0.3554688 0.6445312 -0.3554688), wk = 0.0035461 k( 163) = ( 0.3469669 0.6530331 -0.3469669), wk = 0.0035461 k( 164) = ( 0.3384651 0.6615349 -0.3384651), wk = 0.0035461 k( 165) = ( 0.3299632 0.6700368 -0.3299632), wk = 0.0035461 k( 166) = ( 0.3214614 0.6785386 -0.3214614), wk = 0.0035461 k( 167) = ( 0.3129596 0.6870404 -0.3129596), wk = 0.0035461 k( 168) = ( 0.3129596 0.6870404 -0.3129596), wk = 0.0035461 k( 169) = ( 0.2945502 0.6760381 -0.2945502), wk = 0.0035461 k( 170) = ( 0.2761408 0.6650357 -0.2761408), wk = 0.0035461 k( 171) = ( 0.2577314 0.6540333 -0.2577314), wk = 0.0035461 k( 172) = ( 0.2393220 0.6430309 -0.2393220), wk = 0.0035461 k( 173) = ( 0.2209126 0.6320286 -0.2209126), wk = 0.0035461 k( 174) = ( 0.2025032 0.6210262 -0.2025032), wk = 0.0035461 k( 175) = ( 0.1840939 0.6100238 -0.1840939), wk = 0.0035461 k( 176) = ( 0.1656845 0.5990214 -0.1656845), wk = 0.0035461 k( 177) = ( 0.1472751 0.5880190 -0.1472751), wk = 0.0035461 k( 178) = ( 0.1288657 0.5770167 -0.1288657), wk = 0.0035461 k( 179) = ( 0.1104563 0.5660143 -0.1104563), wk = 0.0035461 k( 180) = ( 0.0920469 0.5550119 -0.0920469), wk = 0.0035461 k( 181) = ( 0.0736375 0.5440095 -0.0736375), wk = 0.0035461 k( 182) = ( 0.0552282 0.5330071 -0.0552282), wk = 0.0035461 k( 183) = ( 0.0368188 0.5220048 -0.0368188), wk = 0.0035461 k( 184) = ( 0.0184094 0.5110024 -0.0184094), wk = 0.0035461 k( 185) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035461 k( 186) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0035461 k( 187) = ( 0.0086207 0.4913793 0.0086207), wk = 0.0035461 k( 188) = ( 0.0172414 0.4827586 0.0172414), wk = 0.0035461 k( 189) = ( 0.0258621 0.4741379 0.0258621), wk = 0.0035461 k( 190) = ( 0.0344828 0.4655172 0.0344828), wk = 0.0035461 k( 191) = ( 0.0431035 0.4568966 0.0431035), wk = 0.0035461 k( 192) = ( 0.0517241 0.4482759 0.0517241), wk = 0.0035461 k( 193) = ( 0.0603448 0.4396552 0.0603448), wk = 0.0035461 k( 194) = ( 0.0689655 0.4310345 0.0689655), wk = 0.0035461 k( 195) = ( 0.0775862 0.4224138 0.0775862), wk = 0.0035461 k( 196) = ( 0.0862069 0.4137931 0.0862069), wk = 0.0035461 k( 197) = ( 0.0948276 0.4051724 0.0948276), wk = 0.0035461 k( 198) = ( 0.1034483 0.3965517 0.1034483), wk = 0.0035461 k( 199) = ( 0.1120690 0.3879310 0.1120690), wk = 0.0035461 k( 200) = ( 0.1206897 0.3793103 0.1206897), wk = 0.0035461 k( 201) = ( 0.1293103 0.3706897 0.1293103), wk = 0.0035461 k( 202) = ( 0.1379310 0.3620690 0.1379310), wk = 0.0035461 k( 203) = ( 0.1465517 0.3534483 0.1465517), wk = 0.0035461 k( 204) = ( 0.1551724 0.3448276 0.1551724), wk = 0.0035461 k( 205) = ( 0.1637931 0.3362069 0.1637931), wk = 0.0035461 k( 206) = ( 0.1724138 0.3275862 0.1724138), wk = 0.0035461 k( 207) = ( 0.1810345 0.3189655 0.1810345), wk = 0.0035461 k( 208) = ( 0.1896552 0.3103448 0.1896552), wk = 0.0035461 k( 209) = ( 0.1982759 0.3017241 0.1982759), wk = 0.0035461 k( 210) = ( 0.2068966 0.2931034 0.2068966), wk = 0.0035461 k( 211) = ( 0.2155172 0.2844828 0.2155172), wk = 0.0035461 k( 212) = ( 0.2241379 0.2758621 0.2241379), wk = 0.0035461 k( 213) = ( 0.2327586 0.2672414 0.2327586), wk = 0.0035461 k( 214) = ( 0.2413793 0.2586207 0.2413793), wk = 0.0035461 k( 215) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 k( 216) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 k( 217) = ( 0.2638889 0.2638889 0.2291156), wk = 0.0035461 k( 218) = ( 0.2777778 0.2777778 0.2082312), wk = 0.0035461 k( 219) = ( 0.2916667 0.2916667 0.1873468), wk = 0.0035461 k( 220) = ( 0.3055556 0.3055556 0.1664624), wk = 0.0035461 k( 221) = ( 0.3194444 0.3194444 0.1455780), wk = 0.0035461 k( 222) = ( 0.3333333 0.3333333 0.1246936), wk = 0.0035461 k( 223) = ( 0.3472222 0.3472222 0.1038092), wk = 0.0035461 k( 224) = ( 0.3611111 0.3611111 0.0829248), wk = 0.0035461 k( 225) = ( 0.3750000 0.3750000 0.0620404), wk = 0.0035461 k( 226) = ( 0.3888889 0.3888889 0.0411561), wk = 0.0035461 k( 227) = ( 0.4027778 0.4027778 0.0202717), wk = 0.0035461 k( 228) = ( 0.4166667 0.4166667 -0.0006127), wk = 0.0035461 k( 229) = ( 0.4305556 0.4305556 -0.0214971), wk = 0.0035461 k( 230) = ( 0.4444444 0.4444444 -0.0423815), wk = 0.0035461 k( 231) = ( 0.4583333 0.4583333 -0.0632659), wk = 0.0035461 k( 232) = ( 0.4722222 0.4722222 -0.0841503), wk = 0.0035461 k( 233) = ( 0.4861111 0.4861111 -0.1050347), wk = 0.0035461 k( 234) = ( 0.5000000 0.5000000 -0.1259191), wk = 0.0035461 k( 235) = ( 0.5000000 0.5000000 -0.1259191), wk = 0.0035461 k( 236) = ( 0.5000000 0.5000000 -0.1379862), wk = 0.0035461 k( 237) = ( 0.5000000 0.5000000 -0.1500534), wk = 0.0035461 k( 238) = ( 0.5000000 0.5000000 -0.1621205), wk = 0.0035461 k( 239) = ( 0.5000000 0.5000000 -0.1741876), wk = 0.0035461 k( 240) = ( 0.5000000 0.5000000 -0.1862547), wk = 0.0035461 k( 241) = ( 0.5000000 0.5000000 -0.1983219), wk = 0.0035461 k( 242) = ( 0.5000000 0.5000000 -0.2103890), wk = 0.0035461 k( 243) = ( 0.5000000 0.5000000 -0.2224561), wk = 0.0035461 k( 244) = ( 0.5000000 0.5000000 -0.2345232), wk = 0.0035461 k( 245) = ( 0.5000000 0.5000000 -0.2465904), wk = 0.0035461 k( 246) = ( 0.5000000 0.5000000 -0.2586575), wk = 0.0035461 k( 247) = ( 0.5000000 0.5000000 -0.2707246), wk = 0.0035461 k( 248) = ( 0.5000000 0.5000000 -0.2827917), wk = 0.0035461 k( 249) = ( 0.5000000 0.5000000 -0.2948589), wk = 0.0035461 k( 250) = ( 0.5000000 0.5000000 -0.3069260), wk = 0.0035461 k( 251) = ( 0.5000000 0.5000000 -0.3189931), wk = 0.0035461 k( 252) = ( 0.5000000 0.5000000 -0.3310602), wk = 0.0035461 k( 253) = ( 0.5000000 0.5000000 -0.3431274), wk = 0.0035461 k( 254) = ( 0.5000000 0.5000000 -0.3551945), wk = 0.0035461 k( 255) = ( 0.5000000 0.5000000 -0.3672616), wk = 0.0035461 k( 256) = ( 0.5000000 0.5000000 -0.3793287), wk = 0.0035461 k( 257) = ( 0.5000000 0.5000000 -0.3913959), wk = 0.0035461 k( 258) = ( 0.5000000 0.5000000 -0.4034630), wk = 0.0035461 k( 259) = ( 0.5000000 0.5000000 -0.4155301), wk = 0.0035461 k( 260) = ( 0.5000000 0.5000000 -0.4275972), wk = 0.0035461 k( 261) = ( 0.5000000 0.5000000 -0.4396644), wk = 0.0035461 k( 262) = ( 0.5000000 0.5000000 -0.4517315), wk = 0.0035461 k( 263) = ( 0.5000000 0.5000000 -0.4637986), wk = 0.0035461 k( 264) = ( 0.5000000 0.5000000 -0.4758657), wk = 0.0035461 k( 265) = ( 0.5000000 0.5000000 -0.4879329), wk = 0.0035461 k( 266) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0035461 k( 267) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035461 k( 268) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0035461 k( 269) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0035461 k( 270) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0035461 k( 271) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0035461 k( 272) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0035461 k( 273) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0035461 k( 274) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0035461 k( 275) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0035461 k( 276) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0035461 k( 277) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0035461 k( 278) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0035461 k( 279) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0035461 k( 280) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0035461 k( 281) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0035461 k( 282) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035461 Dense grid: 67783 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 46397 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.25 Mb ( 264, 62) NL pseudopotentials 0.33 Mb ( 132, 164) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1412) G-vector shells 0.01 Mb ( 672) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.00 Mb ( 264, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.31 Mb ( 164, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./AlCuSe2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.9 secs Computing kpt #: 2 total cpu time spent up to now is 49.7 secs Computing kpt #: 3 total cpu time spent up to now is 53.4 secs Computing kpt #: 4 total cpu time spent up to now is 57.2 secs Computing kpt #: 5 total cpu time spent up to now is 61.1 secs Computing kpt #: 6 total cpu time spent up to now is 65.2 secs Computing kpt #: 7 total cpu time spent up to now is 69.2 secs Computing kpt #: 8 total cpu time spent up to now is 73.1 secs Computing kpt #: 9 total cpu time spent up to now is 77.0 secs Computing kpt #: 10 total cpu time spent up to now is 81.4 secs Computing kpt #: 11 total cpu time spent up to now is 85.4 secs Computing kpt #: 12 total cpu time spent up to now is 89.4 secs Computing kpt #: 13 total cpu time spent up to now is 93.6 secs Computing kpt #: 14 total cpu time spent up to now is 98.1 secs Computing kpt #: 15 total cpu time spent up to now is 102.4 secs Computing kpt #: 16 total cpu time spent up to now is 106.7 secs Computing kpt #: 17 total cpu time spent up to now is 112.4 secs Computing kpt #: 18 total cpu time spent up to now is 117.5 secs Computing kpt #: 19 total cpu time spent up to now is 122.2 secs Computing kpt #: 20 total cpu time spent up to now is 125.8 secs Computing kpt #: 21 total cpu time spent up to now is 129.3 secs Computing kpt #: 22 total cpu time spent up to now is 132.9 secs Computing kpt #: 23 total cpu time spent up to now is 136.6 secs Computing kpt #: 24 total cpu time spent up to now is 140.0 secs Computing kpt #: 25 total cpu time spent up to now is 143.6 secs Computing kpt #: 26 total cpu time spent up to now is 147.2 secs Computing kpt #: 27 total cpu time spent up to now is 150.6 secs Computing kpt #: 28 total cpu time spent up to now is 154.2 secs Computing kpt #: 29 total cpu time spent up to now is 157.7 secs Computing kpt #: 30 total cpu time spent up to now is 161.2 secs Computing kpt #: 31 total cpu time spent up to now is 164.9 secs Computing kpt #: 32 total cpu time spent up to now is 168.4 secs Computing kpt #: 33 total cpu time spent up to now is 172.3 secs Computing kpt #: 34 total cpu time spent up to now is 177.0 secs Computing kpt #: 35 total cpu time spent up to now is 183.1 secs Computing kpt #: 36 total cpu time spent up to now is 186.8 secs Computing kpt #: 37 total cpu time spent up to now is 190.4 secs Computing kpt #: 38 total cpu time spent up to now is 193.9 secs Computing kpt #: 39 total cpu time spent up to now is 197.5 secs Computing kpt #: 40 total cpu time spent up to now is 201.2 secs Computing kpt #: 41 total cpu time spent up to now is 205.2 secs Computing kpt #: 42 total cpu time spent up to now is 209.4 secs Computing kpt #: 43 total cpu time spent up to now is 213.6 secs Computing kpt #: 44 total cpu time spent up to now is 217.5 secs Computing kpt #: 45 total cpu time spent up to now is 221.9 secs Computing kpt #: 46 total cpu time spent up to now is 226.2 secs Computing kpt #: 47 total cpu time spent up to now is 230.2 secs Computing kpt #: 48 total cpu time spent up to now is 234.4 secs Computing kpt #: 49 total cpu time spent up to now is 239.1 secs Computing kpt #: 50 total cpu time spent up to now is 243.3 secs Computing kpt #: 51 total cpu time spent up to now is 248.0 secs Computing kpt #: 52 total cpu time spent up to now is 253.0 secs Computing kpt #: 53 total cpu time spent up to now is 257.8 secs Computing kpt #: 54 total cpu time spent up to now is 262.5 secs Computing kpt #: 55 total cpu time spent up to now is 267.2 secs Computing kpt #: 56 total cpu time spent up to now is 272.0 secs Computing kpt #: 57 total cpu time spent up to now is 277.5 secs Computing kpt #: 58 total cpu time spent up to now is 283.7 secs Computing kpt #: 59 total cpu time spent up to now is 288.5 secs Computing kpt #: 60 total cpu time spent up 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Computing kpt #: 76 total cpu time spent up to now is 360.8 secs Computing kpt #: 77 total cpu time spent up to now is 368.0 secs Computing kpt #: 78 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 375.5 secs Computing kpt #: 79 total cpu time spent up to now is 380.1 secs Computing kpt #: 80 total cpu time spent up to now is 384.7 secs Computing kpt #: 81 total cpu time spent up to now is 389.0 secs Computing kpt #: 82 total cpu time spent up to now is 392.9 secs Computing kpt #: 83 total cpu time spent up to now is 396.7 secs Computing kpt #: 84 total cpu time spent up to now is 400.2 secs Computing kpt #: 85 total cpu time spent up to now is 404.2 secs Computing kpt #: 86 total cpu time spent up to now is 407.6 secs Computing kpt #: 87 total cpu time spent up to now is 411.1 secs Computing kpt #: 88 total cpu time spent up to now is 414.6 secs Computing kpt #: 89 total cpu time spent up to now is 418.0 secs Computing kpt #: 90 total cpu time spent up to now is 422.1 secs Computing kpt #: 91 total cpu time spent up to now is 425.7 secs Computing kpt #: 92 total cpu time spent up to now is 429.3 secs Computing kpt #: 93 total cpu time spent up to now is 433.2 secs Computing kpt #: 94 total cpu time spent up to now is 437.3 secs Computing kpt #: 95 total cpu time spent up to now is 440.8 secs Computing kpt #: 96 total cpu time spent up to now is 444.6 secs Computing kpt #: 97 total cpu time spent up to now is 448.4 secs Computing kpt #: 98 total cpu time spent up to now is 452.4 secs Computing kpt #: 99 total cpu time spent up to now is 457.1 secs Computing kpt #: 100 total cpu time spent up to now is 462.2 secs Computing kpt #: 101 total cpu time spent up to now is 466.8 secs Computing kpt #: 102 total cpu time spent up to now is 471.5 secs Computing kpt #: 103 total cpu time spent up to now is 476.8 secs Computing kpt #: 104 total cpu time spent up to now is 481.7 secs Computing kpt #: 105 total cpu time spent up to now is 486.2 secs Computing kpt #: 106 total cpu time spent up to now is 490.3 secs Computing kpt #: 107 total cpu time spent up to now is 494.4 secs Computing kpt #: 108 total cpu time spent up to now is 498.2 secs Computing kpt #: 109 total cpu time spent up to now is 502.0 secs Computing kpt #: 110 total cpu time spent up to now is 505.6 secs Computing kpt #: 111 total cpu time spent up to now is 509.3 secs Computing kpt #: 112 total cpu time spent up to now is 513.1 secs Computing kpt #: 113 total cpu time spent up to now is 516.9 secs Computing kpt #: 114 total cpu time spent up to now is 520.5 secs Computing kpt #: 115 total cpu time spent up to now is 524.3 secs Computing kpt #: 116 total cpu time spent up to now is 528.2 secs Computing kpt #: 117 total cpu time spent up to now is 531.9 secs Computing kpt #: 118 total cpu time spent up to now is 535.8 secs Computing kpt #: 119 total cpu time spent up to now is 539.8 secs Computing kpt #: 120 total cpu time spent up to now is 543.2 secs Computing 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total cpu time spent up to now is 599.5 secs Computing kpt #: 137 total cpu time spent up to now is 603.4 secs Computing kpt #: 138 total cpu time spent up to now is 607.3 secs Computing kpt #: 139 total cpu time spent up to now is 611.5 secs Computing kpt #: 140 total cpu time spent up to now is 615.4 secs Computing kpt #: 141 total cpu time spent up to now is 619.3 secs Computing kpt #: 142 total cpu time spent up to now is 623.1 secs Computing kpt #: 143 total cpu time spent up to now is 627.0 secs Computing kpt #: 144 total cpu time spent up to now is 630.8 secs Computing kpt #: 145 total cpu time spent up to now is 634.5 secs Computing kpt #: 146 total cpu time spent up to now is 639.0 secs Computing kpt #: 147 total cpu time spent up to now is 643.7 secs Computing kpt #: 148 total cpu time spent up to now is 648.3 secs Computing kpt #: 149 total cpu time spent up to now is 652.9 secs Computing kpt #: 150 total cpu time spent up to now is 657.7 secs Computing kpt #: 151 total cpu 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Computing kpt #: 166 total cpu time spent up to now is 742.5 secs Computing kpt #: 167 total cpu time spent up to now is 750.1 secs Computing kpt #: 168 total cpu time spent up to now is 756.8 secs Computing kpt #: 169 total cpu time spent up to now is 762.4 secs Computing kpt #: 170 total cpu time spent up to now is 768.4 secs Computing kpt #: 171 total cpu time spent up to now is 773.7 secs Computing kpt #: 172 total cpu time spent up to now is 781.3 secs Computing kpt #: 173 total cpu time spent up to now is 785.9 secs Computing kpt #: 174 total cpu time spent up to now is 790.9 secs Computing kpt #: 175 total cpu time spent up to now is 795.7 secs Computing kpt #: 176 total cpu time spent up to now is 799.9 secs Computing kpt #: 177 total cpu time spent up to now is 804.7 secs Computing kpt #: 178 total cpu time spent up to now is 809.3 secs Computing kpt #: 179 total cpu time spent up to now is 813.9 secs Computing kpt #: 180 total cpu time spent up to now is 818.7 secs Computing kpt #: 181 total cpu time spent up to now is 824.3 secs Computing kpt #: 182 total cpu time spent up to now is 829.6 secs Computing kpt #: 183 total cpu time spent up to now is 834.5 secs Computing kpt #: 184 total cpu time spent up to now is 839.7 secs Computing kpt #: 185 total cpu time spent up to now is 844.7 secs Computing kpt #: 186 total cpu time spent up to now is 849.2 secs Computing kpt #: 187 total cpu time spent up to now is 854.3 secs Computing kpt #: 188 total cpu time spent up to now is 859.3 secs Computing kpt #: 189 total cpu time spent up to now is 864.2 secs Computing kpt #: 190 total cpu time spent up to now is 869.5 secs Computing kpt #: 191 total cpu time spent up to now is 875.3 secs Computing kpt #: 192 total cpu time spent up to now is 883.0 secs Computing kpt #: 193 total cpu time spent up to now is 888.7 secs Computing kpt #: 194 total cpu time spent up to now is 893.6 secs Computing kpt #: 195 total cpu time spent up to now is 898.1 secs Computing kpt #: 196 total cpu time spent up to now is 903.2 secs Computing kpt #: 197 total cpu time spent up to now is 907.4 secs Computing kpt #: 198 total cpu time spent up to now is 912.0 secs Computing kpt #: 199 total cpu time spent up to now is 916.9 secs Computing kpt #: 200 total cpu time spent up to now is 921.1 secs Computing kpt #: 201 total cpu time spent up to now is 925.1 secs Computing kpt #: 202 total cpu time spent up to now is 929.3 secs Computing kpt #: 203 total cpu time spent up to now is 934.0 secs Computing kpt #: 204 total cpu time spent up to now is 938.0 secs Computing kpt #: 205 total cpu time spent up to now is 942.5 secs Computing kpt #: 206 total cpu time spent up to now is 946.6 secs Computing kpt #: 207 total cpu time spent up to now is 950.9 secs Computing kpt #: 208 total cpu time spent up to now is 955.2 secs Computing kpt #: 209 total cpu time spent up to now is 959.2 secs Computing kpt #: 210 total cpu time spent up to now is 963.1 secs Computing kpt #: 211 total cpu 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secs Computing kpt #: 226 total cpu time spent up to now is 1032.1 secs Computing kpt #: 227 total cpu time spent up to now is 1036.7 secs Computing kpt #: 228 total cpu time spent up to now is 1041.4 secs Computing kpt #: 229 total cpu time spent up to now is 1045.2 secs Computing kpt #: 230 total cpu time spent up to now is 1050.1 secs Computing kpt #: 231 total cpu time spent up to now is 1054.7 secs Computing kpt #: 232 total cpu time spent up to now is 1060.9 secs Computing kpt #: 233 total cpu time spent up to now is 1066.8 secs Computing kpt #: 234 total cpu time spent up to now is 1071.8 secs Computing kpt #: 235 total cpu time spent up to now is 1078.4 secs Computing kpt #: 236 total cpu time spent up to now is 1083.9 secs Computing kpt #: 237 total cpu time spent up to now is 1088.8 secs Computing kpt #: 238 total cpu time spent up to now is 1092.5 secs Computing kpt #: 239 total cpu time spent up to now is 1096.6 secs Computing kpt #: 240 total cpu time spent up to now is 1101.7 secs Computing kpt #: 241 total cpu time spent up to now is 1106.9 secs Computing kpt #: 242 total cpu time spent up to now is 1110.9 secs Computing kpt #: 243 total cpu time spent up to now is 1116.1 secs Computing kpt #: 244 total cpu time spent up to now is 1119.9 secs Computing kpt #: 245 total cpu time spent up to now is 1124.6 secs Computing kpt #: 246 total cpu time spent up to now is 1129.5 secs Computing kpt #: 247 total cpu time spent up to now is 1133.9 secs Computing kpt #: 248 total cpu time spent up to now is 1138.7 secs Computing kpt #: 249 total cpu time spent up to now is 1143.2 secs Computing kpt #: 250 total cpu time spent up to now is 1148.6 secs Computing kpt #: 251 total cpu time spent up to now is 1153.3 secs Computing kpt #: 252 total cpu time spent up to now is 1157.9 secs Computing kpt #: 253 total cpu time spent up to now is 1162.4 secs Computing kpt #: 254 total cpu time spent up to now is 1167.4 secs Computing kpt #: 255 total cpu time spent up to now is 1171.8 secs Computing kpt #: 256 total cpu time spent up to now is 1176.3 secs Computing kpt #: 257 total cpu time spent up to now is 1181.0 secs Computing kpt #: 258 total cpu time spent up to now is 1185.6 secs Computing kpt #: 259 total cpu time spent up to now is 1190.2 secs Computing kpt #: 260 total cpu time spent up to now is 1194.8 secs Computing kpt #: 261 total cpu time spent up to now is 1199.6 secs Computing kpt #: 262 total cpu time spent up to now is 1204.4 secs Computing kpt #: 263 total cpu time spent up to now is 1209.6 secs Computing kpt #: 264 total cpu time spent up to now is 1214.1 secs Computing kpt #: 265 total cpu time spent up to now is 1219.1 secs Computing kpt #: 266 total cpu time spent up to now is 1222.9 secs Computing kpt #: 267 total cpu time spent up to now is 1227.2 secs Computing kpt #: 268 total cpu time spent up to now is 1231.5 secs Computing kpt #: 269 total cpu time spent up to now is 1235.4 secs Computing kpt #: 270 total cpu time spent up to now is 1239.8 secs Computing kpt #: 271 total cpu time spent up to now is 1244.4 secs Computing kpt #: 272 total cpu time spent up to now is 1248.8 secs Computing kpt #: 273 total cpu time spent up to now is 1253.1 secs Computing kpt #: 274 total cpu time spent up to now is 1257.4 secs Computing kpt #: 275 total cpu time spent up to now is 1261.7 secs Computing kpt #: 276 total cpu time spent up to now is 1266.1 secs Computing kpt #: 277 total cpu time spent up to now is 1270.4 secs Computing kpt #: 278 total cpu time spent up to now is 1276.0 secs Computing kpt #: 279 total cpu time spent up to now is 1281.9 secs Computing kpt #: 280 total cpu time spent up to now is 1287.9 secs Computing kpt #: 281 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1295.2 secs Computing kpt #: 282 total cpu time spent up to now is 1299.4 secs ethr = 1.92E-11, avg # of iterations = 42.9 total cpu time spent up to now is 1299.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5783 PWs) bands (ev): -7.7287 -7.7287 -6.3043 -6.3043 -6.3009 -6.3009 -6.2976 -6.2976 -0.0066 -0.0066 1.0537 1.0537 1.6709 1.6709 1.9726 1.9726 2.1249 2.1249 2.5947 2.5947 2.6375 2.6375 3.2290 3.2290 3.3549 3.3549 3.4260 3.4260 3.5210 3.5210 3.5517 3.5517 4.7054 4.7054 4.7856 4.7856 4.8873 4.8873 5.1507 5.1507 5.1849 5.1849 5.2861 5.2861 5.3228 5.3228 6.7485 6.7485 6.8704 6.8704 6.9729 6.9729 8.2758 8.2758 8.6293 8.6293 9.7260 9.7260 11.0323 11.0323 11.0372 11.0372 k = 0.0000 0.0000 0.0211 ( 5783 PWs) bands (ev): -7.7279 -7.7279 -6.3044 -6.3042 -6.3015 -6.3014 -6.2982 -6.2982 -0.0062 -0.0055 1.0500 1.0563 1.6661 1.6745 1.9714 1.9714 2.1224 2.1245 2.5950 2.5999 2.6385 2.6430 3.2270 3.2297 3.3523 3.3547 3.4241 3.4265 3.5188 3.5216 3.5495 3.5548 4.7050 4.7065 4.7783 4.7939 4.8859 4.8892 5.1376 5.1585 5.1789 5.1935 5.2733 5.3001 5.3195 5.3277 6.7424 6.7464 6.8636 6.8665 6.9682 6.9726 8.2862 8.2874 8.6334 8.6351 9.7291 9.7323 11.0306 11.0309 11.0353 11.0378 k = 0.0000 0.0000 0.0421 ( 5787 PWs) bands (ev): -7.7255 -7.7254 -6.3050 -6.3046 -6.3027 -6.3027 -6.3001 -6.3001 -0.0042 -0.0027 1.0452 1.0578 1.6599 1.6765 1.9681 1.9682 2.1177 2.1214 2.6004 2.6096 2.6458 2.6550 3.2235 3.2290 3.3473 3.3521 3.4206 3.4256 3.5149 3.5209 3.5486 3.5589 4.7051 4.7082 4.7723 4.8030 4.8852 4.8918 5.1225 5.1591 5.1721 5.2067 5.2617 5.3150 5.3181 5.3339 6.7263 6.7349 6.8475 6.8545 6.9591 6.9672 8.3177 8.3200 8.6472 8.6506 9.7417 9.7481 11.0252 11.0271 11.0326 11.0362 k = 0.0000 0.0000 0.0632 ( 5807 PWs) bands (ev): -7.7214 -7.7214 -6.3072 -6.3070 -6.3035 -6.3032 -6.3031 -6.3030 -0.0006 0.0016 1.0393 1.0579 1.6520 1.6762 1.9636 1.9645 2.1119 2.1163 2.6094 2.6220 2.6593 2.6733 3.2186 3.2272 3.3403 3.3473 3.4149 3.4228 3.5095 3.5193 3.5490 3.5638 4.7058 4.7107 4.7675 4.8129 4.8852 4.8949 5.1071 5.1544 5.1634 5.2226 5.2514 5.3179 5.3315 5.3412 6.6972 6.7099 6.8280 6.8395 6.9467 6.9575 8.3675 8.3709 8.6701 8.6751 9.7641 9.7737 11.0169 11.0215 11.0286 11.0323 k = 0.0000 0.0000 0.0843 ( 5801 PWs) bands (ev): -7.7157 -7.7157 -6.3111 -6.3111 -6.3073 -6.3073 -6.3036 -6.3029 0.0044 0.0074 1.0320 1.0562 1.6420 1.6724 1.9594 1.9622 2.1065 2.1107 2.6192 2.6347 2.6787 2.6971 3.2123 3.2246 3.3321 3.3411 3.4064 3.4174 3.5033 3.5173 3.5509 3.5698 4.7070 4.7141 4.7641 4.8235 4.8860 4.8986 5.0919 5.1467 5.1529 5.2342 5.2477 5.3199 5.3486 5.3496 6.6538 6.6686 6.8109 6.8258 6.9315 6.9441 8.4321 8.4366 8.7008 8.7075 9.7967 9.8096 11.0063 11.0141 11.0232 11.0262 k = 0.0000 0.0000 0.1054 ( 5793 PWs) bands (ev): -7.7085 -7.7085 -6.3164 -6.3163 -6.3126 -6.3126 -6.3036 -6.3027 0.0109 0.0147 1.0230 1.0524 1.6295 1.6644 1.9568 1.9634 2.1032 2.1060 2.6271 2.6455 2.7036 2.7255 3.2053 3.2217 3.3234 3.3341 3.3943 3.4085 3.4974 3.5157 3.5542 3.5766 4.7088 4.7185 4.7622 4.8346 4.8876 4.9028 5.0773 5.1372 5.1411 5.2280 5.2630 5.3237 5.3592 5.3665 6.5983 6.6133 6.7975 6.8144 6.9137 6.9275 8.5076 8.5134 8.7382 8.7464 9.8400 9.8563 10.9937 11.0053 11.0163 11.0181 k = 0.0000 0.0000 0.1264 ( 5797 PWs) bands (ev): -7.6996 -7.6996 -6.3228 -6.3227 -6.3191 -6.3190 -6.3036 -6.3024 0.0186 0.0232 1.0120 1.0460 1.6143 1.6514 1.9569 1.9695 2.1036 2.1036 2.6309 2.6518 2.7328 2.7574 3.1987 3.2191 3.3147 3.3271 3.3780 3.3950 3.4928 3.5148 3.5586 3.5844 4.7109 4.7242 4.7617 4.8462 4.8900 4.9075 5.0633 5.1267 5.1284 5.2187 5.2820 5.3291 5.3698 5.3851 6.5344 6.5489 6.7856 6.8044 6.8938 6.9082 8.5910 8.5981 8.7806 8.7903 9.8947 9.9142 10.9793 10.9952 11.0084 11.0084 k = 0.0000 0.0000 0.1475 ( 5801 PWs) bands (ev): -7.6892 -7.6892 -6.3304 -6.3301 -6.3266 -6.3264 -6.3035 -6.3022 0.0274 0.0329 0.9989 1.0366 1.5965 1.6336 1.9604 1.9811 2.1049 2.1087 2.6288 2.6516 2.7652 2.7915 3.1937 3.2179 3.3064 3.3207 3.3573 3.3769 3.4901 3.5151 3.5642 3.5929 4.7134 4.7311 4.7625 4.8581 4.8933 4.9126 5.0501 5.1156 5.1157 5.2090 5.3018 5.3361 5.3818 5.4043 6.4657 6.4796 6.7732 6.7942 6.8724 6.8866 8.6795 8.6880 8.8265 8.8375 9.9610 9.9839 10.9636 10.9840 10.9974 10.9996 k = 0.0000 0.0000 0.1686 ( 5805 PWs) bands (ev): -7.6772 -7.6772 -6.3390 -6.3386 -6.3351 -6.3348 -6.3036 -6.3020 0.0372 0.0435 0.9832 1.0239 1.5765 1.6118 1.9678 1.9980 2.1110 2.1193 2.6192 2.6430 2.7997 2.8270 3.1919 3.2190 3.2980 3.3152 3.3324 3.3550 3.4891 3.5164 3.5709 3.6021 4.7161 4.7396 4.7647 4.8702 4.8977 4.9182 5.0380 5.1034 5.1047 5.1994 5.3217 5.3445 5.3951 5.4239 6.3950 6.4084 6.7585 6.7823 6.8509 6.8641 8.7709 8.7809 8.8745 8.8867 10.0394 10.0656 10.9467 10.9717 10.9858 10.9904 k = 0.0000 0.0000 0.1896 ( 5803 PWs) bands (ev): -7.6637 -7.6637 -6.3485 -6.3480 -6.3445 -6.3441 -6.3037 -6.3020 0.0477 0.0550 0.9650 1.0077 1.5549 1.5873 1.9793 2.0193 2.1230 2.1356 2.6014 2.6250 2.8352 2.8630 3.1943 3.2228 3.2879 3.3027 3.3115 3.3315 3.4895 3.5188 3.5784 3.6117 4.7191 4.7495 4.7681 4.8822 4.9031 4.9241 5.0271 5.0923 5.0941 5.1898 5.3418 5.3546 5.4098 5.4438 6.3243 6.3373 6.7396 6.7668 6.8307 6.8424 8.8634 8.8750 8.9235 8.9365 10.1296 10.1590 10.9290 10.9582 10.9741 10.9811 k = 0.0000 0.0000 0.2107 ( 5808 PWs) bands (ev): -7.6487 -7.6487 -6.3589 -6.3582 -6.3547 -6.3542 -6.3040 -6.3021 0.0588 0.0670 0.9441 0.9880 1.5326 1.5611 1.9950 2.0438 2.1416 2.1572 2.5754 2.5978 2.8712 2.8989 3.2009 3.2292 3.2708 3.2715 3.3080 3.3118 3.4912 3.5221 3.5867 3.6215 4.7223 4.7605 4.7732 4.8936 4.9099 4.9302 5.0175 5.0830 5.0840 5.1804 5.3619 5.3661 5.4259 5.4638 6.2551 6.2679 6.7154 6.7458 6.8132 6.8236 8.9556 8.9686 8.9729 8.9863 10.2312 10.2639 10.9108 10.9437 10.9629 10.9720 k = 0.0000 0.0000 0.2318 ( 5808 PWs) bands (ev): -7.6322 -7.6322 -6.3701 -6.3693 -6.3657 -6.3650 -6.3045 -6.3024 0.0703 0.0794 0.9208 0.9650 1.5103 1.5343 2.0146 2.0703 2.1671 2.1835 2.5418 2.5627 2.9069 2.9340 3.2094 3.2278 3.2458 3.2466 3.3006 3.3061 3.4938 3.5263 3.5956 3.6312 4.7255 4.7704 4.7818 4.9036 4.9180 4.9365 5.0095 5.0747 5.0763 5.1714 5.3792 5.3821 5.4433 5.4838 6.1885 6.2013 6.6861 6.7184 6.7984 6.8085 9.0210 9.0346 9.0470 9.0618 10.3429 10.3790 10.8925 10.9281 10.9527 10.9634 k = 0.0000 0.0000 0.2529 ( 5804 PWs) bands (ev): -7.6143 -7.6143 -6.3821 -6.3812 -6.3773 -6.3766 -6.3052 -6.3030 0.0818 0.0919 0.8950 0.9389 1.4887 1.5078 2.0379 2.0980 2.1995 2.2129 2.5017 2.5221 2.9419 2.9676 3.1931 3.2011 3.2350 3.2534 3.2948 3.3058 3.4972 3.5314 3.6048 3.6406 4.7289 4.7775 4.7956 4.9113 4.9277 4.9427 5.0033 5.0667 5.0731 5.1629 5.3939 5.4023 5.4617 5.5035 6.1253 6.1384 6.6527 6.6860 6.7859 6.7964 9.0688 9.0828 9.1351 9.1523 10.4629 10.5029 10.8748 10.9117 10.9438 10.9557 k = 0.0000 0.0000 0.2739 ( 5804 PWs) bands (ev): -7.5950 -7.5950 -6.3947 -6.3937 -6.3896 -6.3887 -6.3063 -6.3039 0.0932 0.1041 0.8672 0.9101 1.4685 1.4823 2.0641 2.1264 2.2377 2.2424 2.4566 2.4800 2.9754 2.9988 3.1534 3.1682 3.2472 3.2648 3.2917 3.3076 3.5013 3.5372 3.6142 3.6495 4.7322 4.7835 4.8124 4.9162 4.9384 4.9485 4.9990 5.0601 5.0743 5.1550 5.4099 5.4227 5.4809 5.5226 6.0665 6.0799 6.6164 6.6501 6.7746 6.7860 9.1159 9.1299 9.2205 9.2398 10.5865 10.6326 10.8602 10.8955 10.9363 10.9492 k = 0.0000 0.0000 0.2950 ( 5804 PWs) bands (ev): -7.5743 -7.5743 -6.4079 -6.4068 -6.4023 -6.4014 -6.3077 -6.3052 0.1041 0.1159 0.8375 0.8792 1.4503 1.4585 2.0921 2.1549 2.2647 2.2802 2.4087 2.4450 3.0064 3.0250 3.1137 3.1339 3.2627 3.2751 3.2909 3.3123 3.5061 3.5438 3.6235 3.6574 4.7357 4.7894 4.8309 4.9181 4.9499 4.9537 4.9962 5.0554 5.0810 5.1482 5.4274 5.4435 5.5002 5.5407 6.0125 6.0265 6.5783 6.6121 6.7641 6.7765 9.1623 9.1760 9.3022 9.3238 10.6988 10.7580 10.8613 10.8865 10.9304 10.9440 k = 0.0000 0.0000 0.3161 ( 5790 PWs) bands (ev): -7.5523 -7.5522 -6.4216 -6.4204 -6.4155 -6.4144 -6.3096 -6.3069 0.1143 0.1270 0.8064 0.8465 1.4345 1.4369 2.1204 2.1826 2.2642 2.3178 2.3674 2.4336 3.0297 3.0380 3.0806 3.1101 3.2764 3.2830 3.2941 3.3208 3.5116 3.5510 3.6326 3.6642 4.7391 4.7953 4.8504 4.9172 4.9581 4.9623 4.9943 5.0527 5.0934 5.1429 5.4462 5.4647 5.5194 5.5575 5.9638 5.9785 6.5397 6.5731 6.7539 6.7674 9.2082 9.2216 9.3797 9.4036 10.7488 10.8165 10.9247 10.9261 10.9406 10.9425 k = 0.0000 0.0000 0.3371 ( 5786 PWs) bands (ev): -7.5291 -7.5289 -6.4356 -6.4344 -6.4289 -6.4278 -6.3120 -6.3092 0.1235 0.1370 0.7742 0.8124 1.4176 1.4217 2.1466 2.2079 2.2344 2.2927 2.3910 2.4541 3.0195 3.0242 3.0811 3.1117 3.2842 3.2888 3.3044 3.3320 3.5177 3.5589 3.6411 3.6697 4.7425 4.8012 4.8699 4.9142 4.9615 4.9751 4.9933 5.0521 5.1109 5.1397 5.4662 5.4862 5.5376 5.5722 5.9211 5.9364 6.5013 6.5342 6.7439 6.7584 9.2538 9.2668 9.4524 9.4788 10.7397 10.8009 10.9243 10.9387 11.0402 11.0582 k = 0.0000 0.0000 0.3582 ( 5796 PWs) bands (ev): -7.5046 -7.5044 -6.4500 -6.4487 -6.4426 -6.4415 -6.3149 -6.3120 0.1316 0.1458 0.7411 0.7775 1.4011 1.4121 2.1605 2.1966 2.2288 2.2420 2.4432 2.4936 2.9900 2.9972 3.1029 3.1268 3.2895 3.2941 3.3182 3.3441 3.5244 3.5672 3.6489 3.6735 4.7459 4.8070 4.8884 4.9099 4.9640 4.9859 4.9952 5.0530 5.1327 5.1398 5.4870 5.5081 5.5545 5.5844 5.8848 5.9006 6.4640 6.4961 6.7339 6.7493 9.2994 9.3118 9.5200 9.5489 10.7127 10.7698 10.9242 10.9388 11.1054 11.1348 k = 0.0000 0.0000 0.3793 ( 5792 PWs) bands (ev): -7.4789 -7.4787 -6.4646 -6.4632 -6.4564 -6.4553 -6.3185 -6.3155 0.1383 0.1532 0.7075 0.7420 1.3872 1.4059 2.1231 2.1899 2.1981 2.2429 2.4999 2.5420 2.9642 2.9718 3.1250 3.1422 3.2963 3.3002 3.3319 3.3562 3.5315 3.5760 3.6559 3.6757 4.7494 4.8127 4.9049 4.9050 4.9664 4.9887 5.0060 5.0546 5.1446 5.1584 5.5087 5.5300 5.5696 5.5936 5.8552 5.8712 6.4289 6.4600 6.7238 6.7402 9.3451 9.3569 9.5820 9.6134 10.6768 10.7301 10.9262 10.9407 11.0804 11.1142 k = 0.0000 0.0000 0.4004 ( 5800 PWs) bands (ev): -7.4522 -7.4519 -6.4793 -6.4779 -6.4703 -6.4692 -6.3228 -6.3197 0.1436 0.1589 0.6736 0.7062 1.3760 1.4031 2.0691 2.1396 2.2064 2.2473 2.5589 2.5950 2.9473 2.9537 3.1442 3.1541 3.3058 3.3082 3.3444 3.3676 3.5391 3.5849 3.6617 3.6760 4.7527 4.8182 4.8997 4.9179 4.9692 4.9892 5.0198 5.0556 5.1557 5.1873 5.5307 5.5514 5.5828 5.5995 5.8323 5.8486 6.3968 6.4266 6.7136 6.7310 9.3912 9.4022 9.6379 9.6718 10.6335 10.6824 10.9299 10.9443 11.0553 11.0897 k = 0.0000 0.0000 0.4214 ( 5806 PWs) bands (ev): -7.4243 -7.4240 -6.4941 -6.4927 -6.4842 -6.4831 -6.3279 -6.3247 0.1473 0.1630 0.6398 0.6706 1.3671 1.4036 2.0148 2.0922 2.2055 2.2401 2.6195 2.6508 2.9416 2.9457 3.1593 3.1616 3.3181 3.3186 3.3556 3.3781 3.5468 3.5939 3.6665 3.6745 4.7561 4.8234 4.8943 4.9270 4.9727 4.9899 5.0335 5.0553 5.1739 5.2191 5.5526 5.5705 5.5952 5.6027 5.8157 5.8325 6.3687 6.3969 6.7033 6.7217 9.4376 9.4479 9.6871 9.7234 10.5831 10.6272 10.9349 10.9488 11.0321 11.0669 k = 0.0000 0.0000 0.4425 ( 5806 PWs) bands (ev): -7.3955 -7.3952 -6.5088 -6.5075 -6.4980 -6.4968 -6.3338 -6.3306 0.1495 0.1655 0.6062 0.6352 1.3600 1.4069 1.9628 2.0490 2.1931 2.2207 2.6810 2.7083 2.9478 2.9491 3.1646 3.1700 3.3318 3.3328 3.3653 3.3876 3.5548 3.6026 3.6700 3.6712 4.7594 4.8284 4.8889 4.9326 4.9767 4.9912 5.0466 5.0538 5.1990 5.2535 5.5736 5.5830 5.6045 5.6108 5.8043 5.8227 6.3452 6.3719 6.6930 6.7123 9.4844 9.4939 9.7288 9.7674 10.5261 10.5650 10.9400 10.9530 11.0124 11.0474 k = 0.0000 0.0000 0.4636 ( 5802 PWs) bands (ev): -7.3658 -7.3654 -6.5234 -6.5221 -6.5115 -6.5104 -6.3406 -6.3373 0.1502 0.1663 0.5730 0.6003 1.3542 1.4122 1.9150 2.0112 2.1694 2.1898 2.7431 2.7667 2.9636 2.9648 3.1637 3.1763 3.3475 3.3489 3.3738 3.3963 3.5626 3.6108 3.6664 3.6723 4.7628 4.8332 4.8836 4.9359 4.9806 4.9932 5.0513 5.0587 5.2299 5.2902 5.5878 5.5893 5.6102 5.6308 5.7972 5.8186 6.3271 6.3521 6.6826 6.7029 9.5316 9.5401 9.7624 9.8029 10.4630 10.4968 10.9419 10.9540 10.9995 11.0345 k = 0.0000 0.0000 0.4846 ( 5810 PWs) bands (ev): -7.3353 -7.3348 -6.5379 -6.5366 -6.5248 -6.5238 -6.3483 -6.3451 0.1496 0.1658 0.5403 0.5661 1.3488 1.4183 1.8732 1.9800 2.1355 2.1494 2.8051 2.8254 2.9875 2.9904 3.1594 3.1786 3.3651 3.3656 3.3812 3.4043 3.5703 3.6180 3.6605 3.6735 4.7660 4.8377 4.8785 4.9379 4.9838 4.9959 5.0481 5.0693 5.2655 5.3291 5.5875 5.5936 5.6263 5.6527 5.7934 5.8197 6.3147 6.3380 6.6723 6.6934 9.5791 9.5864 9.7869 9.8289 10.3946 10.4234 10.9367 10.9481 10.9979 11.0319 k = 0.0000 0.0000 0.5057 ( 5810 PWs) bands (ev): -7.3040 -7.3035 -6.5521 -6.5509 -6.5377 -6.5367 -6.3571 -6.3539 0.1478 0.1639 0.5085 0.5327 1.3431 1.4236 1.8394 1.9562 2.0937 2.1019 2.8666 2.8840 3.0184 3.0217 3.1520 3.1777 3.3812 3.3832 3.3885 3.4125 3.5778 3.6231 3.6547 3.6737 4.7692 4.8422 4.8736 4.9395 4.9866 4.9992 5.0447 5.0785 5.3047 5.3698 5.5835 5.5931 5.6466 5.6754 5.7929 5.8255 6.3081 6.3297 6.6621 6.6840 9.6264 9.6322 9.8014 9.8443 10.3221 10.3462 10.9259 10.9358 11.0065 11.0399 k = 0.0000 0.0000 0.5268 ( 5808 PWs) bands (ev): -7.2720 -7.2714 -6.5660 -6.5649 -6.5502 -6.5493 -6.3670 -6.3637 0.1450 0.1610 0.4774 0.5003 1.3363 1.4259 1.8158 1.9409 2.0459 2.0493 2.9271 2.9418 3.0533 3.0553 3.1423 3.1746 3.3904 3.3995 3.4005 3.4227 3.5852 3.6240 3.6516 3.6732 4.7723 4.8467 4.8688 4.9408 4.9891 5.0031 5.0412 5.0862 5.3463 5.4117 5.5767 5.5907 5.6679 5.6984 5.7965 5.8360 6.3068 6.3269 6.6520 6.6746 9.6727 9.6764 9.8052 9.8481 10.2470 10.2665 10.9141 10.9207 11.0211 11.0554 k = 0.0000 0.0000 0.5478 ( 5804 PWs) bands (ev): -7.2395 -7.2388 -6.5796 -6.5785 -6.5622 -6.5613 -6.3779 -6.3747 0.1415 0.1573 0.4474 0.4689 1.3279 1.4236 1.8044 1.9342 1.9937 1.9942 2.9862 2.9984 3.0866 3.0874 3.1330 3.1722 3.3953 3.4108 3.4148 3.4378 3.5923 3.6192 3.6528 3.6721 4.7754 4.8515 4.8643 4.9419 4.9918 5.0076 5.0377 5.0927 5.3892 5.4542 5.5675 5.5863 5.6901 5.7221 5.8051 5.8508 6.3104 6.3290 6.6421 6.6654 9.7164 9.7164 9.7984 9.8398 10.1721 10.1867 10.9035 10.9055 11.0400 11.0761 k = 0.0000 0.0000 0.5689 ( 5808 PWs) bands (ev): -7.2064 -7.2057 -6.5928 -6.5918 -6.5736 -6.5728 -6.3899 -6.3868 0.1376 0.1532 0.4184 0.4387 1.3178 1.4156 1.8059 1.9285 1.9401 1.9444 3.0434 3.0530 3.0986 3.1057 3.1445 3.1783 3.3990 3.4179 3.4279 3.4565 3.5995 3.6112 3.6565 3.6708 4.7783 4.8567 4.8599 4.9428 4.9950 5.0128 5.0344 5.0982 5.4318 5.4957 5.5566 5.5796 5.7139 5.7470 5.8194 5.8700 6.3181 6.3353 6.6325 6.6563 9.7433 9.7531 9.7849 9.8194 10.1026 10.1113 10.8915 10.8946 11.0625 11.1010 k = 0.0000 0.0000 0.5900 ( 5800 PWs) bands (ev): -7.1730 -7.1722 -6.6055 -6.6046 -6.5844 -6.5836 -6.4031 -6.4001 0.1335 0.1488 0.3905 0.4097 1.3063 1.4026 1.8197 1.8752 1.8849 1.9506 3.0808 3.0958 3.1066 3.1075 3.1789 3.1999 3.4021 3.4231 3.4392 3.4763 3.6026 3.6069 3.6608 3.6695 4.7811 4.8557 4.8626 4.9434 4.9990 5.0185 5.0315 5.1032 5.4726 5.5346 5.5446 5.5709 5.7407 5.7740 5.8399 5.8933 6.3291 6.3451 6.6232 6.6474 9.7325 9.7684 9.7787 9.7920 10.0500 10.0510 10.8787 10.8871 11.0888 11.1298 k = 0.0000 0.0000 0.6111 ( 5792 PWs) bands (ev): -7.1393 -7.1384 -6.6177 -6.6169 -6.5944 -6.5937 -6.4175 -6.4145 0.1295 0.1445 0.3638 0.3820 1.2939 1.3862 1.8171 1.8274 1.8462 1.9700 3.0579 3.0879 3.1511 3.1571 3.2154 3.2291 3.4047 3.4275 3.4484 3.4955 3.5949 3.6144 3.6649 3.6685 4.7838 4.8516 4.8692 4.9436 5.0039 5.0247 5.0292 5.1080 5.5094 5.5324 5.5594 5.5699 5.7720 5.8042 5.8660 5.9203 6.3427 6.3575 6.6142 6.6386 9.6932 9.7350 9.7556 9.7677 10.0246 10.0311 10.8671 10.8799 11.1190 11.1622 k = 0.0000 0.0000 0.6321 ( 5794 PWs) bands (ev): -7.1055 -7.1044 -6.6295 -6.6288 -6.6036 -6.6030 -6.4329 -6.4300 0.1257 0.1404 0.3384 0.3556 1.2814 1.3683 1.7595 1.7738 1.8782 1.9968 3.0295 3.0648 3.1997 3.2044 3.2504 3.2587 3.4069 3.4317 3.4556 3.5127 3.5897 3.6222 3.6679 3.6686 4.7864 4.8477 4.8764 4.9435 5.0094 5.0277 5.0314 5.1127 5.5193 5.5418 5.5491 5.5963 5.8090 5.8388 5.8970 5.9504 6.3581 6.3719 6.6056 6.6301 9.6414 9.6807 9.7005 9.7155 10.0377 10.0472 10.8558 10.8720 11.1532 11.1981 k = 0.0000 0.0000 0.6532 ( 5794 PWs) bands (ev): -7.0715 -7.0704 -6.6408 -6.6403 -6.6120 -6.6114 -6.4494 -6.4467 0.1225 0.1369 0.3142 0.3306 1.2696 1.3506 1.7034 1.7202 1.9180 2.0300 2.9967 3.0358 3.2446 3.2482 3.2830 3.2861 3.4088 3.4361 3.4611 3.5263 3.5885 3.6299 3.6678 3.6719 4.7890 4.8440 4.8841 4.9432 5.0149 5.0276 5.0385 5.1175 5.5085 5.5386 5.5662 5.6157 5.8519 5.8783 5.9321 5.9831 6.3747 6.3875 6.5974 6.6217 9.5807 9.6159 9.6274 9.6443 10.0738 10.0834 10.8439 10.8624 11.1913 11.2371 k = 0.0000 0.0000 0.6743 ( 5794 PWs) bands (ev): -7.0377 -7.0365 -6.6517 -6.6513 -6.6193 -6.6189 -6.4669 -6.4643 0.1200 0.1340 0.2914 0.3070 1.2591 1.3343 1.6492 1.6684 1.9633 2.0686 2.9597 3.0018 3.2849 3.2875 3.3104 3.3131 3.4105 3.4413 3.4654 3.5351 3.5925 3.6371 3.6684 3.6747 4.7914 4.8403 4.8921 4.9427 5.0192 5.0300 5.0460 5.1223 5.4992 5.5294 5.5835 5.6277 5.8994 5.9221 5.9700 6.0176 6.3921 6.4040 6.5896 6.6134 9.5135 9.5425 9.5483 9.5686 10.1199 10.1287 10.8308 10.8502 11.2327 11.2789 k = 0.0000 0.0000 0.6953 ( 5794 PWs) bands (ev): -7.0041 -7.0028 -6.6622 -6.6620 -6.6257 -6.6253 -6.4853 -6.4829 0.1184 0.1321 0.2700 0.2849 1.2507 1.3203 1.5973 1.6189 2.0129 2.1118 2.9185 2.9633 3.3198 3.3206 3.3312 3.3417 3.4123 3.4479 3.4691 3.5397 3.6008 3.6433 3.6698 3.6769 4.7937 4.8368 4.8999 4.9421 5.0219 5.0351 5.0538 5.1268 5.4920 5.5221 5.5939 5.6335 5.9494 5.9691 6.0094 6.0529 6.4099 6.4209 6.5821 6.6052 9.4421 9.4643 9.4691 9.4937 10.1705 10.1783 10.8157 10.8348 11.2767 11.3226 k = 0.0000 0.0000 0.7164 ( 5796 PWs) bands (ev): -6.9709 -6.9694 -6.6725 -6.6724 -6.6309 -6.6307 -6.5044 -6.5022 0.1178 0.1312 0.2499 0.2642 1.2448 1.3094 1.5482 1.5720 2.0658 2.1589 2.8736 2.9206 3.3460 3.3480 3.3484 3.3692 3.4148 3.4570 3.4727 3.5424 3.6109 3.6483 3.6718 3.6787 4.7960 4.8334 4.9073 4.9414 5.0243 5.0412 5.0620 5.1306 5.4875 5.5175 5.5984 5.6343 6.0001 6.0172 6.0492 6.0881 6.4276 6.4378 6.5749 6.5970 9.3692 9.3867 9.3932 9.4203 10.2233 10.2300 10.7979 10.8160 11.3225 11.3677 k = 0.0000 0.0000 0.7375 ( 5800 PWs) bands (ev): -6.9383 -6.9367 -6.6829 -6.6827 -6.6349 -6.6347 -6.5239 -6.5219 0.1183 0.1314 0.2312 0.2450 1.2419 1.3019 1.5021 1.5281 2.1214 2.2091 2.8251 2.8743 3.3623 3.3647 3.3687 3.3918 3.4207 3.4691 3.4766 3.5446 3.6209 3.6521 3.6741 3.6798 4.7983 4.8301 4.9138 4.9407 5.0272 5.0470 5.0703 5.1334 5.4860 5.5159 5.5979 5.6311 6.0492 6.0644 6.0879 6.1220 6.4449 6.4544 6.5680 6.5889 9.2986 9.3138 9.3220 9.3495 10.2769 10.2825 10.7770 10.7935 11.3689 11.4131 k = 0.0000 0.0000 0.7586 ( 5816 PWs) bands (ev): -6.9065 -6.9048 -6.6936 -6.6932 -6.6375 -6.6374 -6.5435 -6.5418 0.1200 0.1329 0.2139 0.2273 1.2423 1.2981 1.4593 1.4875 2.1791 2.2619 2.7734 2.8248 3.3733 3.3784 3.3824 3.4029 3.4348 3.4810 3.4838 3.5468 3.6301 3.6552 3.6761 3.6802 4.8005 4.8269 4.9194 4.9399 5.0308 5.0517 5.0788 5.1348 5.4878 5.5175 5.5933 5.6246 6.0949 6.1087 6.1240 6.1534 6.4616 6.4704 6.5613 6.5806 9.2339 9.2483 9.2565 9.2835 10.3306 10.3350 10.7527 10.7672 11.4149 11.4578 k = 0.0000 0.0000 0.7796 ( 5830 PWs) bands (ev): -6.8757 -6.8739 -6.7051 -6.7044 -6.6386 -6.6385 -6.5627 -6.5613 0.1231 0.1357 0.1981 0.2111 1.2463 1.2983 1.4200 1.4504 2.2384 2.3167 2.7190 2.7727 3.3817 3.3883 3.3907 3.4062 3.4524 3.4854 3.4993 3.5488 3.6383 3.6581 3.6772 3.6797 4.8028 4.8238 4.9241 4.9391 5.0350 5.0551 5.0872 5.1346 5.4926 5.5222 5.5854 5.6154 6.1355 6.1482 6.1562 6.1810 6.4773 6.4856 6.5548 6.5722 9.1779 9.1923 9.1985 9.2243 10.3838 10.3869 10.7249 10.7372 11.4592 11.5008 k = 0.0000 0.0000 0.8007 ( 5830 PWs) bands (ev): -6.8463 -6.8444 -6.7178 -6.7168 -6.6378 -6.6378 -6.5808 -6.5797 0.1275 0.1399 0.1837 0.1964 1.2540 1.3027 1.3844 1.4171 2.2989 2.3731 2.6623 2.7183 3.3880 3.3952 3.3954 3.4072 3.4680 3.4896 3.5138 3.5501 3.6459 3.6611 3.6772 3.6781 4.8051 4.8208 4.9278 4.9383 5.0396 5.0568 5.0956 5.1327 5.5004 5.5299 5.5750 5.6043 6.1692 6.1813 6.1830 6.2038 6.4918 6.4998 6.5482 6.5637 9.1328 9.1479 9.1499 9.1742 10.4360 10.4377 10.6935 10.7034 11.5009 11.5410 k = 0.0000 0.0000 0.8218 ( 5838 PWs) bands (ev): -6.8185 -6.8166 -6.7325 -6.7312 -6.6350 -6.6350 -6.5971 -6.5964 0.1333 0.1456 0.1707 0.1832 1.2657 1.3112 1.3527 1.3877 2.3601 2.4306 2.6038 2.6623 3.3926 3.3977 3.4000 3.4072 3.4799 3.4926 3.5263 3.5499 3.6530 3.6643 3.6752 3.6761 4.8075 4.8179 4.9307 4.9373 5.0444 5.0569 5.1037 5.1292 5.5106 5.5399 5.5628 5.5917 6.1947 6.2029 6.2065 6.2203 6.5047 6.5128 6.5414 6.5548 9.1003 9.1125 9.1165 9.1351 10.4867 10.4868 10.6585 10.6661 11.5389 11.5774 k = 0.0000 0.0000 0.8428 ( 5836 PWs) bands (ev): -6.7929 -6.7910 -6.7498 -6.7482 -6.6298 -6.6298 -6.6109 -6.6105 0.1405 0.1527 0.1592 0.1715 1.2814 1.3240 1.3249 1.3623 2.4216 2.4887 2.5439 2.6050 3.3957 3.3983 3.4032 3.4066 3.4880 3.4938 3.5362 3.5478 3.6597 3.6676 3.6710 3.6739 4.8100 4.8152 4.9330 4.9362 5.0488 5.0554 5.1114 5.1244 5.5227 5.5495 5.5518 5.5784 6.2111 6.2149 6.2231 6.2296 6.5160 6.5247 6.5340 6.5455 9.0817 9.0881 9.0993 9.1089 10.5339 10.5355 10.6200 10.6255 11.5725 11.6093 k = 0.0000 0.0000 0.8639 ( 5828 PWs) bands (ev): -6.7699 -6.7699 -6.7681 -6.7681 -6.6219 -6.6219 -6.6217 -6.6217 0.1491 0.1491 0.1614 0.1614 1.3011 1.3011 1.3410 1.3410 2.4830 2.4830 2.5470 2.5470 3.3976 3.3976 3.4053 3.4053 3.4925 3.4925 3.5433 3.5433 3.6658 3.6658 3.6710 3.6710 4.8126 4.8126 4.9348 4.9348 5.0526 5.0526 5.1183 5.1183 5.5360 5.5360 5.5649 5.5649 6.2178 6.2178 6.2307 6.2307 6.5257 6.5257 6.5356 6.5356 9.0776 9.0776 9.0968 9.0968 10.5784 10.5784 10.5819 10.5819 11.6012 11.6012 k = 0.0000 0.0000 0.8639 ( 5828 PWs) bands (ev): -6.7699 -6.7699 -6.7681 -6.7681 -6.6219 -6.6219 -6.6217 -6.6217 0.1491 0.1491 0.1614 0.1614 1.3011 1.3011 1.3410 1.3410 2.4830 2.4830 2.5470 2.5470 3.3976 3.3976 3.4053 3.4053 3.4925 3.4925 3.5433 3.5433 3.6658 3.6658 3.6710 3.6710 4.8126 4.8126 4.9348 4.9348 5.0526 5.0526 5.1183 5.1183 5.5360 5.5360 5.5649 5.5649 6.2178 6.2178 6.2307 6.2307 6.5257 6.5257 6.5356 6.5356 9.0776 9.0776 9.0968 9.0968 10.5784 10.5784 10.5819 10.5819 11.6012 11.6012 k =-0.0114 0.0161 0.8639 ( 5834 PWs) bands (ev): -6.7699 -6.7699 -6.7681 -6.7681 -6.6221 -6.6221 -6.6219 -6.6219 0.1507 0.1507 0.1630 0.1630 1.3013 1.3013 1.3412 1.3412 2.4836 2.4836 2.5476 2.5476 3.3969 3.3969 3.4047 3.4047 3.4919 3.4919 3.5427 3.5427 3.6650 3.6650 3.6705 3.6705 4.8124 4.8124 4.9346 4.9346 5.0521 5.0521 5.1176 5.1176 5.5357 5.5357 5.5648 5.5648 6.2172 6.2172 6.2303 6.2303 6.5230 6.5230 6.5329 6.5329 9.0800 9.0800 9.0992 9.0992 10.5843 10.5843 10.5894 10.5894 11.5957 11.5957 k =-0.0229 0.0323 0.8639 ( 5842 PWs) bands (ev): -6.7698 -6.7698 -6.7680 -6.7680 -6.6227 -6.6227 -6.6224 -6.6224 0.1555 0.1555 0.1679 0.1679 1.3021 1.3021 1.3416 1.3416 2.4855 2.4855 2.5493 2.5493 3.3946 3.3946 3.4030 3.4030 3.4901 3.4901 3.5410 3.5410 3.6627 3.6627 3.6692 3.6692 4.8119 4.8119 4.9341 4.9341 5.0506 5.0506 5.1157 5.1157 5.5349 5.5349 5.5645 5.5645 6.2155 6.2155 6.2290 6.2290 6.5149 6.5149 6.5249 6.5249 9.0870 9.0870 9.1063 9.1063 10.6028 10.6028 10.6111 10.6111 11.5794 11.5794 k =-0.0343 0.0484 0.8639 ( 5830 PWs) bands (ev): -6.7696 -6.7696 -6.7678 -6.7678 -6.6237 -6.6237 -6.6233 -6.6233 0.1633 0.1633 0.1761 0.1761 1.3033 1.3033 1.3423 1.3423 2.4887 2.4887 2.5521 2.5521 3.3910 3.3910 3.4001 3.4001 3.4872 3.4872 3.5382 3.5382 3.6590 3.6590 3.6670 3.6670 4.8111 4.8111 4.9333 4.9333 5.0483 5.0483 5.1125 5.1125 5.5337 5.5337 5.5642 5.5642 6.2127 6.2127 6.2269 6.2269 6.5019 6.5019 6.5120 6.5120 9.0987 9.0987 9.1182 9.1182 10.6337 10.6337 10.6457 10.6457 11.5525 11.5525 k =-0.0458 0.0645 0.8639 ( 5826 PWs) bands (ev): -6.7696 -6.7696 -6.7678 -6.7678 -6.6249 -6.6249 -6.6244 -6.6244 0.1742 0.1742 0.1873 0.1873 1.3051 1.3051 1.3434 1.3434 2.4931 2.4931 2.5560 2.5560 3.3857 3.3857 3.3960 3.3960 3.4831 3.4831 3.5343 3.5343 3.6539 3.6539 3.6639 3.6639 4.8101 4.8101 4.9323 4.9323 5.0451 5.0451 5.1082 5.1082 5.5317 5.5317 5.5636 5.5636 6.2088 6.2088 6.2238 6.2238 6.4843 6.4843 6.4945 6.4945 9.1150 9.1150 9.1347 9.1347 10.6758 10.6758 10.6920 10.6920 11.5154 11.5154 k =-0.0572 0.0806 0.8639 ( 5830 PWs) bands (ev): -6.7697 -6.7697 -6.7681 -6.7681 -6.6260 -6.6260 -6.6255 -6.6255 0.1881 0.1881 0.2016 0.2016 1.3074 1.3074 1.3448 1.3448 2.4988 2.4988 2.5610 2.5610 3.3790 3.3790 3.3906 3.3906 3.4779 3.4779 3.5292 3.5292 3.6477 3.6477 3.6601 3.6601 4.8088 4.8088 4.9309 4.9309 5.0412 5.0412 5.1031 5.1031 5.5291 5.5291 5.5627 5.5627 6.2039 6.2039 6.2198 6.2198 6.4628 6.4628 6.4732 6.4732 9.1356 9.1356 9.1556 9.1556 10.7275 10.7275 10.7481 10.7481 11.4690 11.4690 k =-0.0687 0.0968 0.8639 ( 5818 PWs) bands (ev): -6.7704 -6.7704 -6.7688 -6.7688 -6.6270 -6.6270 -6.6263 -6.6263 0.2046 0.2046 0.2187 0.2187 1.3102 1.3102 1.3465 1.3465 2.5056 2.5056 2.5671 2.5671 3.3709 3.3709 3.3841 3.3841 3.4715 3.4715 3.5230 3.5230 3.6404 3.6404 3.6556 3.6556 4.8072 4.8072 4.9293 4.9293 5.0366 5.0366 5.0973 5.0973 5.5256 5.5256 5.5614 5.5614 6.1979 6.1979 6.2149 6.2149 6.4381 6.4381 6.4488 6.4488 9.1605 9.1605 9.1809 9.1809 10.7862 10.7862 10.8118 10.8118 11.4144 11.4144 k =-0.0801 0.1129 0.8639 ( 5820 PWs) bands (ev): -6.7717 -6.7717 -6.7702 -6.7702 -6.6276 -6.6276 -6.6268 -6.6268 0.2238 0.2238 0.2384 0.2384 1.3136 1.3136 1.3486 1.3486 2.5137 2.5137 2.5743 2.5743 3.3612 3.3612 3.3763 3.3763 3.4641 3.4641 3.5158 3.5158 3.6323 3.6323 3.6504 3.6504 4.8056 4.8056 4.9275 4.9275 5.0315 5.0315 5.0910 5.0910 5.5211 5.5211 5.5596 5.5596 6.1909 6.1909 6.2090 6.2090 6.4110 6.4110 6.4219 6.4219 9.1895 9.1895 9.2102 9.2102 10.8478 10.8478 10.8792 10.8792 11.3541 11.3541 k =-0.0916 0.1290 0.8639 ( 5820 PWs) bands (ev): -6.7739 -6.7739 -6.7725 -6.7725 -6.6274 -6.6274 -6.6265 -6.6265 0.2452 0.2452 0.2606 0.2606 1.3177 1.3177 1.3512 1.3512 2.5229 2.5229 2.5826 2.5826 3.3500 3.3500 3.3672 3.3672 3.4556 3.4556 3.5074 3.5074 3.6236 3.6236 3.6448 3.6448 4.8038 4.8038 4.9254 4.9254 5.0260 5.0260 5.0845 5.0845 5.5156 5.5156 5.5573 5.5573 6.1829 6.1829 6.2022 6.2022 6.3823 6.3823 6.3936 6.3936 9.2221 9.2221 9.2433 9.2433 10.9058 10.9058 10.9440 10.9440 11.2927 11.2927 k =-0.1030 0.1452 0.8639 ( 5820 PWs) bands (ev): -6.7772 -6.7772 -6.7760 -6.7760 -6.6263 -6.6263 -6.6253 -6.6253 0.2687 0.2687 0.2848 0.2848 1.3225 1.3225 1.3543 1.3543 2.5333 2.5333 2.5919 2.5919 3.3374 3.3374 3.3568 3.3568 3.4461 3.4461 3.4979 3.4979 3.6146 3.6146 3.6386 3.6386 4.8019 4.8019 4.9232 4.9232 5.0201 5.0201 5.0780 5.0780 5.5090 5.5090 5.5542 5.5542 6.1738 6.1738 6.1943 6.1943 6.3529 6.3529 6.3645 6.3645 9.2581 9.2581 9.2798 9.2798 10.9471 10.9471 10.9928 10.9928 11.2409 11.2409 k =-0.1145 0.1613 0.8639 ( 5820 PWs) bands (ev): -6.7817 -6.7817 -6.7807 -6.7807 -6.6240 -6.6240 -6.6229 -6.6229 0.2938 0.2938 0.3109 0.3109 1.3281 1.3281 1.3581 1.3581 2.5448 2.5448 2.6022 2.6022 3.3234 3.3234 3.3451 3.3451 3.4359 3.4359 3.4874 3.4874 3.6055 3.6055 3.6322 3.6322 4.8000 4.8000 4.9208 4.9208 5.0140 5.0140 5.0718 5.0718 5.5012 5.5012 5.5503 5.5503 6.1636 6.1636 6.1853 6.1853 6.3234 6.3234 6.3355 6.3355 9.2971 9.2971 9.3193 9.3193 10.9496 10.9496 10.9998 10.9998 11.2164 11.2164 k =-0.1259 0.1774 0.8639 ( 5808 PWs) bands (ev): -6.7876 -6.7876 -6.7867 -6.7867 -6.6205 -6.6205 -6.6192 -6.6192 0.3203 0.3203 0.3383 0.3383 1.3346 1.3346 1.3627 1.3627 2.5573 2.5573 2.6135 2.6135 3.3081 3.3081 3.3321 3.3321 3.4249 3.4249 3.4761 3.4761 3.5964 3.5964 3.6254 3.6254 4.7983 4.7983 4.9184 4.9184 5.0079 5.0079 5.0660 5.0660 5.4924 5.4924 5.5456 5.5456 6.1523 6.1523 6.1752 6.1752 6.2946 6.2946 6.3073 6.3073 9.3386 9.3386 9.3614 9.3614 10.9038 10.9038 10.9524 10.9524 11.2207 11.2207 k =-0.1259 0.1774 0.8639 ( 5808 PWs) bands (ev): -6.7876 -6.7876 -6.7867 -6.7867 -6.6205 -6.6205 -6.6192 -6.6192 0.3203 0.3203 0.3383 0.3383 1.3346 1.3346 1.3627 1.3627 2.5573 2.5573 2.6135 2.6135 3.3081 3.3081 3.3321 3.3321 3.4249 3.4249 3.4761 3.4761 3.5964 3.5964 3.6254 3.6254 4.7983 4.7983 4.9184 4.9184 5.0079 5.0079 5.0660 5.0660 5.4924 5.4924 5.5456 5.5456 6.1523 6.1523 6.1752 6.1752 6.2946 6.2946 6.3073 6.3073 9.3386 9.3386 9.3614 9.3614 10.9038 10.9038 10.9524 10.9524 11.2207 11.2207 k =-0.1344 0.1894 0.8492 ( 5814 PWs) bands (ev): -6.7987 -6.7979 -6.7876 -6.7871 -6.6313 -6.6302 -6.6020 -6.6006 0.3328 0.3489 0.3518 0.3677 1.3304 1.3502 1.3600 1.3771 2.5264 2.5809 2.6106 2.6610 3.2942 3.2966 3.3195 3.3229 3.4119 3.4171 3.4624 3.4743 3.5860 3.5930 3.6186 3.6216 4.7955 4.7985 4.9140 4.9188 4.9980 5.0079 5.0567 5.0683 5.4734 5.4965 5.5316 5.5512 6.1251 6.1449 6.1596 6.1815 6.2658 6.2716 6.2915 6.2956 9.3717 9.3755 9.3936 9.4000 10.8264 10.8659 10.8766 10.9176 11.2250 11.2391 k =-0.1429 0.2014 0.8345 ( 5810 PWs) bands (ev): -6.8098 -6.8089 -6.7899 -6.7895 -6.6418 -6.6408 -6.5817 -6.5801 0.3457 0.3655 0.3793 0.3985 1.3296 1.3544 1.3737 1.3933 2.4958 2.5521 2.6600 2.7082 3.2788 3.2826 3.3054 3.3113 3.3959 3.4038 3.4519 3.4743 3.5752 3.5892 3.6111 3.6177 4.7927 4.7988 4.9090 4.9192 4.9879 5.0071 5.0491 5.0720 5.4544 5.4987 5.5178 5.5551 6.0912 6.1124 6.1582 6.1845 6.2358 6.2465 6.2846 6.2887 9.4112 9.4182 9.4323 9.4446 10.7328 10.7752 10.8360 10.8809 11.2250 11.2557 k =-0.1514 0.2134 0.8198 ( 5806 PWs) bands (ev): -6.8206 -6.8198 -6.7937 -6.7933 -6.6520 -6.6511 -6.5604 -6.5586 0.3589 0.3799 0.4105 0.4305 1.3326 1.3570 1.3940 1.4112 2.4659 2.5232 2.7095 2.7547 3.2618 3.2659 3.2899 3.2970 3.3780 3.3853 3.4451 3.4750 3.5644 3.5850 3.6032 3.6136 4.7897 4.7992 4.9034 4.9196 4.9784 5.0049 5.0439 5.0764 5.4359 5.4970 5.5061 5.5567 6.0526 6.0741 6.1490 6.1797 6.2104 6.2295 6.2805 6.2848 9.4562 9.4657 9.4767 9.4943 10.6322 10.6725 10.8001 10.8438 11.2141 11.2535 k =-0.1599 0.2253 0.8052 ( 5810 PWs) bands (ev): -6.8312 -6.8303 -6.7985 -6.7980 -6.6618 -6.6610 -6.5386 -6.5366 0.3721 0.3943 0.4428 0.4635 1.3394 1.3629 1.4162 1.4307 2.4367 2.4949 2.7578 2.8000 3.2429 3.2468 3.2729 3.2797 3.3585 3.3636 3.4404 3.4762 3.5538 3.5806 3.5951 3.6093 4.7866 4.7996 4.8973 4.9201 4.9699 5.0007 5.0419 5.0814 5.4181 5.4869 5.5007 5.5559 6.0113 6.0324 6.1289 6.1577 6.2003 6.2223 6.2786 6.2832 9.5058 9.5171 9.5258 9.5480 10.5290 10.5672 10.7650 10.8074 11.1915 11.2323 k =-0.1684 0.2373 0.7905 ( 5804 PWs) bands (ev): -6.8416 -6.8407 -6.8039 -6.8033 -6.6713 -6.6705 -6.5168 -6.5146 0.3852 0.4088 0.4757 0.4972 1.3499 1.3724 1.4400 1.4517 2.4083 2.4674 2.8046 2.8435 3.2219 3.2256 3.2541 3.2597 3.3367 3.3411 3.4369 3.4777 3.5439 3.5760 3.5874 3.6048 4.7835 4.8000 4.8912 4.9205 4.9625 4.9952 5.0424 5.0869 5.4014 5.4742 5.4962 5.5521 5.9684 5.9886 6.1016 6.1269 6.1990 6.2207 6.2786 6.2837 9.5587 9.5712 9.5783 9.6045 10.4260 10.4619 10.7311 10.7723 11.1594 11.1999 k =-0.1769 0.2493 0.7758 ( 5800 PWs) bands (ev): -6.8516 -6.8507 -6.8096 -6.8089 -6.6804 -6.6796 -6.4953 -6.4929 0.3978 0.4230 0.5091 0.5314 1.3642 1.3854 1.4652 1.4743 2.3809 2.4407 2.8491 2.8846 3.1980 3.2029 3.2329 3.2383 3.3125 3.3187 3.4339 3.4793 3.5349 3.5713 3.5804 3.6002 4.7803 4.8005 4.8852 4.9209 4.9560 4.9893 5.0448 5.0925 5.3859 5.4616 5.4896 5.5452 5.9250 5.9438 6.0713 6.0946 6.1993 6.2208 6.2804 6.2861 9.6132 9.6268 9.6321 9.6625 10.3256 10.3592 10.6983 10.7389 11.1217 11.1602 k =-0.1854 0.2613 0.7611 ( 5794 PWs) bands (ev): -6.8612 -6.8603 -6.8154 -6.8146 -6.6891 -6.6883 -6.4743 -6.4718 0.4100 0.4368 0.5428 0.5657 1.3821 1.4020 1.4917 1.4984 2.3543 2.4149 2.8907 2.9225 3.1718 3.1787 3.2083 3.2170 3.2873 3.2958 3.4312 3.4812 3.5271 3.5664 3.5746 3.5955 4.7772 4.8011 4.8796 4.9213 4.9505 4.9837 5.0484 5.0983 5.3719 5.4497 5.4806 5.5351 5.8822 5.8990 6.0400 6.0625 6.1998 6.2213 6.2840 6.2903 9.6665 9.6826 9.6844 9.7205 10.2310 10.2620 10.6665 10.7069 11.0829 11.1181 k =-0.1939 0.2733 0.7464 ( 5798 PWs) bands (ev): -6.8704 -6.8695 -6.8212 -6.8204 -6.6973 -6.6966 -6.4539 -6.4513 0.4216 0.4500 0.5763 0.5998 1.4033 1.4220 1.5195 1.5241 2.3287 2.3900 2.9283 2.9558 3.1439 3.1527 3.1816 3.1957 3.2619 3.2726 3.4288 3.4832 3.5204 3.5616 3.5699 3.5910 4.7743 4.8016 4.8747 4.9216 4.9458 4.9787 5.0525 5.1040 5.3595 5.4386 5.4692 5.5217 5.8404 5.8551 6.0090 6.0313 6.1998 6.2219 6.2893 6.2962 9.7139 9.7296 9.7371 9.7771 10.1473 10.1751 10.6351 10.6758 11.0476 11.0787 k =-0.2024 0.2852 0.7317 ( 5795 PWs) bands (ev): -6.8791 -6.8783 -6.8269 -6.8260 -6.7051 -6.7044 -6.4344 -6.4317 0.4325 0.4627 0.6094 0.6335 1.4277 1.4452 1.5485 1.5514 2.3041 2.3660 2.9602 2.9826 3.1150 3.1248 3.1538 3.1745 3.2378 3.2505 3.4267 3.4853 3.5150 3.5572 3.5665 3.5867 4.7718 4.8021 4.8706 4.9217 4.9420 4.9748 5.0571 5.1095 5.3489 5.4284 5.4556 5.5052 5.8002 5.8130 5.9788 6.0014 6.1993 6.2223 6.2962 6.3036 9.7449 9.7590 9.7878 9.8307 10.0842 10.1086 10.6033 10.6444 11.0203 11.0467 k =-0.2109 0.2972 0.7170 ( 5791 PWs) bands (ev): -6.8874 -6.8866 -6.8324 -6.8315 -6.7124 -6.7117 -6.4159 -6.4131 0.4426 0.4745 0.6417 0.6663 1.4549 1.4713 1.5782 1.5805 2.2804 2.3428 2.9834 3.0002 3.0857 3.0953 3.1257 3.1532 3.2174 3.2321 3.4247 3.4874 3.5106 3.5534 3.5641 3.5831 4.7699 4.8025 4.8674 4.9214 4.9390 4.9719 5.0618 5.1148 5.3399 5.4190 5.4402 5.4859 5.7614 5.7737 5.9499 5.9732 6.1983 6.2224 6.3045 6.3122 9.7421 9.7590 9.8334 9.8793 10.0559 10.0785 10.5703 10.6116 11.0049 11.0266 k =-0.2194 0.3092 0.7023 ( 5793 PWs) bands (ev): -6.8951 -6.8943 -6.8377 -6.8367 -6.7192 -6.7185 -6.3985 -6.3956 0.4520 0.4856 0.6730 0.6980 1.4845 1.4998 1.6086 1.6115 2.2576 2.3204 2.9926 3.0068 3.0566 3.0650 3.0979 3.1313 3.2043 3.2212 3.4230 3.4895 3.5073 3.5502 3.5624 3.5807 4.7686 4.8027 4.8649 4.9205 4.9371 4.9700 5.0665 5.1197 5.3326 5.4100 5.4240 5.4645 5.7240 5.7379 5.9226 5.9467 6.1968 6.2223 6.3141 6.3217 9.7027 9.7227 9.8730 9.9209 10.0670 10.0894 10.5357 10.5765 11.0041 11.0215 k =-0.2279 0.3212 0.6876 ( 5783 PWs) bands (ev): -6.9023 -6.9015 -6.8427 -6.8416 -6.7255 -6.7247 -6.3823 -6.3794 0.4606 0.4958 0.7029 0.7281 1.5159 1.5303 1.6398 1.6438 2.2356 2.2987 2.9833 3.0018 3.0283 3.0359 3.0710 3.1079 3.2011 3.2200 3.4216 3.4912 3.5051 3.5477 3.5607 3.5802 4.7681 4.8029 4.8632 4.9191 4.9363 4.9692 5.0710 5.1241 5.3265 5.3990 5.4100 5.4420 5.6882 5.7058 5.8973 5.9222 6.1950 6.2219 6.3247 6.3320 9.6431 9.6636 9.9059 9.9543 10.1031 10.1250 10.5001 10.5394 11.0192 11.0328 k =-0.2364 0.3332 0.6729 ( 5791 PWs) bands (ev): -6.9089 -6.9081 -6.8473 -6.8461 -6.7312 -6.7305 -6.3674 -6.3643 0.4684 0.5051 0.7310 0.7564 1.5486 1.5623 1.6720 1.6770 2.2144 2.2777 2.9603 2.9829 2.9994 3.0109 3.0454 3.0834 3.2069 3.2271 3.4204 3.4922 3.5040 3.5460 3.5588 3.5817 4.7684 4.8028 4.8620 4.9172 4.9366 4.9691 5.0752 5.1280 5.3209 5.3837 5.4009 5.4200 5.6544 5.6769 5.8741 5.8998 6.1930 6.2212 6.3359 6.3427 9.5773 9.5967 9.9317 9.9795 10.1492 10.1700 10.4644 10.5014 11.0495 11.0598 k =-0.2449 0.3451 0.6583 ( 5778 PWs) bands (ev): -6.9148 -6.9141 -6.8515 -6.8503 -6.7364 -6.7357 -6.3538 -6.3507 0.4753 0.5136 0.7571 0.7825 1.5819 1.5951 1.7048 1.7108 2.1938 2.2571 2.9302 2.9545 2.9707 2.9872 3.0212 3.0592 3.2182 3.2384 3.4194 3.4923 3.5038 3.5449 3.5572 3.5850 4.7695 4.8026 4.8613 4.9151 4.9378 4.9697 5.0792 5.1313 5.3145 5.3677 5.3903 5.4042 5.6229 5.6510 5.8531 5.8796 6.1909 6.2203 6.3475 6.3535 9.5122 9.5299 9.9509 9.9973 10.1968 10.2166 10.4299 10.4642 11.0929 11.1011 k =-0.2534 0.3571 0.6436 ( 5782 PWs) bands (ev): -6.9201 -6.9195 -6.8553 -6.8541 -6.7410 -6.7403 -6.3417 -6.3385 0.4815 0.5211 0.7809 0.8061 1.6152 1.6277 1.7381 1.7450 2.1737 2.2369 2.8967 2.9226 2.9433 2.9626 2.9987 3.0362 3.2316 3.2510 3.4187 3.4916 3.5043 3.5435 3.5569 3.5895 4.7714 4.8022 4.8609 4.9128 4.9398 4.9707 5.0829 5.1339 5.3054 5.3521 5.3762 5.3982 5.5939 5.6278 5.8345 5.8615 6.1888 6.2193 6.3589 6.3641 9.4510 9.4669 9.9642 10.0087 10.2419 10.2611 10.3978 10.4294 11.1463 11.1543 k =-0.2619 0.3691 0.6289 ( 5784 PWs) bands (ev): -6.9248 -6.9241 -6.8586 -6.8574 -6.7450 -6.7443 -6.3311 -6.3278 0.4868 0.5276 0.8021 0.8270 1.6477 1.6594 1.7712 1.7790 2.1541 2.2171 2.8625 2.8903 2.9177 2.9380 2.9782 3.0152 3.2449 3.2629 3.4181 3.4906 3.5050 3.5414 3.5585 3.5947 4.7740 4.8016 4.8607 4.9104 4.9425 4.9718 5.0865 5.1359 5.2933 5.3350 5.3684 5.3957 5.5675 5.6071 5.8183 5.8456 6.1868 6.2181 6.3699 6.3741 9.3957 9.4096 9.9727 10.0151 10.2813 10.3008 10.3694 10.3991 11.2066 11.2165 k =-0.2705 0.3811 0.6142 ( 5791 PWs) bands (ev): -6.9287 -6.9281 -6.8615 -6.8602 -6.7484 -6.7477 -6.3220 -6.3187 0.4914 0.5332 0.8205 0.8450 1.6783 1.6890 1.8036 1.8121 2.1349 2.1977 2.8292 2.8593 2.8946 2.9148 2.9602 2.9967 3.2570 3.2734 3.4177 3.4894 3.5059 3.5388 3.5616 3.6000 4.7770 4.8009 4.8605 4.9081 4.9459 4.9727 5.0900 5.1369 5.2797 5.3172 5.3674 5.3946 5.5436 5.5891 5.8045 5.8320 6.1849 6.2170 6.3799 6.3832 9.3474 9.3593 9.9777 10.0178 10.3097 10.3329 10.3477 10.3778 11.2708 11.2840 k =-0.2790 0.3931 0.5995 ( 5793 PWs) bands (ev): -6.9320 -6.9314 -6.8638 -6.8626 -6.7512 -6.7505 -6.3145 -6.3112 0.4952 0.5378 0.8358 0.8600 1.7060 1.7154 1.8345 1.8434 2.1163 2.1789 2.7987 2.8312 2.8747 2.8941 2.9449 2.9810 3.2672 3.2819 3.4174 3.4882 3.5068 3.5359 3.5652 3.6050 4.7803 4.8000 4.8605 4.9058 4.9498 4.9732 5.0936 5.1371 5.2667 5.3008 5.3704 5.3946 5.5226 5.5737 5.7933 5.8207 6.1833 6.2160 6.3888 6.3912 9.3069 9.3171 9.9802 10.0181 10.3133 10.3287 10.3623 10.3780 11.3355 11.3530 k =-0.2875 0.4050 0.5848 ( 5798 PWs) bands (ev): -6.9345 -6.9340 -6.8657 -6.8644 -6.7534 -6.7527 -6.3086 -6.3053 0.4981 0.5414 0.8479 0.8717 1.7297 1.7374 1.8627 1.8714 2.0987 2.1613 2.7726 2.8074 2.8583 2.8770 2.9328 2.9685 3.2753 3.2885 3.4171 3.4871 3.5077 3.5332 3.5687 3.6093 4.7838 4.7987 4.8604 4.9039 4.9540 4.9729 5.0974 5.1361 5.2558 5.2869 5.3755 5.3950 5.5046 5.5612 5.7846 5.8118 6.1820 6.2151 6.3960 6.3977 9.2749 9.2834 9.9811 10.0170 10.3014 10.3152 10.3825 10.3938 11.3967 11.4191 k =-0.2960 0.4170 0.5701 ( 5791 PWs) bands (ev): -6.9364 -6.9358 -6.8670 -6.8657 -6.7550 -6.7543 -6.3044 -6.3010 0.5002 0.5440 0.8567 0.8801 1.7481 1.7539 1.8866 1.8942 2.0833 2.1463 2.7524 2.7893 2.8462 2.8642 2.9239 2.9594 3.2812 3.2931 3.4170 3.4863 3.5087 3.5310 3.5716 3.6127 4.7872 4.7973 4.8603 4.9023 4.9583 4.9718 5.1012 5.1343 5.2479 5.2763 5.3811 5.3956 5.4904 5.5520 5.7784 5.8054 6.1810 6.2144 6.4015 6.4026 9.2517 9.2589 9.9812 10.0156 10.2909 10.3037 10.3978 10.4081 11.4489 11.4768 k =-0.3045 0.4290 0.5554 ( 5787 PWs) bands (ev): -6.9375 -6.9369 -6.8678 -6.8665 -6.7559 -6.7552 -6.3019 -6.2985 0.5014 0.5455 0.8620 0.8852 1.7599 1.7640 1.9037 1.9090 2.0721 2.1357 2.7397 2.7779 2.8387 2.8563 2.9185 2.9538 3.2848 3.2957 3.4169 3.4857 3.5095 3.5294 3.5735 3.6148 4.7903 4.7954 4.8603 4.9013 4.9623 4.9699 5.1044 5.1323 5.2431 5.2697 5.3858 5.3958 5.4809 5.5463 5.7747 5.8015 6.1805 6.2140 6.4048 6.4055 9.2377 9.2441 9.9811 10.0144 10.2844 10.2963 10.4071 10.4170 11.4855 11.5187 k =-0.3130 0.4410 0.5407 ( 5789 PWs) bands (ev): -6.9378 -6.9373 -6.8681 -6.8668 -6.7562 -6.7555 -6.3010 -6.2976 0.5019 0.5460 0.8637 0.8869 1.7641 1.7673 1.9104 1.9139 2.0679 2.1318 2.7354 2.7740 2.8362 2.8536 2.9167 2.9520 3.2860 3.2966 3.4169 3.4855 3.5097 3.5289 3.5742 3.6155 4.7927 4.7935 4.8603 4.9010 4.9646 4.9682 5.1057 5.1314 5.2416 5.2674 5.3878 5.3958 5.4775 5.5443 5.7734 5.8002 6.1802 6.2139 6.4060 6.4065 9.2331 9.2391 9.9810 10.0139 10.2822 10.2938 10.4103 10.4200 11.4989 11.5346 k =-0.3130 0.4410 0.5407 ( 5789 PWs) bands (ev): -6.9378 -6.9373 -6.8681 -6.8668 -6.7562 -6.7555 -6.3010 -6.2976 0.5019 0.5460 0.8637 0.8869 1.7641 1.7673 1.9104 1.9139 2.0679 2.1318 2.7354 2.7740 2.8362 2.8536 2.9167 2.9520 3.2860 3.2966 3.4169 3.4855 3.5097 3.5289 3.5742 3.6155 4.7927 4.7935 4.8603 4.9010 4.9646 4.9682 5.1057 5.1314 5.2416 5.2674 5.3878 5.3958 5.4775 5.5443 5.7734 5.8002 6.1802 6.2139 6.4060 6.4065 9.2331 9.2391 9.9810 10.0139 10.2822 10.2938 10.4103 10.4200 11.4989 11.5346 k =-0.3043 0.4287 0.5257 ( 5793 PWs) bands (ev): -6.9470 -6.9467 -6.8480 -6.8466 -6.7654 -6.7644 -6.3003 -6.2969 0.5011 0.5451 0.8806 0.9067 1.7554 1.7699 1.9290 1.9291 2.0210 2.0953 2.7026 2.7422 2.8076 2.8222 2.9025 2.9328 3.2891 3.2960 3.4214 3.4845 3.5142 3.5352 3.5967 3.6295 4.7921 4.7951 4.8605 4.9027 4.9696 4.9713 5.1125 5.1422 5.2382 5.2656 5.3794 5.3858 5.4668 5.5342 5.7801 5.8069 6.1842 6.2186 6.4188 6.4190 9.2883 9.2941 10.0120 10.0444 10.3559 10.3685 10.4102 10.4215 11.5077 11.5408 k =-0.2956 0.4165 0.5107 ( 5781 PWs) bands (ev): -6.9650 -6.9649 -6.8274 -6.8260 -6.7654 -6.7643 -6.2997 -6.2961 0.4981 0.5415 0.8939 0.9229 1.7465 1.7756 1.9432 1.9532 1.9840 2.0650 2.6693 2.7091 2.7779 2.7899 2.8896 2.9158 3.2908 3.2951 3.4258 3.4831 3.5179 3.5405 3.6189 3.6436 4.7918 4.7967 4.8607 4.9043 4.9740 4.9740 5.1174 5.1509 5.2354 5.2642 5.3742 5.3789 5.4582 5.5261 5.7894 5.8163 6.1850 6.2199 6.4293 6.4296 9.3458 9.3512 10.0357 10.0668 10.4021 10.4035 10.4395 10.4398 11.5106 11.5369 k =-0.2869 0.4042 0.4957 ( 5785 PWs) bands (ev): -6.9899 -6.9899 -6.8064 -6.8050 -6.7583 -6.7570 -6.2991 -6.2955 0.4927 0.5351 0.9039 0.9357 1.7364 1.7825 1.9259 1.9817 1.9891 2.0431 2.6358 2.6752 2.7472 2.7568 2.8783 2.9012 3.2914 3.2939 3.4300 3.4815 3.5208 3.5449 3.6402 3.6573 4.7918 4.7981 4.8607 4.9056 4.9763 4.9775 5.1202 5.1574 5.2330 5.2624 5.3723 5.3757 5.4515 5.5199 5.8012 5.8285 6.1826 6.2177 6.4373 6.4386 9.4053 9.4104 10.0533 10.0824 10.3948 10.3975 10.4974 10.5032 11.5080 11.5285 k =-0.2782 0.3920 0.4807 ( 5789 PWs) bands (ev): -7.0193 -7.0193 -6.7851 -6.7837 -6.7463 -6.7449 -6.2986 -6.2949 0.4850 0.5260 0.9108 0.9455 1.7241 1.7856 1.8998 2.0074 2.0180 2.0373 2.6027 2.6412 2.7156 2.7231 2.8684 2.8888 3.2910 3.2924 3.4337 3.4796 3.5227 3.5484 3.6606 3.6705 4.7920 4.7993 4.8608 4.9066 4.9781 4.9801 5.1208 5.1615 5.2305 5.2600 5.3736 5.3762 5.4464 5.5156 5.8155 5.8434 6.1770 6.2120 6.4433 6.4457 9.4667 9.4713 10.0658 10.0925 10.3841 10.3859 10.5525 10.5593 11.4968 11.5127 k =-0.2695 0.3797 0.4656 ( 5803 PWs) bands (ev): -7.0515 -7.0514 -6.7635 -6.7620 -6.7312 -6.7297 -6.2981 -6.2944 0.4750 0.5143 0.9152 0.9525 1.7088 1.7763 1.8906 2.0131 2.0525 2.0647 2.5706 2.6074 2.6833 2.6890 2.8600 2.8787 3.2898 3.2906 3.4370 3.4776 3.5236 3.5508 3.6797 3.6829 4.7924 4.8003 4.8611 4.9074 4.9797 4.9819 5.1194 5.1631 5.2278 5.2569 5.3781 5.3804 5.4429 5.5130 5.8325 5.8610 6.1683 6.2028 6.4474 6.4514 9.5298 9.5338 10.0740 10.0979 10.3734 10.3734 10.6000 10.6074 11.4731 11.4855 k =-0.2608 0.3675 0.4506 ( 5807 PWs) bands (ev): -7.0851 -7.0850 -6.7417 -6.7402 -6.7141 -6.7126 -6.2977 -6.2940 0.4628 0.5004 0.9174 0.9572 1.6909 1.7531 1.9014 2.0177 2.0897 2.1050 2.5406 2.5745 2.6510 2.6548 2.8531 2.8706 3.2880 3.2887 3.4396 3.4756 3.5235 3.5524 3.6943 3.6973 4.7929 4.8008 4.8617 4.9080 4.9811 4.9829 5.1161 5.1625 5.2248 5.2531 5.3854 5.3877 5.4406 5.5119 5.8521 5.8813 6.1567 6.1903 6.4499 6.4559 9.5944 9.5978 10.0790 10.0999 10.3619 10.3642 10.6393 10.6474 11.4337 11.4437 k =-0.2521 0.3552 0.4356 ( 5811 PWs) bands (ev): -7.1195 -7.1194 -6.7197 -6.7182 -6.6957 -6.6942 -6.2974 -6.2937 0.4486 0.4842 0.9181 0.9601 1.6710 1.7236 1.9247 2.0286 2.1272 2.1482 2.5142 2.5435 2.6191 2.6209 2.8478 2.8645 3.2856 3.2865 3.4414 3.4735 3.5223 3.5530 3.7045 3.7134 4.7936 4.8009 4.8627 4.9084 4.9823 4.9831 5.1110 5.1597 5.2212 5.2486 5.3949 5.3973 5.4393 5.5121 5.8743 5.9041 6.1428 6.1747 6.4512 6.4595 9.6603 9.6630 10.0816 10.0995 10.3528 10.3575 10.6700 10.6788 11.3773 11.3856 k =-0.2434 0.3430 0.4206 ( 5827 PWs) bands (ev): -7.1542 -7.1541 -6.6977 -6.6961 -6.6765 -6.6750 -6.2971 -6.2934 0.4326 0.4662 0.9176 0.9618 1.6504 1.6931 1.9551 2.0455 2.1617 2.1910 2.4937 2.5157 2.5878 2.5886 2.8440 2.8602 3.2828 3.2839 3.4425 3.4714 3.5200 3.5528 3.7133 3.7276 4.7942 4.8005 4.8641 4.9087 4.9825 4.9834 5.1042 5.1551 5.2168 5.2436 5.4063 5.4082 5.4391 5.5132 5.8990 5.9292 6.1271 6.1565 6.4518 6.4628 9.7274 9.7293 10.0827 10.0976 10.3470 10.3542 10.6914 10.7010 11.3048 11.3121 k =-0.2347 0.3307 0.4056 ( 5819 PWs) bands (ev): -7.1889 -7.1888 -6.6756 -6.6740 -6.6568 -6.6552 -6.2969 -6.2933 0.4150 0.4465 0.9164 0.9626 1.6298 1.6637 1.9900 2.0669 2.1890 2.2297 2.4819 2.4932 2.5568 2.5610 2.8417 2.8577 3.2796 3.2811 3.4427 3.4695 3.5166 3.5518 3.7205 3.7399 4.7947 4.7995 4.8661 4.9090 4.9813 4.9844 5.0962 5.1491 5.2117 5.2377 5.4188 5.4191 5.4407 5.5151 5.9262 5.9561 6.1107 6.1361 6.4523 6.4664 9.7952 9.7965 10.0827 10.0948 10.3452 10.3550 10.7024 10.7130 11.2191 11.2255 k =-0.2260 0.3185 0.3905 ( 5815 PWs) bands (ev): -7.2233 -7.2232 -6.6536 -6.6520 -6.6367 -6.6352 -6.2968 -6.2932 0.3960 0.4255 0.9150 0.9629 1.6103 1.6364 2.0280 2.0913 2.2046 2.2586 2.4781 2.4785 2.5326 2.5403 2.8410 2.8570 3.2759 3.2778 3.4420 3.4676 3.5119 3.5502 3.7260 3.7501 4.7952 4.7980 4.8685 4.9095 4.9795 4.9852 5.0870 5.1420 5.2056 5.2308 5.4259 5.4328 5.4462 5.5174 5.9559 5.9834 6.0954 6.1143 6.4531 6.4707 9.8636 9.8642 10.0818 10.0915 10.3477 10.3602 10.7012 10.7128 11.1246 11.1300 k =-0.2173 0.3062 0.3755 ( 5823 PWs) bands (ev): -7.2572 -7.2572 -6.6317 -6.6301 -6.6165 -6.6149 -6.2968 -6.2932 0.3758 0.4034 0.9135 0.9631 1.5923 1.6116 2.0681 2.1169 2.2065 2.2717 2.4678 2.4692 2.5316 2.5356 2.8418 2.8580 3.2718 3.2740 3.4402 3.4659 3.5060 3.5479 3.7295 3.7581 4.7953 4.7959 4.8712 4.9101 4.9769 4.9858 5.0769 5.1340 5.1987 5.2226 5.4281 5.4467 5.4563 5.5198 5.9877 6.0073 6.0861 6.0920 6.4550 6.4763 9.9320 9.9324 10.0794 10.0875 10.3548 10.3701 10.6846 10.6975 11.0279 11.0317 k =-0.2086 0.2940 0.3605 ( 5827 PWs) bands (ev): -7.2906 -7.2906 -6.6099 -6.6084 -6.5962 -6.5946 -6.2968 -6.2933 0.3548 0.3805 0.9124 0.9636 1.5764 1.5896 2.1086 2.1412 2.1969 2.2686 2.4477 2.4561 2.5548 2.5583 2.8443 2.8608 3.2671 3.2697 3.4374 3.4643 3.4989 3.5451 3.7310 3.7638 4.7933 4.7953 4.8743 4.9110 4.9734 4.9862 5.0662 5.1253 5.1912 5.2133 5.4276 5.4602 5.4678 5.5221 6.0184 6.0216 6.0703 6.0931 6.4583 6.4835 9.9986 10.0005 10.0746 10.0834 10.3665 10.3846 10.6471 10.6615 10.9381 10.9398 k =-0.1999 0.2817 0.3455 ( 5827 PWs) bands (ev): -7.3233 -7.3232 -6.5885 -6.5869 -6.5760 -6.5745 -6.2970 -6.2935 0.3330 0.3569 0.9119 0.9644 1.5629 1.5705 2.1469 2.1611 2.1809 2.2548 2.4253 2.4461 2.5912 2.5980 2.8487 2.8656 3.2619 3.2647 3.4335 3.4629 3.4905 3.5419 3.7304 3.7670 4.7903 4.7949 4.8775 4.9124 4.9690 4.9863 5.0553 5.1161 5.1833 5.2028 5.4256 5.4725 5.4786 5.5240 6.0152 6.0487 6.0590 6.1188 6.4636 6.4929 10.0483 10.0634 10.0702 10.0920 10.3825 10.4036 10.5832 10.5983 10.8651 10.8657 k =-0.1913 0.2695 0.3305 ( 5821 PWs) bands (ev): -7.3551 -7.3551 -6.5673 -6.5658 -6.5560 -6.5545 -6.2971 -6.2937 0.3107 0.3329 0.9120 0.9658 1.5519 1.5545 2.1551 2.1724 2.1866 2.2369 2.4085 2.4436 2.6354 2.6428 2.8556 2.8729 3.2561 3.2591 3.4283 3.4617 3.4809 3.5385 3.7277 3.7678 4.7867 4.7941 4.8806 4.9142 4.9635 4.9859 5.0446 5.1061 5.1754 5.1917 5.4225 5.4826 5.4874 5.5252 6.0083 6.0331 6.0956 6.1539 6.4713 6.5047 10.0454 10.0498 10.1335 10.1456 10.4019 10.4270 10.4958 10.5092 10.8120 10.8145 k =-0.1826 0.2572 0.3154 ( 5817 PWs) bands (ev): -7.3860 -7.3860 -6.5466 -6.5450 -6.5363 -6.5348 -6.2974 -6.2940 0.2882 0.3088 0.9130 0.9679 1.5415 1.5437 2.1333 2.1713 2.2106 2.2195 2.4031 2.4519 2.6816 2.6880 2.8661 2.8835 3.2497 3.2527 3.4219 3.4605 3.4704 3.5349 3.7228 3.7662 4.7826 4.7929 4.8831 4.9164 4.9568 4.9849 5.0349 5.0953 5.1675 5.1803 5.4183 5.4897 5.4936 5.5256 6.0040 6.0212 6.1346 6.1930 6.4816 6.5192 10.0225 10.0249 10.1895 10.2029 10.3908 10.4090 10.4340 10.4544 10.7761 10.7805 k =-0.1739 0.2450 0.3004 ( 5813 PWs) bands (ev): -7.4160 -7.4159 -6.5263 -6.5248 -6.5169 -6.5154 -6.2976 -6.2944 0.2656 0.2846 0.9149 0.9708 1.5315 1.5382 2.1098 2.1579 2.2043 2.2204 2.4146 2.4708 2.7254 2.7294 2.8823 2.8990 3.2426 3.2455 3.4142 3.4563 3.4620 3.5314 3.7158 3.7620 4.7780 4.7912 4.8843 4.9191 4.9496 4.9832 5.0265 5.0835 5.1602 5.1695 5.4129 5.4930 5.4964 5.5249 6.0050 6.0156 6.1750 6.2345 6.4946 6.5363 9.9867 9.9880 10.1921 10.2119 10.3418 10.3493 10.4577 10.4848 10.7531 10.7598 k =-0.1652 0.2327 0.2854 ( 5817 PWs) bands (ev): -7.4448 -7.4448 -6.5065 -6.5050 -6.4980 -6.4966 -6.2980 -6.2948 0.2430 0.2606 0.9178 0.9745 1.5245 1.5356 2.0866 2.1375 2.1893 2.2158 2.4421 2.4980 2.7627 2.7628 2.9069 2.9214 3.2348 3.2376 3.4053 3.4445 3.4605 3.5280 3.7068 3.7555 4.7729 4.7891 4.8829 4.9221 4.9431 4.9805 5.0199 5.0705 5.1536 5.1600 5.4064 5.4920 5.4958 5.5229 6.0125 6.0174 6.2164 6.2774 6.5105 6.5561 9.9371 9.9372 10.1005 10.1201 10.3793 10.3869 10.4871 10.5178 10.7414 10.7509 k =-0.1565 0.2205 0.2704 ( 5817 PWs) bands (ev): -7.4726 -7.4725 -6.4873 -6.4859 -6.4795 -6.4782 -6.2984 -6.2953 0.2207 0.2370 0.9218 0.9790 1.5204 1.5357 2.0641 2.1146 2.1733 2.2025 2.4794 2.5301 2.7861 2.7911 2.9408 2.9523 3.2262 3.2288 3.3954 3.4311 3.4602 3.5247 3.6960 3.7467 4.7672 4.7864 4.8778 4.9254 4.9387 4.9769 5.0151 5.0566 5.1479 5.1526 5.3986 5.4866 5.4919 5.5196 6.0271 6.0273 6.2586 6.3213 6.5291 6.5785 9.8719 9.8734 9.9832 10.0014 10.4411 10.4505 10.5181 10.5520 10.7407 10.7530 k =-0.1478 0.2082 0.2554 ( 5803 PWs) bands (ev): -7.4991 -7.4990 -6.4687 -6.4674 -6.4617 -6.4604 -6.2988 -6.2958 0.1989 0.2139 0.9267 0.9842 1.5192 1.5386 2.0430 2.0912 2.1571 2.1855 2.5209 2.5643 2.8004 2.8107 2.9816 2.9905 3.2171 3.2194 3.3848 3.4170 3.4602 3.5218 3.6838 3.7359 4.7611 4.7833 4.8689 4.9285 4.9370 4.9723 5.0120 5.0422 5.1433 5.1477 5.3898 5.4773 5.4853 5.5152 6.0453 6.0488 6.3013 6.3656 6.5504 6.6030 9.7932 9.7962 9.8621 9.8791 10.5054 10.5186 10.5492 10.5848 10.7501 10.7650 k =-0.1391 0.1960 0.2403 ( 5795 PWs) bands (ev): -7.5244 -7.5243 -6.4509 -6.4496 -6.4445 -6.4433 -6.2992 -6.2964 0.1776 0.1914 0.9325 0.9902 1.5207 1.5441 2.0236 2.0683 2.1413 2.1675 2.5634 2.5985 2.8087 2.8234 3.0256 3.0331 3.2075 3.2098 3.3737 3.4027 3.4606 3.5191 3.6704 3.7234 4.7545 4.7797 4.8576 4.9308 4.9370 4.9667 5.0106 5.0284 5.1399 5.1454 5.3798 5.4647 5.4767 5.5096 6.0710 6.0772 6.3442 6.4098 6.5741 6.6296 9.7028 9.7075 9.7419 9.7575 10.5520 10.5867 10.5900 10.6110 10.7688 10.7857 k =-0.1304 0.1837 0.2253 ( 5795 PWs) bands (ev): -7.5483 -7.5483 -6.4339 -6.4327 -6.4280 -6.4269 -6.2996 -6.2970 0.1570 0.1697 0.9392 0.9967 1.5246 1.5520 2.0059 2.0463 2.1266 2.1500 2.6045 2.6307 2.8127 2.8315 3.0695 3.0773 3.1980 3.2008 3.3626 3.3886 3.4612 3.5166 3.6563 3.7096 4.7477 4.7754 4.8450 4.9314 4.9374 4.9599 5.0108 5.0168 5.1380 5.1457 5.3690 5.4500 5.4667 5.5026 6.1036 6.1118 6.3871 6.4535 6.6002 6.6578 9.6029 9.6098 9.6246 9.6382 10.5518 10.6088 10.6518 10.6567 10.7960 10.8078 k =-0.1217 0.1715 0.2103 ( 5787 PWs) bands (ev): -7.5710 -7.5709 -6.4176 -6.4165 -6.4122 -6.4112 -6.3001 -6.2976 0.1372 0.1488 0.9467 1.0036 1.5308 1.5621 1.9903 2.0256 2.1137 2.1339 2.6423 2.6589 2.8134 2.8360 3.1101 3.1209 3.1892 3.1947 3.3520 3.3752 3.4622 3.5145 3.6419 3.6949 4.7407 4.7707 4.8325 4.9295 4.9373 4.9514 5.0096 5.0129 5.1376 5.1482 5.3574 5.4343 5.4558 5.4944 6.1424 6.1519 6.4297 6.4963 6.6282 6.6872 9.4971 9.5059 9.5099 9.5216 10.5045 10.5586 10.7146 10.7192 10.7874 10.8063 k =-0.1130 0.1592 0.1953 ( 5787 PWs) bands (ev): -7.5922 -7.5922 -6.4023 -6.4013 -6.3973 -6.3964 -6.3006 -6.2982 0.1183 0.1290 0.9549 1.0108 1.5391 1.5740 1.9769 2.0065 2.1028 2.1198 2.6749 2.6816 2.8113 2.8377 3.1399 3.1619 3.1827 3.1984 3.3427 3.3629 3.4634 3.5127 3.6277 3.6796 4.7339 4.7655 4.8204 4.9252 4.9362 4.9407 5.0082 5.0167 5.1390 5.1528 5.3452 5.4182 5.4444 5.4849 6.1867 6.1968 6.4717 6.5374 6.6581 6.7173 9.3903 9.3958 9.3977 9.4087 10.4256 10.4728 10.7706 10.7729 10.7999 10.8235 k =-0.1043 0.1470 0.1802 ( 5789 PWs) bands (ev): -7.6120 -7.6120 -6.3879 -6.3870 -6.3832 -6.3825 -6.3010 -6.2988 0.1005 0.1102 0.9635 1.0181 1.5490 1.5874 1.9657 1.9894 2.0941 2.1080 2.6971 2.7003 2.8068 2.8364 3.1505 3.1757 3.2030 3.2210 3.3355 3.3524 3.4650 3.5112 3.6139 3.6643 4.7276 4.7598 4.8092 4.9188 4.9285 4.9338 5.0119 5.0220 5.1419 5.1590 5.3326 5.4025 5.4328 5.4740 6.2355 6.2461 6.5128 6.5767 6.6893 6.7477 9.2796 9.2843 9.2877 9.3030 10.3364 10.3778 10.8149 10.8163 10.8294 10.8536 k =-0.0956 0.1347 0.1652 ( 5791 PWs) bands (ev): -7.6303 -7.6303 -6.3744 -6.3737 -6.3701 -6.3694 -6.3015 -6.2994 0.0839 0.0926 0.9726 1.0253 1.5604 1.6018 1.9569 1.9746 2.0877 2.0988 2.7050 2.7168 2.8000 2.8314 3.1523 3.1749 3.2370 3.2527 3.3317 3.3441 3.4670 3.5099 3.6011 3.6493 4.7220 4.7537 4.7990 4.9097 4.9174 4.9305 5.0194 5.0286 5.1464 5.1665 5.3198 5.3878 5.4212 5.4619 6.2883 6.2989 6.5527 6.6136 6.7216 6.7779 9.1636 9.1684 9.1893 9.2038 10.2471 10.2839 10.8497 10.8524 10.8643 10.8860 k =-0.0869 0.1225 0.1502 ( 5795 PWs) bands (ev): -7.6472 -7.6472 -6.3620 -6.3615 -6.3579 -6.3574 -6.3019 -6.3000 0.0684 0.0763 0.9818 1.0321 1.5727 1.6166 1.9505 1.9625 2.0838 2.0925 2.7053 2.7234 2.7908 2.8222 3.1547 3.1776 3.2649 3.2840 3.3333 3.3387 3.4696 3.5091 3.5893 3.6350 4.7172 4.7475 4.7898 4.8974 4.9094 4.9263 5.0294 5.0362 5.1524 5.1752 5.3066 5.3741 5.4096 5.4485 6.3441 6.3547 6.5912 6.6481 6.7544 6.8075 9.0476 9.0525 9.0972 9.1109 10.1615 10.1943 10.8815 10.8841 10.8964 10.9170 k =-0.0782 0.1102 0.1352 ( 5791 PWs) bands (ev): -7.6625 -7.6625 -6.3507 -6.3503 -6.3467 -6.3464 -6.3023 -6.3006 0.0543 0.0612 0.9911 1.0385 1.5855 1.6311 1.9465 1.9534 2.0823 2.0892 2.6992 2.7207 2.7786 2.8081 3.1604 3.1838 3.2839 3.3098 3.3387 3.3431 3.4729 3.5088 3.5790 3.6215 4.7135 4.7411 4.7818 4.8842 4.9031 4.9216 5.0414 5.0447 5.1595 5.1848 5.2932 5.3618 5.3983 5.4340 6.4021 6.4125 6.6282 6.6802 6.7870 6.8359 8.9332 8.9380 9.0119 9.0247 10.0816 10.1108 10.9109 10.9124 10.9246 10.9453 k =-0.0695 0.0980 0.1202 ( 5797 PWs) bands (ev): -7.6763 -7.6763 -6.3405 -6.3401 -6.3366 -6.3364 -6.3027 -6.3012 0.0415 0.0476 1.0003 1.0442 1.5985 1.6444 1.9449 1.9476 2.0830 2.0887 2.6881 2.7110 2.7627 2.7895 3.1694 3.1923 3.2951 3.3226 3.3506 3.3595 3.4770 3.5090 3.5701 3.6091 4.7108 4.7349 4.7751 4.8711 4.8979 4.9168 5.0539 5.0548 5.1672 5.1949 5.2794 5.3508 5.3873 5.4184 6.4611 6.4713 6.6635 6.7097 6.8187 6.8628 8.8216 8.8264 8.9340 8.9458 10.0085 10.0342 10.9375 10.9376 10.9492 10.9700 k =-0.0609 0.0857 0.1051 ( 5795 PWs) bands (ev): -7.6885 -7.6885 -6.3314 -6.3312 -6.3276 -6.3274 -6.3030 -6.3017 0.0301 0.0354 1.0092 1.0490 1.6111 1.6560 1.9453 1.9455 2.0859 2.0910 2.6736 2.6966 2.7432 2.7672 3.1802 3.2016 3.3034 3.3270 3.3693 3.3774 3.4822 3.5099 3.5627 3.5978 4.7088 4.7289 4.7699 4.8584 4.8936 4.9119 5.0638 5.0696 5.1753 5.2055 5.2653 5.3412 5.3768 5.4019 6.5197 6.5297 6.6972 6.7370 6.8489 6.8875 8.7145 8.7192 8.8641 8.8747 9.9428 9.9652 10.9597 10.9607 10.9705 10.9906 k =-0.0522 0.0735 0.0901 ( 5805 PWs) bands (ev): -7.6991 -7.6991 -6.3235 -6.3233 -6.3198 -6.3196 -6.3033 -6.3022 0.0201 0.0247 1.0178 1.0530 1.6231 1.6653 1.9464 1.9481 2.0906 2.0955 2.6572 2.6794 2.7212 2.7427 3.1915 3.2102 3.3119 3.3311 3.3860 3.3935 3.4884 3.5116 3.5568 3.5877 4.7075 4.7234 4.7663 4.8462 4.8902 4.9071 5.0744 5.0853 5.1830 5.2163 5.2507 5.3331 5.3668 5.3847 6.5759 6.5857 6.7295 6.7625 6.8769 6.9098 8.6137 8.6181 8.8025 8.8119 9.8851 9.9043 10.9789 10.9804 10.9884 11.0071 k =-0.0435 0.0612 0.0751 ( 5805 PWs) bands (ev): -7.7081 -7.7081 -6.3168 -6.3167 -6.3130 -6.3130 -6.3034 -6.3026 0.0117 0.0155 1.0257 1.0559 1.6341 1.6719 1.9503 1.9523 2.0967 2.1017 2.6404 2.6610 2.6985 2.7176 3.2021 3.2174 3.3212 3.3363 3.3992 3.4064 3.4954 3.5138 3.5525 3.5788 4.7066 4.7185 4.7648 4.8346 4.8877 4.9026 5.0858 5.1016 5.1897 5.2272 5.2359 5.3265 5.3575 5.3672 6.6271 6.6370 6.7609 6.7866 6.9022 6.9293 8.5210 8.5252 8.7497 8.7577 9.8358 9.8518 10.9951 10.9966 11.0033 11.0196 k =-0.0348 0.0490 0.0601 ( 5801 PWs) bands (ev): -7.7155 -7.7155 -6.3114 -6.3112 -6.3075 -6.3075 -6.3035 -6.3029 0.0049 0.0079 1.0330 1.0577 1.6439 1.6758 1.9560 1.9575 2.1037 2.1087 2.6244 2.6425 2.6772 2.6936 3.2110 3.2228 3.3307 3.3421 3.4090 3.4158 3.5026 3.5164 3.5496 3.5711 4.7059 4.7143 4.7653 4.8235 4.8861 4.8985 5.0980 5.1182 5.1947 5.2205 5.2385 5.3217 5.3488 5.3496 6.6706 6.6805 6.7916 6.8101 6.9245 6.9456 8.4391 8.4427 8.7061 8.7127 9.7954 9.8082 11.0084 11.0094 11.0152 11.0284 k =-0.0261 0.0367 0.0451 ( 5799 PWs) bands (ev): -7.7213 -7.7213 -6.3073 -6.3071 -6.3035 -6.3032 -6.3031 -6.3030 -0.0004 0.0018 1.0396 1.0584 1.6525 1.6773 1.9622 1.9630 2.1109 2.1156 2.6108 2.6253 2.6591 2.6721 3.2181 3.2266 3.3396 3.3477 3.4160 3.4219 3.5093 3.5189 3.5483 3.5645 4.7054 4.7109 4.7679 4.8130 4.8853 4.8949 5.1108 5.1343 5.1970 5.2055 5.2496 5.3188 5.3322 5.3409 6.7044 6.7135 6.8209 6.8327 6.9432 6.9585 8.3707 8.3736 8.6721 8.6771 9.7640 9.7736 11.0188 11.0192 11.0244 11.0340 k =-0.0174 0.0245 0.0300 ( 5793 PWs) bands (ev): -7.7254 -7.7254 -6.3050 -6.3046 -6.3027 -6.3027 -6.3001 -6.3001 -0.0041 -0.0026 1.0452 1.0579 1.6599 1.6768 1.9677 1.9679 2.1174 2.1211 2.6006 2.6106 2.6459 2.6549 3.2234 3.2288 3.3470 3.3522 3.4209 3.4253 3.5149 3.5208 3.5483 3.5592 4.7050 4.7083 4.7723 4.8031 4.8852 4.8918 5.1242 5.1486 5.1913 5.1960 5.2611 5.3155 5.3182 5.3338 6.7280 6.7352 6.8461 6.8527 6.9579 6.9677 8.3188 8.3209 8.6478 8.6512 9.7419 9.7483 11.0262 11.0263 11.0309 11.0371 k =-0.0087 0.0122 0.0150 ( 5783 PWs) bands (ev): -7.7279 -7.7279 -6.3044 -6.3042 -6.3015 -6.3014 -6.2982 -6.2982 -0.0062 -0.0054 1.0500 1.0564 1.6660 1.6746 1.9713 1.9714 2.1224 2.1245 2.5950 2.6000 2.6385 2.6430 3.2270 3.2296 3.3522 3.3548 3.4241 3.4265 3.5188 3.5216 3.5495 3.5549 4.7050 4.7065 4.7783 4.7940 4.8859 4.8892 5.1379 5.1568 5.1821 5.1916 5.2732 5.3002 5.3195 5.3277 6.7425 6.7464 6.8635 6.8663 6.9680 6.9727 8.2864 8.2876 8.6335 8.6352 9.7292 9.7324 11.0307 11.0308 11.0350 11.0380 k = 0.0000 0.0000 0.0000 ( 5783 PWs) bands (ev): -7.7287 -7.7287 -6.3043 -6.3043 -6.3009 -6.3009 -6.2976 -6.2976 -0.0066 -0.0066 1.0537 1.0537 1.6709 1.6709 1.9726 1.9726 2.1249 2.1249 2.5947 2.5947 2.6375 2.6375 3.2290 3.2290 3.3549 3.3549 3.4260 3.4260 3.5210 3.5210 3.5517 3.5517 4.7054 4.7054 4.7856 4.7856 4.8873 4.8873 5.1507 5.1507 5.1849 5.1849 5.2861 5.2861 5.3228 5.3228 6.7485 6.7485 6.8704 6.8704 6.9729 6.9729 8.2758 8.2758 8.6293 8.6293 9.7260 9.7260 11.0323 11.0323 11.0372 11.0372 k = 0.0000 0.0000 0.0000 ( 5783 PWs) bands (ev): -7.7287 -7.7287 -6.3043 -6.3043 -6.3009 -6.3009 -6.2976 -6.2976 -0.0066 -0.0066 1.0537 1.0537 1.6709 1.6709 1.9726 1.9726 2.1249 2.1249 2.5947 2.5947 2.6375 2.6375 3.2290 3.2290 3.3549 3.3549 3.4260 3.4260 3.5210 3.5210 3.5517 3.5517 4.7054 4.7054 4.7856 4.7856 4.8873 4.8873 5.1507 5.1507 5.1849 5.1849 5.2861 5.2861 5.3228 5.3228 6.7485 6.7485 6.8704 6.8704 6.9729 6.9729 8.2758 8.2758 8.6293 8.6293 9.7260 9.7260 11.0323 11.0323 11.0372 11.0372 k = 0.0172 0.0122 0.0000 ( 5783 PWs) bands (ev): -7.7279 -7.7279 -6.3055 -6.3055 -6.3011 -6.3011 -6.2977 -6.2977 -0.0055 -0.0055 1.0506 1.0506 1.6667 1.6667 1.9792 1.9792 2.1289 2.1289 2.5957 2.5957 2.6385 2.6385 3.2290 3.2290 3.3548 3.3548 3.4255 3.4255 3.5211 3.5211 3.5502 3.5502 4.7039 4.7039 4.7882 4.7882 4.8871 4.8871 5.1504 5.1504 5.1859 5.1859 5.2865 5.2865 5.3231 5.3231 6.7460 6.7460 6.8679 6.8679 6.9647 6.9647 8.2876 8.2876 8.6308 8.6308 9.7273 9.7273 11.0192 11.0192 11.0237 11.0237 k = 0.0345 0.0245 0.0000 ( 5771 PWs) bands (ev): -7.7254 -7.7254 -6.3095 -6.3095 -6.3013 -6.3013 -6.2978 -6.2978 -0.0020 -0.0020 1.0414 1.0414 1.6549 1.6549 1.9977 1.9977 2.1406 2.1406 2.5986 2.5986 2.6415 2.6415 3.2290 3.2290 3.3546 3.3546 3.4238 3.4238 3.5212 3.5212 3.5460 3.5460 4.6999 4.6999 4.7953 4.7953 4.8869 4.8869 5.1495 5.1495 5.1890 5.1890 5.2876 5.2876 5.3239 5.3239 6.7385 6.7385 6.8606 6.8606 6.9409 6.9409 8.3223 8.3223 8.6353 8.6353 9.7313 9.7313 10.9808 10.9808 10.9843 10.9843 k = 0.0517 0.0367 0.0000 ( 5771 PWs) bands (ev): -7.7213 -7.7213 -6.3163 -6.3163 -6.3016 -6.3016 -6.2980 -6.2980 0.0036 0.0036 1.0266 1.0266 1.6381 1.6381 2.0258 2.0258 2.1595 2.1595 2.6035 2.6035 2.6466 2.6466 3.2289 3.2289 3.3543 3.3543 3.4209 3.4209 3.5213 3.5213 3.5391 3.5391 4.6945 4.6945 4.8058 4.8058 4.8862 4.8862 5.1478 5.1478 5.1940 5.1940 5.2895 5.2895 5.3256 5.3256 6.7258 6.7258 6.8485 6.8485 6.9044 6.9044 8.3772 8.3772 8.6428 8.6428 9.7379 9.7379 10.9193 10.9193 10.9226 10.9226 k = 0.0690 0.0489 0.0000 ( 5787 PWs) bands (ev): -7.7155 -7.7155 -6.3258 -6.3258 -6.3019 -6.3019 -6.2983 -6.2983 0.0114 0.0114 1.0069 1.0069 1.6187 1.6187 2.0612 2.0612 2.1848 2.1848 2.6104 2.6104 2.6536 2.6536 3.2287 3.2287 3.3538 3.3538 3.4163 3.4163 3.5212 3.5212 3.5301 3.5301 4.6886 4.6886 4.8185 4.8185 4.8852 4.8852 5.1451 5.1451 5.2008 5.2008 5.2922 5.2922 5.3281 5.3281 6.7079 6.7079 6.8317 6.8317 6.8588 6.8588 8.4488 8.4488 8.6533 8.6533 9.7470 9.7470 10.8386 10.8386 10.8427 10.8427 k = 0.0862 0.0612 0.0000 ( 5783 PWs) bands (ev): -7.7081 -7.7081 -6.3380 -6.3380 -6.3022 -6.3022 -6.2987 -6.2987 0.0211 0.0211 0.9832 0.9832 1.5986 1.5986 2.1019 2.1019 2.2156 2.2156 2.6190 2.6190 2.6625 2.6625 3.2284 3.2284 3.3532 3.3532 3.4096 3.4096 3.5177 3.5177 3.5231 3.5231 4.6829 4.6829 4.8328 4.8328 4.8840 4.8840 5.1414 5.1414 5.2096 5.2096 5.2956 5.2956 5.3319 5.3319 6.6842 6.6842 6.8072 6.8072 6.8113 6.8113 8.5338 8.5338 8.6668 8.6668 9.7588 9.7588 10.7430 10.7430 10.7482 10.7482 k = 0.1034 0.0734 0.0000 ( 5791 PWs) bands (ev): -7.6990 -7.6990 -6.3527 -6.3527 -6.3026 -6.3026 -6.2992 -6.2992 0.0327 0.0327 0.9563 0.9563 1.5791 1.5791 2.1466 2.1466 2.2509 2.2509 2.6296 2.6296 2.6732 2.6732 3.2281 3.2281 3.3525 3.3525 3.4001 3.4001 3.5067 3.5067 3.5228 3.5228 4.6776 4.6776 4.8478 4.8478 4.8828 4.8828 5.1364 5.1364 5.2202 5.2202 5.2998 5.2998 5.3374 5.3374 6.6537 6.6537 6.7554 6.7554 6.7859 6.7859 8.6292 8.6292 8.6833 8.6833 9.7731 9.7731 10.6364 10.6364 10.6426 10.6426 k = 0.1207 0.0857 0.0000 ( 5798 PWs) bands (ev): -7.6884 -7.6884 -6.3699 -6.3699 -6.3031 -6.3031 -6.2997 -6.2997 0.0458 0.0458 0.9269 0.9269 1.5612 1.5612 2.1942 2.1942 2.2898 2.2898 2.6418 2.6418 2.6858 2.6858 3.2276 3.2276 3.3515 3.3515 3.3869 3.3869 3.4952 3.4952 3.5230 3.5230 4.6730 4.6730 4.8624 4.8624 4.8823 4.8823 5.1301 5.1301 5.2323 5.2323 5.3046 5.3046 5.3449 5.3449 6.6154 6.6154 6.7056 6.7056 6.7572 6.7572 8.7025 8.7025 8.7327 8.7327 9.7898 9.7898 10.5222 10.5222 10.5292 10.5292 k = 0.1379 0.0979 0.0000 ( 5794 PWs) bands (ev): -7.6761 -7.6761 -6.3894 -6.3894 -6.3036 -6.3036 -6.3003 -6.3003 0.0604 0.0604 0.8959 0.8959 1.5457 1.5457 2.2440 2.2440 2.3316 2.3316 2.6558 2.6558 2.7001 2.7001 3.2270 3.2270 3.3498 3.3498 3.3696 3.3696 3.4848 3.4848 3.5234 3.5234 4.6692 4.6692 4.8720 4.8720 4.8866 4.8866 5.1226 5.1226 5.2459 5.2459 5.3103 5.3103 5.3546 5.3546 6.5690 6.5690 6.6603 6.6603 6.7253 6.7253 8.7250 8.7250 8.8417 8.8417 9.8089 9.8089 10.4029 10.4029 10.4105 10.4105 k = 0.1552 0.1101 0.0000 ( 5802 PWs) bands (ev): -7.6623 -7.6623 -6.4112 -6.4112 -6.3042 -6.3042 -6.3010 -6.3010 0.0760 0.0760 0.8636 0.8636 1.5331 1.5331 2.2953 2.2953 2.3755 2.3755 2.6714 2.6714 2.7161 2.7161 3.2259 3.2259 3.3417 3.3417 3.3540 3.3540 3.4760 3.4760 3.5239 3.5239 4.6663 4.6663 4.8727 4.8727 4.8993 4.8993 5.1137 5.1137 5.2606 5.2606 5.3171 5.3171 5.3666 5.3666 6.5170 6.5170 6.6185 6.6185 6.6907 6.6907 8.7504 8.7504 8.9548 8.9548 9.8301 9.8301 10.2806 10.2806 10.2887 10.2887 k = 0.1724 0.1224 0.0000 ( 5798 PWs) bands (ev): -7.6469 -7.6469 -6.4350 -6.4350 -6.3048 -6.3048 -6.3017 -6.3017 0.0924 0.0924 0.8308 0.8308 1.5239 1.5239 2.3473 2.3473 2.4209 2.4209 2.6885 2.6885 2.7336 2.7336 3.2241 3.2241 3.3173 3.3173 3.3504 3.3504 3.4689 3.4689 3.5243 3.5243 4.6642 4.6642 4.8707 4.8707 4.9135 4.9135 5.1037 5.1037 5.2761 5.2761 5.3256 5.3256 5.3808 5.3808 6.4627 6.4627 6.5785 6.5785 6.6538 6.6538 8.7787 8.7787 9.0704 9.0704 9.8533 9.8533 10.1570 10.1570 10.1656 10.1656 k = 0.1897 0.1346 0.0000 ( 5782 PWs) bands (ev): -7.6299 -7.6299 -6.4609 -6.4609 -6.3055 -6.3055 -6.3024 -6.3024 0.1094 0.1094 0.7978 0.7978 1.5185 1.5185 2.3996 2.3996 2.4671 2.4671 2.7070 2.7070 2.7525 2.7525 3.2203 3.2203 3.2886 3.2886 3.3487 3.3487 3.4634 3.4634 3.5248 3.5248 4.6629 4.6629 4.8681 4.8681 4.9266 4.9266 5.0929 5.0929 5.2919 5.2919 5.3366 5.3366 5.3970 5.3970 6.4084 6.4084 6.5388 6.5388 6.6150 6.6150 8.8100 8.8100 9.1868 9.1868 9.8781 9.8781 10.0335 10.0335 10.0426 10.0426 k = 0.2069 0.1468 0.0000 ( 5782 PWs) bands (ev): -7.6115 -7.6115 -6.4887 -6.4887 -6.3061 -6.3061 -6.3032 -6.3032 0.1266 0.1266 0.7649 0.7649 1.5171 1.5171 2.4516 2.4516 2.5134 2.5134 2.7268 2.7268 2.7728 2.7728 3.2104 3.2104 3.2620 3.2620 3.3471 3.3471 3.4589 3.4589 3.5253 3.5253 4.6625 4.6625 4.8651 4.8651 4.9379 4.9379 5.0816 5.0816 5.3076 5.3076 5.3505 5.3505 5.4149 5.4149 6.3554 6.3554 6.4988 6.4988 6.5749 6.5749 8.8440 8.8440 9.3024 9.3024 9.9002 9.9002 9.9118 9.9118 9.9242 9.9242 k = 0.2241 0.1591 0.0000 ( 5774 PWs) bands (ev): -7.5915 -7.5915 -6.5181 -6.5181 -6.3068 -6.3068 -6.3040 -6.3040 0.1439 0.1439 0.7325 0.7325 1.5201 1.5201 2.5025 2.5025 2.5592 2.5592 2.7476 2.7476 2.7943 2.7943 3.1871 3.1871 3.2461 3.2461 3.3454 3.3454 3.4554 3.4554 3.5256 3.5256 4.6628 4.6628 4.8619 4.8619 4.9464 4.9464 5.0703 5.0703 5.3233 5.3233 5.3675 5.3675 5.4343 5.4343 6.3045 6.3045 6.4586 6.4586 6.5339 6.5339 8.8808 8.8808 9.4151 9.4151 9.7909 9.7909 9.7998 9.7998 9.9322 9.9322 k = 0.2414 0.1713 0.0000 ( 5774 PWs) bands (ev): -7.5701 -7.5701 -6.5491 -6.5491 -6.3075 -6.3075 -6.3048 -6.3048 0.1609 0.1609 0.7007 0.7007 1.5277 1.5277 2.5516 2.5516 2.6037 2.6037 2.7692 2.7692 2.8169 2.8169 3.1526 3.1526 3.2399 3.2399 3.3435 3.3435 3.4527 3.4527 3.5259 3.5259 4.6639 4.6639 4.8585 4.8585 4.9517 4.9517 5.0593 5.0593 5.3395 5.3395 5.3871 5.3871 5.4550 5.4550 6.2559 6.2559 6.4183 6.4183 6.4925 6.4925 8.9202 8.9202 9.5217 9.5217 9.6737 9.6737 9.6841 9.6841 9.9580 9.9580 k = 0.2586 0.1835 0.0000 ( 5782 PWs) bands (ev): -7.5473 -7.5473 -6.5816 -6.5816 -6.3082 -6.3082 -6.3057 -6.3057 0.1774 0.1774 0.6697 0.6697 1.5399 1.5399 2.5979 2.5979 2.6462 2.6462 2.7908 2.7908 2.8404 2.8404 3.1145 3.1145 3.2375 3.2375 3.3412 3.3412 3.4507 3.4507 3.5261 3.5261 4.6657 4.6657 4.8548 4.8548 4.9531 4.9531 5.0493 5.0493 5.3569 5.3569 5.4085 5.4085 5.4767 5.4767 6.2099 6.2099 6.3782 6.3782 6.4512 6.4512 8.9621 8.9621 9.5602 9.5602 9.5635 9.5635 9.6279 9.6279 9.9814 9.9814 k = 0.2759 0.1958 0.0000 ( 5790 PWs) bands (ev): -7.5231 -7.5231 -6.6153 -6.6153 -6.3089 -6.3089 -6.3065 -6.3065 0.1934 0.1934 0.6397 0.6397 1.5570 1.5570 2.6395 2.6395 2.6864 2.6864 2.8112 2.8112 2.8647 2.8647 3.0778 3.0778 3.2365 3.2365 3.3386 3.3386 3.4496 3.4496 3.5262 3.5262 4.6682 4.6682 4.8510 4.8510 4.9507 4.9507 5.0402 5.0402 5.3758 5.3758 5.4313 5.4313 5.4991 5.4991 6.1664 6.1664 6.3386 6.3386 6.4105 6.4105 9.0063 9.0063 9.4510 9.4510 9.4583 9.4583 9.7086 9.7086 9.9991 9.9991 k = 0.2931 0.2080 0.0000 ( 5778 PWs) bands (ev): -7.4976 -7.4976 -6.6501 -6.6501 -6.3096 -6.3096 -6.3073 -6.3073 0.2087 0.2087 0.6108 0.6108 1.5788 1.5788 2.6733 2.6733 2.7244 2.7244 2.8282 2.8283 2.8896 2.8896 3.0478 3.0478 3.2363 3.2363 3.3355 3.3355 3.4492 3.4492 3.5261 3.5261 4.6715 4.6715 4.8470 4.8470 4.9451 4.9451 5.0321 5.0321 5.3964 5.3964 5.4550 5.4550 5.5219 5.5219 6.1252 6.1252 6.3000 6.3000 6.3708 6.3708 9.0526 9.0526 9.3468 9.3468 9.3545 9.3545 9.7708 9.7708 10.0067 10.0067 k = 0.3103 0.2203 0.0000 ( 5778 PWs) bands (ev): -7.4707 -7.4707 -6.6859 -6.6859 -6.3102 -6.3102 -6.3082 -6.3082 0.2232 0.2232 0.5831 0.5831 1.6055 1.6055 2.6936 2.6936 2.7605 2.7605 2.8399 2.8399 2.9153 2.9153 3.0307 3.0307 3.2366 3.2366 3.3319 3.3319 3.4496 3.4496 3.5258 3.5258 4.6753 4.6753 4.8428 4.8428 4.9370 4.9370 5.0243 5.0243 5.4187 5.4187 5.4790 5.4790 5.5448 5.5448 6.0864 6.0864 6.2629 6.2629 6.3325 6.3325 9.1004 9.1004 9.2482 9.2482 9.2559 9.2559 9.8021 9.8021 9.9991 9.9991 k = 0.3276 0.2325 0.0000 ( 5778 PWs) bands (ev): -7.4426 -7.4426 -6.7225 -6.7225 -6.3108 -6.3108 -6.3089 -6.3089 0.2370 0.2370 0.5566 0.5566 1.6367 1.6367 2.6935 2.6935 2.7948 2.7948 2.8487 2.8487 2.9420 2.9420 3.0299 3.0299 3.2372 3.2372 3.3277 3.3277 3.4509 3.4509 3.5253 3.5253 4.6797 4.6797 4.8383 4.8383 4.9276 4.9276 5.0163 5.0163 5.4423 5.4423 5.5030 5.5030 5.5672 5.5672 6.0495 6.0495 6.2276 6.2276 6.2959 6.2959 9.1461 9.1461 9.1579 9.1579 9.1642 9.1642 9.7996 9.7996 9.9752 9.9752 k = 0.3448 0.2447 0.0000 ( 5778 PWs) bands (ev): -7.4133 -7.4133 -6.7599 -6.7599 -6.3114 -6.3114 -6.3097 -6.3097 0.2501 0.2501 0.5314 0.5314 1.6724 1.6724 2.6707 2.6707 2.8265 2.8265 2.8602 2.8602 2.9698 2.9698 3.0420 3.0420 3.2383 3.2383 3.3229 3.3229 3.4531 3.4531 3.5246 3.5246 4.6848 4.6848 4.8332 4.8332 4.9182 4.9182 5.0078 5.0078 5.4669 5.4669 5.5269 5.5269 5.5889 5.5889 6.0144 6.0144 6.1947 6.1947 6.2614 6.2614 9.0692 9.0692 9.0768 9.0768 9.1994 9.1994 9.7718 9.7718 9.9398 9.9398 k = 0.3621 0.2570 0.0000 ( 5794 PWs) bands (ev): -7.3828 -7.3828 -6.7977 -6.7977 -6.3119 -6.3119 -6.3104 -6.3104 0.2627 0.2627 0.5075 0.5075 1.7123 1.7123 2.6306 2.6306 2.8546 2.8546 2.8753 2.8753 2.9984 2.9984 3.0608 3.0608 3.2396 3.2396 3.3174 3.3174 3.4562 3.4562 3.5235 3.5235 4.6904 4.6904 4.8276 4.8276 4.9095 4.9095 4.9986 4.9986 5.4922 5.4922 5.5502 5.5502 5.6093 5.6093 5.9809 5.9809 6.1646 6.1646 6.2293 6.2293 8.9906 8.9906 8.9978 8.9978 9.2480 9.2480 9.7305 9.7305 9.9007 9.9007 k = 0.3793 0.2692 0.0000 ( 5782 PWs) bands (ev): -7.3513 -7.3513 -6.8360 -6.8360 -6.3124 -6.3124 -6.3110 -6.3110 0.2748 0.2748 0.4849 0.4849 1.7562 1.7562 2.5798 2.5798 2.8788 2.8788 2.8922 2.8922 3.0268 3.0268 3.0819 3.0819 3.2414 3.2414 3.3113 3.3113 3.4600 3.4600 3.5220 3.5220 4.6966 4.6966 4.8211 4.8211 4.9025 4.9025 4.9887 4.9887 5.5178 5.5178 5.5729 5.5729 5.6280 5.6280 5.9488 5.9488 6.1380 6.1380 6.1998 6.1998 8.9197 8.9197 8.9263 8.9263 9.2946 9.2946 9.6845 9.6845 9.8653 9.8653 k = 0.3966 0.2814 0.0000 ( 5774 PWs) bands (ev): -7.3187 -7.3187 -6.8746 -6.8746 -6.3128 -6.3128 -6.3116 -6.3116 0.2866 0.2866 0.4636 0.4636 1.8037 1.8037 2.5230 2.5230 2.8990 2.8990 2.9090 2.9090 3.0545 3.0545 3.1025 3.1025 3.2434 3.2434 3.3047 3.3047 3.4646 3.4646 3.5202 3.5202 4.7035 4.7035 4.8136 4.8136 4.8976 4.8976 4.9781 4.9781 5.5431 5.5431 5.5947 5.5947 5.6446 5.6446 5.9178 5.9178 6.1153 6.1153 6.1731 6.1731 8.8570 8.8570 8.8630 8.8630 9.3370 9.3370 9.6388 9.6388 9.8392 9.8392 k = 0.4138 0.2937 0.0000 ( 5786 PWs) bands (ev): -7.2851 -7.2851 -6.9133 -6.9133 -6.3131 -6.3131 -6.3121 -6.3121 0.2983 0.2983 0.4436 0.4436 1.8545 1.8545 2.4626 2.4626 2.9155 2.9155 2.9244 2.9244 3.0804 3.0804 3.1212 3.1212 3.2456 3.2456 3.2976 3.2976 3.4698 3.4698 3.5178 3.5178 4.7108 4.7108 4.8050 4.8050 4.8951 4.8951 4.9671 4.9671 5.5675 5.5675 5.6154 5.6154 5.6589 5.6589 5.8878 5.8878 6.0968 6.0968 6.1491 6.1491 8.8031 8.8031 8.8083 8.8083 9.3730 9.3730 9.5963 9.5963 9.8268 9.8268 k = 0.4310 0.3059 0.0000 ( 5794 PWs) bands (ev): -7.2507 -7.2507 -6.9521 -6.9521 -6.3134 -6.3134 -6.3126 -6.3126 0.3100 0.3100 0.4248 0.4248 1.9083 1.9083 2.4002 2.4002 2.9292 2.9292 2.9373 2.9373 3.1039 3.1039 3.1370 3.1370 3.2479 3.2479 3.2901 3.2901 3.4754 3.4754 3.5150 3.5150 4.7187 4.7187 4.7955 4.7955 4.8950 4.8950 4.9559 4.9559 5.5902 5.5902 5.6341 5.6341 5.6717 5.6717 5.8586 5.8586 6.0831 6.0831 6.1281 6.1281 8.7583 8.7583 8.7627 8.7627 9.4009 9.4009 9.5583 9.5583 9.8308 9.8308 k = 0.4483 0.3181 0.0000 ( 5766 PWs) bands (ev): -7.2154 -7.2154 -6.9908 -6.9908 -6.3135 -6.3135 -6.3130 -6.3130 0.3220 0.3220 0.4073 0.4073 1.9647 1.9647 2.3366 2.3366 2.9403 2.9403 2.9471 2.9471 3.1242 3.1242 3.1494 3.1494 3.2505 3.2505 3.2826 3.2826 3.4813 3.4813 3.5116 3.5116 4.7272 4.7272 4.7857 4.7857 4.8973 4.8973 4.9449 4.9449 5.6106 5.6106 5.6487 5.6487 5.6855 5.6855 5.8302 5.8302 6.0742 6.0742 6.1101 6.1101 8.7233 8.7233 8.7266 8.7266 9.4209 9.4209 9.5257 9.5257 9.8517 9.8517 k = 0.4655 0.3304 0.0000 ( 5766 PWs) bands (ev): -7.1793 -7.1793 -7.0293 -7.0293 -6.3136 -6.3136 -6.3133 -6.3133 0.3344 0.3344 0.3908 0.3908 2.0233 2.0233 2.2727 2.2727 2.9487 2.9487 2.9537 2.9537 3.1406 3.1406 3.1577 3.1577 3.2534 3.2534 3.2752 3.2752 3.4872 3.4872 3.5077 3.5077 4.7362 4.7362 4.7755 4.7755 4.9016 4.9016 4.9343 4.9343 5.6278 5.6278 5.6560 5.6560 5.7033 5.7033 5.8025 5.8025 6.0701 6.0701 6.0951 6.0951 8.6981 8.6981 8.7004 8.7004 9.4353 9.4353 9.4988 9.4988 9.8874 9.8874 k = 0.4828 0.3426 0.0000 ( 5758 PWs) bands (ev): -7.1426 -7.1426 -7.0675 -7.0675 -6.3137 -6.3137 -6.3135 -6.3135 0.3474 0.3474 0.3754 0.3754 2.0838 2.0838 2.2089 2.2089 2.9544 2.9544 2.9570 2.9570 3.1526 3.1526 3.1612 3.1612 3.2572 3.2572 3.2682 3.2682 3.4929 3.4929 3.5033 3.5033 4.7456 4.7456 4.7654 4.7654 4.9077 4.9077 4.9243 4.9243 5.6414 5.6414 5.6563 5.6563 5.7253 5.7253 5.7756 5.7756 6.0705 6.0705 6.0834 6.0834 8.6831 8.6831 8.6843 8.6843 9.4475 9.4475 9.4774 9.4774 9.9341 9.9341 k = 0.5000 0.3549 0.0000 ( 5742 PWs) bands (ev): -7.1053 -7.1053 -7.1053 -7.1053 -6.3136 -6.3136 -6.3136 -6.3136 0.3610 0.3610 0.3610 0.3610 2.1458 2.1458 2.1458 2.1458 2.9572 2.9572 2.9572 2.9572 3.1596 3.1596 3.1596 3.1596 3.2622 3.2622 3.2622 3.2622 3.4983 3.4983 3.4983 3.4983 4.7553 4.7553 4.7553 4.7553 4.9154 4.9154 4.9154 4.9154 5.6511 5.6511 5.6511 5.6511 5.7497 5.7497 5.7497 5.7497 6.0751 6.0751 6.0751 6.0751 8.6785 8.6785 8.6785 8.6785 9.4608 9.4608 9.4608 9.4608 9.9881 9.9881 k = 0.5000 0.3549 0.0000 ( 5742 PWs) bands (ev): -7.1053 -7.1053 -7.1053 -7.1053 -6.3136 -6.3136 -6.3136 -6.3136 0.3610 0.3610 0.3610 0.3610 2.1458 2.1458 2.1458 2.1458 2.9572 2.9572 2.9572 2.9572 3.1596 3.1596 3.1596 3.1596 3.2622 3.2622 3.2622 3.2622 3.4983 3.4983 3.4983 3.4983 4.7553 4.7553 4.7553 4.7553 4.9154 4.9154 4.9154 4.9154 5.6511 5.6511 5.6511 5.6511 5.7497 5.7497 5.7497 5.7497 6.0751 6.0751 6.0751 6.0751 8.6785 8.6785 8.6785 8.6785 9.4608 9.4608 9.4608 9.4608 9.9881 9.9881 k = 0.4915 0.3668 0.0147 ( 5742 PWs) bands (ev): -7.1048 -7.1048 -7.1047 -7.1047 -6.3149 -6.3149 -6.3137 -6.3135 0.3605 0.3625 0.3627 0.3629 2.1420 2.1428 2.1455 2.1458 2.9515 2.9563 2.9588 2.9598 3.1513 3.1551 3.1632 3.1657 3.2593 3.2598 3.2647 3.2663 3.4966 3.4970 3.4987 3.4992 4.7540 4.7566 4.7571 4.7579 4.9117 4.9137 4.9169 4.9186 5.6410 5.6424 5.6527 5.6528 5.7438 5.7446 5.7611 5.7618 6.0723 6.0729 6.0754 6.0771 8.6792 8.6797 8.6818 8.6833 9.4629 9.4644 9.4648 9.4656 9.9902 9.9908 k = 0.4830 0.3788 0.0294 ( 5756 PWs) bands (ev): -7.1033 -7.1032 -7.1032 -7.1030 -6.3187 -6.3187 -6.3136 -6.3132 0.3612 0.3659 0.3674 0.3679 2.1341 2.1364 2.1419 2.1420 2.9404 2.9500 2.9634 2.9650 3.1411 3.1493 3.1666 3.1697 3.2561 3.2564 3.2690 3.2720 3.4937 3.4951 3.4981 3.4996 4.7534 4.7600 4.7613 4.7636 4.9077 4.9116 4.9181 4.9213 5.6221 5.6249 5.6514 5.6523 5.7404 5.7424 5.7787 5.7804 6.0656 6.0671 6.0770 6.0806 8.6817 8.6827 8.6930 8.6960 9.4711 9.4748 9.4764 9.4788 9.9992 10.0025 k = 0.4745 0.3908 0.0441 ( 5774 PWs) bands (ev): -7.1008 -7.1006 -7.1005 -7.1003 -6.3251 -6.3251 -6.3135 -6.3129 0.3633 0.3703 0.3755 0.3764 2.1225 2.1267 2.1345 2.1355 2.9242 2.9375 2.9707 2.9734 3.1296 3.1418 3.1698 3.1719 3.2516 3.2518 3.2758 3.2793 3.4897 3.4927 3.4966 3.4996 4.7536 4.7635 4.7690 4.7726 4.9034 4.9091 4.9192 4.9236 5.5982 5.6019 5.6486 5.6505 5.7370 5.7407 5.7997 5.8029 6.0549 6.0574 6.0805 6.0858 8.6862 8.6877 8.7121 8.7166 9.4848 9.4905 9.4966 9.5001 10.0152 10.0226 k = 0.4660 0.4028 0.0588 ( 5774 PWs) bands (ev): -7.0973 -7.0970 -7.0968 -7.0965 -6.3340 -6.3340 -6.3133 -6.3125 0.3665 0.3760 0.3868 0.3880 2.1074 2.1137 2.1240 2.1261 2.9033 2.9191 2.9801 2.9846 3.1171 3.1325 3.1727 3.1727 3.2453 3.2460 3.2849 3.2877 3.4850 3.4898 3.4946 3.4994 4.7546 4.7676 4.7794 4.7847 4.8991 4.9062 4.9203 4.9256 5.5720 5.5762 5.6445 5.6475 5.7327 5.7388 5.8224 5.8271 6.0405 6.0441 6.0860 6.0927 8.6927 8.6946 8.7392 8.7450 9.5035 9.5113 9.5248 9.5294 10.0383 10.0488 k = 0.4575 0.4147 0.0734 ( 5798 PWs) bands (ev): -7.0928 -7.0925 -7.0920 -7.0916 -6.3453 -6.3453 -6.3130 -6.3120 0.3710 0.3828 0.4012 0.4027 2.0893 2.0977 2.1108 2.1141 2.8777 2.8953 2.9907 2.9982 3.1037 3.1219 3.1726 3.1748 3.2376 3.2388 3.2955 3.2969 3.4799 3.4866 3.4925 3.4990 4.7561 4.7721 4.7916 4.7993 4.8952 4.9030 4.9214 4.9274 5.5448 5.5492 5.6389 5.6433 5.7271 5.7362 5.8458 5.8522 6.0229 6.0277 6.0937 6.1014 8.7012 8.7037 8.7741 8.7814 9.5265 9.5364 9.5606 9.5663 10.0689 10.0823 k = 0.4490 0.4267 0.0881 ( 5802 PWs) bands (ev): -7.0873 -7.0869 -7.0861 -7.0857 -6.3589 -6.3589 -6.3126 -6.3115 0.3766 0.3908 0.4186 0.4205 2.0686 2.0791 2.0954 2.0999 2.8479 2.8663 3.0015 3.0136 3.0897 3.1103 3.1719 3.1755 3.2288 3.2304 3.3067 3.3073 3.4750 3.4831 3.4905 3.4987 4.7583 4.7771 4.8049 4.8160 4.8922 4.8995 4.9228 4.9293 5.5174 5.5217 5.6316 5.6374 5.7202 5.7329 5.8695 5.8778 6.0024 6.0087 6.1037 6.1120 8.7120 8.7149 8.8169 8.8254 9.5529 9.5649 9.6036 9.6101 10.1072 10.1235 k = 0.4405 0.4387 0.1028 ( 5800 PWs) bands (ev): -7.0809 -7.0805 -7.0792 -7.0788 -6.3749 -6.3749 -6.3122 -6.3109 0.3832 0.3999 0.4388 0.4411 2.0459 2.0584 2.0781 2.0837 2.8139 2.8328 3.0107 3.0301 3.0752 3.0984 3.1709 3.1743 3.2192 3.2214 3.3168 3.3197 3.4705 3.4796 3.4888 3.4986 4.7611 4.7822 4.8181 4.8341 4.8908 4.8959 4.9247 4.9315 5.4903 5.4942 5.6226 5.6298 5.7118 5.7287 5.8935 5.9034 5.9800 5.9879 6.1159 6.1244 8.7252 8.7284 8.8672 8.8769 9.5819 9.5961 9.6532 9.6605 10.1534 10.1726 k = 0.4320 0.4507 0.1175 ( 5792 PWs) bands (ev): -7.0735 -7.0731 -7.0713 -7.0708 -6.3930 -6.3930 -6.3117 -6.3102 0.3908 0.4099 0.4617 0.4644 2.0216 2.0360 2.0594 2.0659 2.7761 2.7953 3.0163 3.0467 3.0603 3.0872 3.1691 3.1709 3.2090 3.2132 3.3272 3.3324 3.4668 3.4763 3.4876 3.4991 4.7641 4.7874 4.8295 4.8529 4.8921 4.8925 4.9275 4.9343 5.4639 5.4671 5.6120 5.6204 5.7018 5.7234 5.9174 5.9278 5.9574 5.9660 6.1303 6.1388 8.7407 8.7443 8.9248 8.9357 9.6131 9.6293 9.7086 9.7165 10.2076 10.2295 k = 0.4235 0.4627 0.1322 ( 5788 PWs) bands (ev): -7.0653 -7.0648 -7.0624 -7.0618 -6.4131 -6.4131 -6.3111 -6.3094 0.3993 0.4208 0.4869 0.4901 1.9962 2.0123 2.0395 2.0470 2.7348 2.7543 3.0163 3.0445 3.0624 3.0776 3.1645 3.1661 3.1984 3.2087 3.3376 3.3453 3.4641 3.4732 3.4869 3.5003 4.7674 4.7922 4.8376 4.8715 4.8895 4.8966 4.9317 4.9381 5.4385 5.4408 5.5995 5.6090 5.6903 5.7171 5.9266 5.9366 5.9483 5.9594 6.1468 6.1549 8.7588 8.7627 8.9894 9.0015 9.6458 9.6638 9.7692 9.7775 10.2696 10.2942 k = 0.4150 0.4746 0.1469 ( 5791 PWs) bands (ev): -7.0562 -7.0556 -7.0525 -7.0519 -6.4352 -6.4352 -6.3105 -6.3086 0.4084 0.4324 0.5143 0.5181 1.9703 1.9879 2.0191 2.0274 2.6904 2.7103 3.0097 3.0286 3.0697 3.0740 3.1546 3.1618 3.1871 3.2108 3.3479 3.3582 3.4625 3.4707 3.4866 3.5025 4.7708 4.7965 4.8423 4.8843 4.8916 4.9031 4.9388 4.9439 5.4143 5.4154 5.5854 5.5957 5.6772 5.7095 5.9025 5.9190 5.9675 5.9841 6.1651 6.1726 8.7794 8.7837 9.0605 9.0736 9.6797 9.6994 9.8338 9.8423 10.3392 10.3662 k = 0.4065 0.4866 0.1616 ( 5787 PWs) bands (ev): -7.0463 -7.0457 -7.0417 -7.0410 -6.4590 -6.4590 -6.3098 -6.3077 0.4181 0.4445 0.5435 0.5480 1.9441 1.9631 1.9985 2.0074 2.6432 2.6639 2.9977 3.0122 3.0621 3.0781 3.1398 3.1615 3.1752 3.2190 3.3580 3.3710 3.4620 3.4690 3.4867 3.5060 4.7740 4.7999 4.8448 4.8839 4.9050 4.9094 4.9496 4.9530 5.3912 5.3917 5.5699 5.5808 5.6627 5.7007 5.8778 5.8974 5.9914 6.0097 6.1850 6.1918 8.8026 8.8072 9.1376 9.1518 9.7146 9.7359 9.9016 9.9099 10.4159 10.4451 k = 0.3980 0.4986 0.1763 ( 5785 PWs) bands (ev): -7.0356 -7.0350 -7.0299 -7.0291 -6.4845 -6.4845 -6.3090 -6.3068 0.4282 0.4570 0.5742 0.5795 1.9183 1.9385 1.9781 1.9876 2.5938 2.6155 2.9821 2.9952 3.0536 3.0724 3.1216 3.1577 3.1723 3.2309 3.3674 3.3839 3.4628 3.4684 3.4872 3.5108 4.7770 4.8022 4.8463 4.8832 4.9145 4.9158 4.9638 4.9663 5.3684 5.3706 5.5531 5.5644 5.6468 5.6905 5.8542 5.8768 6.0150 6.0351 6.2062 6.2120 8.8285 8.8334 9.2200 9.2352 9.7506 9.7731 9.9710 9.9789 10.4994 10.5303 k = 0.3895 0.5106 0.1910 ( 5795 PWs) bands (ev): -7.0243 -7.0236 -7.0172 -7.0164 -6.5114 -6.5114 -6.3083 -6.3059 0.4385 0.4697 0.6060 0.6122 1.8932 1.9143 1.9586 1.9685 2.5426 2.5657 2.9642 2.9778 3.0433 3.0588 3.1012 3.1427 3.1840 3.2442 3.3759 3.3969 3.4649 3.4692 3.4879 3.5170 4.7795 4.8033 4.8477 4.8834 4.9187 4.9236 4.9799 4.9829 5.3472 5.3514 5.5353 5.5469 5.6296 5.6786 5.8326 5.8581 6.0382 6.0600 6.2282 6.2331 8.8570 8.8623 9.3068 9.3230 9.7877 9.8110 10.0408 10.0477 10.5890 10.6212 k = 0.3810 0.5226 0.2057 ( 5785 PWs) bands (ev): -7.0124 -7.0117 -7.0036 -7.0027 -6.5396 -6.5395 -6.3075 -6.3050 0.4489 0.4823 0.6386 0.6459 1.8693 1.8909 1.9403 1.9505 2.4900 2.5149 2.9445 2.9598 3.0312 3.0403 3.0791 3.1250 3.1990 3.2573 3.3832 3.4106 3.4687 3.4714 3.4886 3.5243 4.7817 4.8034 4.8493 4.8845 4.9228 4.9299 4.9969 5.0012 5.3277 5.3342 5.5170 5.5286 5.6115 5.6652 5.8139 5.8416 6.0606 6.0840 6.2507 6.2546 8.8883 8.8938 9.3971 9.4143 9.8261 9.8500 10.1093 10.1149 10.6840 10.7172 k = 0.3725 0.5345 0.2203 ( 5781 PWs) bands (ev): -7.0001 -6.9993 -6.9892 -6.9883 -6.5687 -6.5686 -6.3066 -6.3040 0.4589 0.4945 0.6715 0.6799 1.8470 1.8688 1.9240 1.9343 2.4364 2.4636 2.9234 2.9412 3.0173 3.0186 3.0559 3.1056 3.2146 3.2691 3.3891 3.4252 3.4741 3.4750 3.4894 3.5328 4.7835 4.8026 4.8511 4.8862 4.9270 4.9354 5.0139 5.0199 5.3101 5.3190 5.4982 5.5100 5.5928 5.6502 5.7984 5.8274 6.0819 6.1069 6.2733 6.2763 8.9222 8.9280 9.4894 9.5079 9.8662 9.8902 10.1747 10.1785 10.7840 10.8178 k = 0.3640 0.5465 0.2350 ( 5779 PWs) bands (ev): -6.9875 -6.9867 -6.9740 -6.9730 -6.5986 -6.5985 -6.3058 -6.3030 0.4685 0.5062 0.7040 0.7139 1.8267 1.8482 1.9100 1.9203 2.3823 2.4122 2.9009 2.9218 2.9949 3.0015 3.0320 3.0848 3.2297 3.2787 3.3940 3.4411 3.4801 3.4809 3.4902 3.5423 4.7851 4.8013 4.8529 4.8882 4.9315 4.9408 5.0306 5.0386 5.2945 5.3058 5.4795 5.4913 5.5738 5.6341 5.7862 5.8158 6.1020 6.1285 6.2957 6.2978 8.9589 8.9648 9.5818 9.6019 9.9086 9.9323 10.2351 10.2367 10.8881 10.9225 k = 0.3555 0.5585 0.2497 ( 5771 PWs) bands (ev): -6.9749 -6.9741 -6.9580 -6.9570 -6.6288 -6.6287 -6.3050 -6.3021 0.4774 0.5169 0.7358 0.7473 1.8087 1.8293 1.8991 1.9091 2.3281 2.3613 2.8770 2.9014 2.9697 2.9836 3.0083 3.0628 3.2436 3.2860 3.3980 3.4576 3.4865 3.4887 3.4912 3.5527 4.7865 4.7996 4.8548 4.8905 4.9365 4.9460 5.0464 5.0566 5.2808 5.2948 5.4612 5.4729 5.5550 5.6174 5.7772 5.8067 6.1205 6.1484 6.3175 6.3188 8.9982 9.0043 9.6720 9.6941 9.9546 9.9771 10.2880 10.2889 10.9960 11.0306 k = 0.3470 0.5705 0.2644 ( 5781 PWs) bands (ev): -6.9627 -6.9619 -6.9413 -6.9402 -6.6589 -6.6587 -6.3041 -6.3011 0.4853 0.5264 0.7662 0.7796 1.7936 1.8123 1.8919 1.9013 2.2741 2.3113 2.8515 2.8797 2.9437 2.9627 2.9861 3.0401 3.2559 3.2910 3.4015 3.4728 3.4917 3.4966 3.4972 3.5640 4.7879 4.7979 4.8565 4.8927 4.9419 4.9511 5.0612 5.0739 5.2692 5.2857 5.4435 5.4550 5.5369 5.6007 5.7713 5.8003 6.1371 6.1664 6.3383 6.3389 9.0402 9.0464 9.7563 9.7811 10.0062 10.0265 10.3310 10.3343 11.1069 11.1416 k = 0.3385 0.5825 0.2791 ( 5777 PWs) bands (ev): -6.9515 -6.9507 -6.9239 -6.9228 -6.6882 -6.6879 -6.3033 -6.3002 0.4919 0.5343 0.7947 0.8102 1.7817 1.7975 1.8889 1.8975 2.2206 2.2627 2.8246 2.8564 2.9171 2.9385 2.9662 3.0172 3.2663 3.2942 3.4050 3.4824 3.4946 3.5058 3.5112 3.5760 4.7892 4.7962 4.8579 4.8950 4.9477 4.9561 5.0747 5.0902 5.2596 5.2787 5.4270 5.4380 5.5197 5.5846 5.7681 5.7964 6.1516 6.1822 6.3579 6.3579 9.0847 9.0910 9.8309 9.8588 10.0653 10.0828 10.3646 10.3702 11.2203 11.2544 k = 0.3300 0.5944 0.2938 ( 5777 PWs) bands (ev): -6.9425 -6.9417 -6.9059 -6.9047 -6.7154 -6.7151 -6.3025 -6.2993 0.4971 0.5404 0.8207 0.8386 1.7732 1.7846 1.8907 1.8981 2.1681 2.2161 2.7962 2.8310 2.8904 2.9118 2.9483 2.9945 3.2748 3.2960 3.4087 3.4856 3.4994 3.5141 3.5307 3.5887 4.7906 4.7948 4.8590 4.8972 4.9535 4.9606 5.0867 5.1053 5.2519 5.2735 5.4119 5.4223 5.5040 5.5697 5.7675 5.7951 6.1638 6.1955 6.3756 6.3759 9.1318 9.1380 9.8928 9.9236 10.1329 10.1474 10.3888 10.3962 11.3353 11.3671 k = 0.3215 0.6064 0.3085 ( 5773 PWs) bands (ev): -6.9371 -6.9364 -6.8873 -6.8860 -6.7389 -6.7384 -6.3018 -6.2984 0.5004 0.5444 0.8438 0.8643 1.7683 1.7736 1.8978 1.9035 2.1170 2.1722 2.7664 2.8035 2.8635 2.8833 2.9319 2.9726 3.2813 3.2967 3.4127 3.4861 3.5048 3.5219 3.5521 3.6019 4.7920 4.7936 4.8598 4.8992 4.9592 4.9647 5.0971 5.1191 5.2460 5.2698 5.3987 5.4081 5.4899 5.5562 5.7693 5.7964 6.1734 6.2062 6.3917 6.3922 9.1812 9.1874 9.9422 9.9747 10.2066 10.2192 10.4036 10.4125 11.4501 11.4652 k = 0.3130 0.6184 0.3232 ( 5789 PWs) bands (ev): -6.9378 -6.9373 -6.8681 -6.8668 -6.7562 -6.7555 -6.3010 -6.2976 0.5019 0.5460 0.8637 0.8869 1.7641 1.7673 1.9104 1.9139 2.0679 2.1318 2.7354 2.7740 2.8362 2.8536 2.9167 2.9520 3.2860 3.2966 3.4169 3.4855 3.5097 3.5289 3.5742 3.6155 4.7927 4.7935 4.8603 4.9010 4.9646 4.9682 5.1057 5.1314 5.2416 5.2674 5.3878 5.3958 5.4775 5.5443 5.7734 5.8002 6.1802 6.2139 6.4060 6.4065 9.2331 9.2391 9.9810 10.0139 10.2822 10.2938 10.4103 10.4200 11.4989 11.5346 k = 0.3130 0.6184 0.3232 ( 5789 PWs) bands (ev): -6.9378 -6.9373 -6.8681 -6.8668 -6.7562 -6.7555 -6.3010 -6.2976 0.5019 0.5460 0.8637 0.8869 1.7641 1.7673 1.9104 1.9139 2.0679 2.1318 2.7354 2.7740 2.8362 2.8536 2.9167 2.9520 3.2860 3.2966 3.4169 3.4855 3.5097 3.5289 3.5742 3.6155 4.7927 4.7935 4.8603 4.9010 4.9646 4.9682 5.1057 5.1314 5.2416 5.2674 5.3878 5.3958 5.4775 5.5443 5.7734 5.8002 6.1802 6.2139 6.4060 6.4065 9.2331 9.2391 9.9810 10.0139 10.2822 10.2938 10.4103 10.4200 11.4989 11.5346 k = 0.2946 0.6132 0.3296 ( 5787 PWs) bands (ev): -6.9446 -6.9440 -6.8578 -6.8565 -6.7587 -6.7579 -6.3010 -6.2976 0.5011 0.5448 0.8724 0.8964 1.7590 1.7670 1.9190 1.9227 2.0451 2.1136 2.7227 2.7625 2.8179 2.8357 2.9169 2.9486 3.2874 3.2968 3.4171 3.4843 3.5090 3.5309 3.5860 3.6221 4.7922 4.7950 4.8603 4.9011 4.9674 4.9697 5.1084 5.1363 5.2403 5.2668 5.3837 5.3908 5.4744 5.5417 5.7758 5.8026 6.1756 6.2096 6.4135 6.4202 9.2600 9.2659 9.9949 10.0276 10.3021 10.3156 10.4212 10.4349 11.5030 11.5405 k = 0.2761 0.6080 0.3360 ( 5785 PWs) bands (ev): -6.9563 -6.9556 -6.8503 -6.8492 -6.7525 -6.7514 -6.3015 -6.2981 0.4984 0.5410 0.8825 0.9066 1.7527 1.7661 1.9309 1.9355 2.0193 2.0928 2.7104 2.7540 2.7924 2.8113 2.9261 2.9536 3.2883 3.2976 3.4144 3.4812 3.5039 3.5316 3.6000 3.6298 4.7922 4.7974 4.8600 4.8999 4.9710 4.9712 5.1099 5.1411 5.2393 5.2665 5.3807 5.3870 5.4742 5.5426 5.7782 5.8048 6.1599 6.1940 6.4285 6.4397 9.2946 9.3003 10.0071 10.0393 10.3005 10.3142 10.4556 10.4716 11.5020 11.5372 k = 0.2577 0.6027 0.3424 ( 5781 PWs) bands (ev): -6.9692 -6.9685 -6.8497 -6.8488 -6.7370 -6.7356 -6.3027 -6.2992 0.4941 0.5348 0.8940 0.9175 1.7461 1.7659 1.9431 1.9500 1.9930 2.0708 2.6937 2.7473 2.7634 2.7909 2.9397 2.9632 3.2891 3.2989 3.4090 3.4757 3.4972 3.5311 3.6142 3.6384 4.7926 4.8004 4.8597 4.8975 4.9724 4.9753 5.1106 5.1453 5.2382 5.2663 5.3793 5.3863 5.4764 5.5463 5.7803 5.8066 6.1372 6.1712 6.4463 6.4602 9.3365 9.3422 10.0185 10.0497 10.2896 10.3011 10.5044 10.5195 11.4952 11.5275 k = 0.2393 0.5975 0.3488 ( 5777 PWs) bands (ev): -6.9822 -6.9815 -6.8542 -6.8534 -6.7154 -6.7137 -6.3045 -6.3010 0.4883 0.5267 0.9066 0.9289 1.7394 1.7670 1.9426 1.9655 1.9779 2.0495 2.6683 2.7259 2.7480 2.7821 2.9553 2.9753 3.2897 3.3008 3.4015 3.4671 3.4906 3.5293 3.6278 3.6473 4.7934 4.8039 4.8594 4.8945 4.9737 4.9796 5.1106 5.1487 5.2366 5.2656 5.3804 5.3900 5.4804 5.5521 5.7818 5.8079 6.1104 6.1443 6.4636 6.4789 9.3856 9.3913 10.0296 10.0597 10.2762 10.2850 10.5605 10.5737 11.4837 11.5130 k = 0.2209 0.5923 0.3552 ( 5775 PWs) bands (ev): -6.9948 -6.9941 -6.8612 -6.8605 -6.6907 -6.6889 -6.3071 -6.3036 0.4815 0.5170 0.9201 0.9408 1.7325 1.7692 1.9188 1.9818 1.9828 2.0321 2.6358 2.6885 2.7502 2.7818 2.9719 2.9890 3.2904 3.3031 3.3922 3.4554 3.4847 3.5261 3.6404 3.6562 4.7946 4.8076 4.8593 4.8914 4.9749 4.9838 5.1104 5.1510 5.2344 5.2638 5.3854 5.3978 5.4857 5.5595 5.7828 5.8085 6.0812 6.1149 6.4780 6.4942 9.4413 9.4473 10.0411 10.0698 10.2632 10.2692 10.6216 10.6330 11.4691 11.4952 k = 0.2025 0.5871 0.3616 ( 5781 PWs) bands (ev): -7.0066 -7.0060 -6.8691 -6.8685 -6.6648 -6.6628 -6.3105 -6.3070 0.4738 0.5064 0.9341 0.9530 1.7249 1.7720 1.8907 1.9849 1.9978 2.0251 2.5996 2.6493 2.7566 2.7863 2.9890 3.0034 3.2912 3.3058 3.3816 3.4416 3.4792 3.5218 3.6518 3.6647 4.7959 4.8113 4.8597 4.8884 4.9759 4.9875 5.1101 5.1520 5.2315 5.2608 5.3948 5.4092 5.4923 5.5681 5.7830 5.8085 6.0508 6.0842 6.4887 6.5052 9.5032 9.5096 10.0535 10.0805 10.2519 10.2554 10.6874 10.6971 11.4532 11.4756 k = 0.1841 0.5819 0.3680 ( 5788 PWs) bands (ev): -7.0176 -7.0170 -6.8772 -6.8766 -6.6387 -6.6365 -6.3148 -6.3113 0.4658 0.4951 0.9484 0.9653 1.7162 1.7731 1.8657 1.9782 2.0126 2.0312 2.5622 2.6096 2.7657 2.7935 3.0064 3.0183 3.2923 3.3088 3.3700 3.4264 3.4738 3.5164 3.6620 3.6727 4.7973 4.8145 4.8606 4.8861 4.9768 4.9906 5.1099 5.1518 5.2285 5.2569 5.4085 5.4235 5.5001 5.5777 5.7825 5.8077 6.0198 6.0528 6.4952 6.5117 9.5707 9.5777 10.0669 10.0921 10.2420 10.2452 10.7575 10.7658 11.4372 11.4556 k = 0.1657 0.5767 0.3744 ( 5790 PWs) bands (ev): -7.0277 -7.0272 -6.8850 -6.8845 -6.6127 -6.6105 -6.3200 -6.3165 0.4576 0.4837 0.9626 0.9774 1.7062 1.7682 1.8497 1.9704 2.0256 2.0423 2.5248 2.5703 2.7765 2.8024 3.0235 3.0332 3.2936 3.3119 3.3579 3.4103 3.4682 3.5102 3.6710 3.6800 4.7985 4.8169 4.8624 4.8848 4.9775 4.9931 5.1099 5.1504 5.2254 5.2522 5.4258 5.4404 5.5088 5.5881 5.7810 5.8063 5.9888 6.0213 6.4975 6.5137 9.6429 9.6510 10.0808 10.1042 10.2339 10.2402 10.8312 10.8386 11.4224 11.4364 k = 0.1473 0.5714 0.3808 ( 5799 PWs) bands (ev): -7.0369 -7.0364 -6.8923 -6.8918 -6.5874 -6.5850 -6.3262 -6.3227 0.4496 0.4725 0.9763 0.9891 1.6950 1.7541 1.8465 1.9659 2.0363 2.0537 2.4887 2.5319 2.7883 2.8121 3.0403 3.0478 3.2954 3.3149 3.3456 3.3938 3.4627 3.5033 3.6789 3.6865 4.7996 4.8182 4.8652 4.8847 4.9781 4.9949 5.1100 5.1480 5.2225 5.2473 5.4457 5.4592 5.5183 5.5992 5.7784 5.8044 5.9583 5.9899 6.4960 6.5117 9.7191 9.7282 10.0942 10.1159 10.2296 10.2400 10.9075 10.9147 11.4102 11.4192 k = 0.1289 0.5662 0.3872 ( 5804 PWs) bands (ev): -7.0450 -7.0446 -6.8989 -6.8985 -6.5628 -6.5603 -6.3334 -6.3299 0.4420 0.4619 0.9893 1.0001 1.6830 1.7340 1.8534 1.9657 2.0441 2.0638 2.4546 2.4951 2.8007 2.8221 3.0562 3.0621 3.2977 3.3171 3.3342 3.3773 3.4572 3.4959 3.6857 3.6922 4.8006 4.8184 4.8688 4.8859 4.9785 4.9960 5.1103 5.1448 5.2201 5.2424 5.4672 5.4797 5.5286 5.6110 5.7743 5.8021 5.9291 5.9592 6.4914 6.5064 9.7979 9.8083 10.1057 10.1261 10.2301 10.2450 10.9845 10.9923 11.4019 11.4057 k = 0.1105 0.5610 0.3936 ( 5805 PWs) bands (ev): -7.0521 -7.0517 -6.9047 -6.9044 -6.5392 -6.5366 -6.3417 -6.3382 0.4352 0.4520 1.0012 1.0102 1.6710 1.7125 1.8659 1.9695 2.0487 2.0720 2.4235 2.4606 2.8129 2.8319 3.0710 3.0756 3.3005 3.3152 3.3269 3.3613 3.4521 3.4882 3.6915 3.6969 4.8013 4.8176 4.8732 4.8882 4.9788 4.9963 5.1107 5.1411 5.2182 5.2377 5.4890 5.5016 5.5393 5.6233 5.7681 5.7991 5.9019 5.9297 6.4846 6.4985 9.8778 9.8891 10.1148 10.1343 10.2360 10.2549 11.0586 11.0683 11.3961 11.4019 k = 0.0920 0.5558 0.4000 ( 5804 PWs) bands (ev): -7.0581 -7.0578 -6.9098 -6.9095 -6.5166 -6.5139 -6.3510 -6.3476 0.4293 0.4431 1.0119 1.0192 1.6596 1.6923 1.8818 1.9766 2.0498 2.0774 2.3962 2.4290 2.8247 2.8409 3.0841 3.0883 3.3036 3.3073 3.3257 3.3468 3.4477 3.4803 3.6964 3.7009 4.8020 4.8161 4.8780 4.8910 4.9792 4.9959 5.1113 5.1371 5.2168 5.2333 5.5101 5.5244 5.5506 5.6364 5.7591 5.7953 5.8777 5.9020 6.4765 6.4891 9.9558 9.9675 10.1223 10.1418 10.2462 10.2684 11.1243 11.1372 11.3956 11.4102 k = 0.0736 0.5506 0.4064 ( 5800 PWs) bands (ev): -7.0631 -7.0628 -6.9140 -6.9137 -6.4952 -6.4924 -6.3614 -6.3581 0.4244 0.4354 1.0210 1.0267 1.6497 1.6745 1.8998 1.9856 2.0477 2.0798 2.3737 2.4012 2.8355 2.8488 3.0955 3.0997 3.2980 3.3080 3.3225 3.3365 3.4443 3.4725 3.7004 3.7040 4.8026 4.8142 4.8829 4.8940 4.9796 4.9947 5.1122 5.1329 5.2161 5.2294 5.5293 5.5460 5.5636 5.6503 5.7464 5.7897 5.8578 5.8774 6.4683 6.4791 10.0264 10.0365 10.1318 10.1536 10.2581 10.2832 11.1745 11.1901 11.4012 11.4266 k = 0.0552 0.5453 0.4128 ( 5800 PWs) bands (ev): -7.0669 -7.0667 -6.9172 -6.9170 -6.4751 -6.4723 -6.3727 -6.3695 0.4208 0.4290 1.0285 1.0326 1.6419 1.6597 1.9191 1.9944 2.0435 2.0786 2.3567 2.3779 2.8449 2.8551 3.1050 3.1091 3.2910 3.3109 3.3145 3.3331 3.4423 3.4649 3.7036 3.7062 4.8033 4.8122 4.8876 4.8966 4.9804 4.9929 5.1133 5.1289 5.2159 5.2260 5.5457 5.5608 5.5826 5.6653 5.7302 5.7805 5.8432 5.8575 6.4610 6.4695 10.0768 10.0818 10.1541 10.1813 10.2687 10.2970 11.2060 11.2210 11.3863 11.4173 k = 0.0368 0.5401 0.4192 ( 5800 PWs) bands (ev): -7.0697 -7.0695 -6.9196 -6.9194 -6.4567 -6.4540 -6.3848 -6.3818 0.4186 0.4240 1.0341 1.0368 1.6368 1.6482 1.9390 1.9979 2.0417 2.0740 2.3454 2.3598 2.8524 2.8593 3.1125 3.1159 3.2867 3.3024 3.3173 3.3314 3.4420 3.4579 3.7059 3.7077 4.8042 4.8102 4.8918 4.8982 4.9817 4.9907 5.1148 5.1252 5.2163 5.2230 5.5586 5.5688 5.6065 5.6795 5.7127 5.7663 5.8343 5.8436 6.4555 6.4614 10.0978 10.0990 10.1944 10.2253 10.2753 10.3068 11.2223 11.2334 11.3434 11.3656 k = 0.0184 0.5349 0.4256 ( 5800 PWs) bands (ev): -7.0713 -7.0713 -6.9210 -6.9209 -6.4408 -6.4386 -6.3963 -6.3939 0.4177 0.4204 1.0377 1.0391 1.6346 1.6402 1.9587 1.9913 2.0469 2.0662 2.3400 2.3473 2.8578 2.8613 3.1176 3.1196 3.2857 3.2939 3.3216 3.3290 3.4436 3.4518 3.7075 3.7084 4.8054 4.8083 4.8952 4.8985 4.9834 4.9882 5.1167 5.1219 5.2172 5.2206 5.5675 5.5724 5.6315 5.6773 5.7110 5.7480 5.8305 5.8351 6.4525 6.4556 10.1041 10.1043 10.2329 10.2616 10.2795 10.3088 11.2293 11.2348 11.3103 11.3214 k = 0.0000 0.5297 0.4320 ( 5804 PWs) bands (ev): -7.0718 -7.0718 -6.9214 -6.9214 -6.4320 -6.4320 -6.4016 -6.4016 0.4183 0.4183 1.0394 1.0394 1.6356 1.6356 1.9769 1.9769 2.0564 2.0564 2.3407 2.3407 2.8608 2.8608 3.1201 3.1201 3.2881 3.2881 3.3257 3.3257 3.4469 3.4469 3.7083 3.7083 4.8067 4.8067 4.8975 4.8975 4.9856 4.9856 5.1191 5.1191 5.2186 5.2186 5.5720 5.5720 5.6561 5.6561 5.7282 5.7282 5.8310 5.8310 6.4525 6.4525 10.1055 10.1055 10.2578 10.2578 10.2986 10.2986 11.2322 11.2322 11.3023 11.3023 k = 0.0000 0.5297 0.4320 ( 5804 PWs) bands (ev): -7.0718 -7.0718 -6.9214 -6.9214 -6.4320 -6.4320 -6.4016 -6.4016 0.4183 0.4183 1.0394 1.0394 1.6356 1.6356 1.9769 1.9769 2.0564 2.0564 2.3407 2.3407 2.8608 2.8608 3.1201 3.1201 3.2881 3.2881 3.3257 3.3257 3.4469 3.4469 3.7083 3.7083 4.8067 4.8067 4.8975 4.8975 4.9856 4.9856 5.1191 5.1191 5.2186 5.2186 5.5720 5.5720 5.6561 5.6561 5.7282 5.7282 5.8310 5.8310 6.4525 6.4525 10.1055 10.1055 10.2578 10.2578 10.2986 10.2986 11.2322 11.2322 11.3023 11.3023 k = 0.0086 0.5175 0.4469 ( 5798 PWs) bands (ev): -7.0714 -7.0713 -6.9210 -6.9210 -6.4325 -6.4324 -6.4019 -6.4019 0.4160 0.4180 1.0356 1.0373 1.6289 1.6314 1.9804 1.9828 2.0543 2.0554 2.3368 2.3452 2.8642 2.8666 3.1205 3.1234 3.2882 3.2883 3.3227 3.3279 3.4451 3.4511 3.7072 3.7087 4.8045 4.8084 4.8956 4.8996 4.9856 4.9860 5.1065 5.1297 5.2078 5.2342 5.5702 5.5737 5.6519 5.6615 5.7255 5.7306 5.8289 5.8404 6.4517 6.4518 10.1059 10.1066 10.2523 10.2548 10.2918 10.2949 11.2279 11.2345 11.3126 11.3133 k = 0.0172 0.5054 0.4617 ( 5798 PWs) bands (ev): -7.0700 -7.0699 -6.9199 -6.9198 -6.4338 -6.4336 -6.4029 -6.4028 0.4110 0.4150 1.0260 1.0293 1.6126 1.6171 1.9893 1.9948 2.0521 2.0529 2.3342 2.3506 2.8762 2.8812 3.1243 3.1303 3.2880 3.2887 3.3196 3.3288 3.4458 3.4571 3.7053 3.7083 4.8017 4.8096 4.8942 4.9020 4.9860 4.9866 5.0939 5.1351 5.2053 5.2525 5.5679 5.5752 5.6493 5.6678 5.7242 5.7316 5.8353 5.8554 6.4494 6.4495 10.1075 10.1089 10.2361 10.2404 10.2779 10.2847 11.2240 11.2341 11.3419 11.3433 k = 0.0259 0.4932 0.4766 ( 5798 PWs) bands (ev): -7.0677 -7.0675 -6.9179 -6.9177 -6.4360 -6.4356 -6.4045 -6.4043 0.4035 0.4095 1.0110 1.0156 1.5891 1.5948 1.9901 1.9996 2.0591 2.0606 2.3347 2.3584 2.8957 2.9032 3.1314 3.1404 3.2870 3.2898 3.3173 3.3283 3.4491 3.4647 3.7027 3.7071 4.7984 4.8102 4.8932 4.9046 4.9869 4.9872 5.0821 5.1334 5.2131 5.2726 5.5647 5.5762 5.6492 5.6750 5.7253 5.7319 5.8498 5.8746 6.4456 6.4457 10.1104 10.1123 10.2055 10.2114 10.2641 10.2745 11.2209 11.2327 11.3836 11.3890 k = 0.0345 0.4811 0.4915 ( 5790 PWs) bands (ev): -7.0645 -7.0642 -6.9151 -6.9149 -6.4390 -6.4385 -6.4067 -6.4065 0.3938 0.4016 0.9910 0.9969 1.5608 1.5671 1.9738 1.9849 2.0834 2.0862 2.3399 2.3699 2.9209 2.9310 3.1414 3.1536 3.2850 3.2915 3.3167 3.3267 3.4547 3.4733 3.6994 3.7052 4.7947 4.8103 4.8927 4.9073 4.9878 4.9883 5.0716 5.1271 5.2287 5.2940 5.5603 5.5761 5.6523 5.6829 5.7293 5.7332 5.8710 5.8971 6.4403 6.4404 10.1139 10.1162 10.1629 10.1710 10.2521 10.2652 11.2175 11.2306 11.4340 11.4434 k = 0.0431 0.4690 0.5064 ( 5784 PWs) bands (ev): -7.0604 -7.0600 -6.9115 -6.9113 -6.4428 -6.4423 -6.4095 -6.4092 0.3821 0.3917 0.9668 0.9737 1.5294 1.5358 1.9458 1.9569 2.1182 2.1219 2.3506 2.3860 2.9502 2.9629 3.1538 3.1691 3.2820 3.2940 3.3181 3.3243 3.4623 3.4826 3.6953 3.7025 4.7907 4.8100 4.8927 4.9101 4.9881 4.9901 5.0625 5.1196 5.2489 5.3162 5.5547 5.5745 5.6589 5.6918 5.7361 5.7373 5.8972 5.9226 6.4335 6.4336 10.1120 10.1163 10.1212 10.1253 10.2416 10.2562 11.2130 11.2274 11.4877 11.4991 k = 0.0517 0.4568 0.5213 ( 5796 PWs) bands (ev): -7.0553 -7.0549 -6.9072 -6.9070 -6.4475 -6.4468 -6.4130 -6.4126 0.3688 0.3799 0.9391 0.9468 1.4961 1.5021 1.9103 1.9209 2.1578 2.1628 2.3670 2.4067 2.9820 2.9973 3.1680 3.1863 3.2788 3.2974 3.3212 3.3218 3.4712 3.4924 3.6906 3.6990 4.7865 4.8092 4.8930 4.9131 4.9880 4.9921 5.0553 5.1127 5.2720 5.3390 5.5481 5.5708 5.6688 5.7020 5.7447 5.7455 5.9274 5.9505 6.4252 6.4253 10.0601 10.0730 10.1213 10.1224 10.2331 10.2480 11.2061 11.2221 11.5259 11.5377 k = 0.0603 0.4447 0.5362 ( 5794 PWs) bands (ev): -7.0494 -7.0489 -6.9022 -6.9019 -6.4529 -6.4522 -6.4170 -6.4166 0.3543 0.3667 0.9084 0.9167 1.4615 1.4670 1.8696 1.8794 2.2001 2.2066 2.3885 2.4319 3.0152 3.0329 3.1830 3.2035 3.2769 3.3018 3.3200 3.3260 3.4811 3.5024 3.6853 3.6948 4.7823 4.8081 4.8936 4.9163 4.9875 4.9943 5.0501 5.1071 5.2973 5.3622 5.5412 5.5651 5.6820 5.7139 5.7555 5.7574 5.9608 5.9808 6.4154 6.4156 10.0065 10.0220 10.1212 10.1220 10.2284 10.2420 11.1958 11.2138 11.5015 11.5308 k = 0.0690 0.4325 0.5511 ( 5796 PWs) bands (ev): -7.0426 -7.0421 -6.8964 -6.8960 -6.4592 -6.4583 -6.4217 -6.4213 0.3388 0.3525 0.8755 0.8843 1.4262 1.4311 1.8252 1.8339 2.2440 2.2521 2.4143 2.4609 3.0487 3.0685 3.1980 3.2183 3.2786 3.3065 3.3206 3.3321 3.4915 3.5123 3.6796 3.6899 4.7781 4.8066 4.8944 4.9196 4.9866 4.9961 5.0473 5.1032 5.3244 5.3855 5.5343 5.5578 5.6979 5.7279 5.7691 5.7715 5.9967 6.0132 6.4042 6.4045 9.9538 9.9719 10.1155 10.1192 10.2288 10.2396 11.1807 11.2009 11.4658 11.4923 k = 0.0776 0.4204 0.5660 ( 5794 PWs) bands (ev): -7.0350 -7.0344 -6.8899 -6.8895 -6.4662 -6.4653 -6.4270 -6.4265 0.3227 0.3375 0.8410 0.8502 1.3906 1.3947 1.7783 1.7859 2.2889 2.2987 2.4436 2.4930 3.0817 3.1030 3.2117 3.2270 3.2871 3.3104 3.3259 3.3396 3.5021 3.5218 3.6735 3.6845 4.7742 4.8049 4.8952 4.9230 4.9856 4.9974 5.0472 5.1008 5.3533 5.4085 5.5283 5.5491 5.7163 5.7438 5.7851 5.7876 6.0346 6.0473 6.3918 6.3923 9.9033 9.9239 10.1051 10.1118 10.2341 10.2417 11.1595 11.1819 11.4244 11.4472 k = 0.0862 0.4082 0.5809 ( 5790 PWs) bands (ev): -7.0265 -7.0258 -6.8827 -6.8823 -6.4740 -6.4730 -6.4328 -6.4323 0.3065 0.3222 0.8053 0.8148 1.3550 1.3584 1.7297 1.7362 2.3341 2.3457 2.4757 2.5275 3.1131 3.1353 3.2233 3.2295 3.3023 3.3141 3.3362 3.3487 3.5125 3.5306 3.6673 3.6786 4.7706 4.8030 4.8958 4.9265 4.9848 4.9982 5.0498 5.0998 5.3837 5.4304 5.5241 5.5398 5.7367 5.7617 5.8029 5.8053 6.0739 6.0828 6.3783 6.3790 9.8557 9.8789 10.0912 10.1001 10.2433 10.2481 11.1311 11.1555 11.3791 11.3976 k = 0.0948 0.3961 0.5958 ( 5790 PWs) bands (ev): -7.0173 -7.0165 -6.8748 -6.8744 -6.4825 -6.4814 -6.4393 -6.4387 0.2904 0.3069 0.7690 0.7788 1.3198 1.3225 1.6802 1.6857 2.3795 2.3929 2.5099 2.5639 3.1422 3.1638 3.2290 3.2329 3.3198 3.3205 3.3501 3.3596 3.5223 3.5385 3.6615 3.6726 4.7675 4.8009 4.8961 4.9300 4.9844 4.9987 5.0545 5.0999 5.4154 5.4494 5.5238 5.5302 5.7587 5.7809 5.8222 5.8243 6.1141 6.1194 6.3639 6.3650 9.8117 9.8375 10.0750 10.0850 10.2547 10.2575 11.0952 11.1209 11.3316 11.3456 k = 0.1034 0.3839 0.6107 ( 5794 PWs) bands (ev): -7.0072 -7.0064 -6.8664 -6.8659 -6.4918 -6.4906 -6.4463 -6.4457 0.2747 0.2919 0.7325 0.7424 1.2852 1.2872 1.6304 1.6350 2.4247 2.4399 2.5456 2.6015 3.1669 3.1860 3.2289 3.2423 3.3283 3.3387 3.3665 3.3728 3.5311 3.5450 3.6564 3.6669 4.7648 4.7987 4.8959 4.9332 4.9848 4.9996 5.0609 5.1007 5.4480 5.4624 5.5211 5.5308 5.7819 5.8012 5.8426 5.8443 6.1545 6.1566 6.3491 6.3506 9.7718 9.8000 10.0572 10.0676 10.2672 10.2686 11.0522 11.0784 11.2839 11.2936 k = 0.1121 0.3718 0.6256 ( 5790 PWs) bands (ev): -6.9965 -6.9956 -6.8574 -6.8569 -6.5017 -6.5004 -6.4539 -6.4532 0.2598 0.2776 0.6959 0.7062 1.2515 1.2530 1.5807 1.5845 2.4697 2.4866 2.5821 2.6397 3.1836 3.1995 3.2337 3.2538 3.3401 3.3551 3.3842 3.3883 3.5385 3.5497 3.6527 3.6618 4.7627 4.7966 4.8952 4.9361 4.9863 5.0013 5.0684 5.1021 5.4678 5.4790 5.5151 5.5467 5.8057 5.8221 5.8638 5.8650 6.1938 6.1945 6.3344 6.3366 9.7361 9.7666 10.0384 10.0485 10.2795 10.2802 11.0034 11.0293 11.2380 11.2438 k = 0.1207 0.3596 0.6405 ( 5790 PWs) bands (ev): -6.9850 -6.9841 -6.8479 -6.8473 -6.5122 -6.5109 -6.4620 -6.4613 0.2458 0.2641 0.6597 0.6702 1.2191 1.2201 1.5317 1.5347 2.5141 2.5328 2.6191 2.6780 3.1894 3.2047 3.2467 3.2676 3.3548 3.3690 3.4020 3.4051 3.5442 3.5525 3.6511 3.6582 4.7612 4.7944 4.8938 4.9384 4.9888 5.0042 5.0765 5.1038 5.4681 5.4924 5.5283 5.5692 5.8295 5.8430 5.8855 5.8862 6.2304 6.2329 6.3204 6.3239 9.7047 9.7375 10.0187 10.0283 10.2906 10.2911 10.9502 10.9752 11.1958 11.1986 k = 0.1293 0.3475 0.6554 ( 5790 PWs) bands (ev): -6.9729 -6.9719 -6.8378 -6.8373 -6.5234 -6.5220 -6.4706 -6.4700 0.2331 0.2517 0.6241 0.6348 1.1882 1.1888 1.4836 1.4860 2.5581 2.5785 2.6561 2.7159 3.1879 3.2048 3.2643 3.2816 3.3711 3.3806 3.4188 3.4220 3.5481 3.5536 3.6518 3.6565 4.7603 4.7923 4.8919 4.9402 4.9925 5.0083 5.0848 5.1057 5.4665 5.4877 5.5606 5.5949 5.8527 5.8633 5.9076 5.9076 6.2650 6.2668 6.3087 6.3158 9.6778 9.7127 9.9983 10.0071 10.2998 10.3003 10.8942 10.9179 11.1593 11.1597 k = 0.1379 0.3353 0.6703 ( 5794 PWs) bands (ev): -6.9601 -6.9591 -6.8274 -6.8268 -6.5351 -6.5337 -6.4798 -6.4791 0.2217 0.2406 0.5891 0.6002 1.1591 1.1594 1.4368 1.4386 2.6013 2.6234 2.6926 2.7530 3.1834 3.2020 3.2826 3.2948 3.3876 3.3891 3.4338 3.4380 3.5506 3.5539 3.6549 3.6572 4.7599 4.7903 4.8895 4.9414 4.9972 5.0138 5.0929 5.1075 5.4645 5.4812 5.5954 5.6219 5.8744 5.8824 5.9293 5.9300 6.2836 6.2878 6.3093 6.3249 9.6552 9.6919 9.9770 9.9852 10.3062 10.3072 10.8367 10.8590 11.1287 11.1299 k = 0.1466 0.3232 0.6852 ( 5798 PWs) bands (ev): -6.9468 -6.9457 -6.8167 -6.8160 -6.5472 -6.5458 -6.4894 -6.4887 0.2119 0.2311 0.5550 0.5665 1.1320 1.1321 1.3915 1.3928 2.6438 2.6676 2.7284 2.7889 3.1775 3.1977 3.3003 3.3070 3.3934 3.4021 3.4465 3.4525 3.5528 3.5547 3.6599 3.6602 4.7601 4.7885 4.8867 4.9422 5.0027 5.0205 5.1006 5.1093 5.4629 5.4754 5.6292 5.6485 5.8942 5.9000 5.9515 5.9526 6.2824 6.2850 6.3362 6.3524 9.6367 9.6752 9.9549 9.9626 10.3095 10.3110 10.7791 10.7997 11.1066 11.1087 k = 0.1552 0.3110 0.7001 ( 5806 PWs) bands (ev): -6.9330 -6.9318 -6.8056 -6.8050 -6.5598 -6.5583 -6.4996 -6.4988 0.2038 0.2231 0.5220 0.5338 1.1072 1.1072 1.3480 1.3488 2.6855 2.7111 2.7630 2.8233 3.1710 3.1924 3.3170 3.3182 3.3926 3.4120 3.4574 3.4653 3.5561 3.5573 3.6652 3.6663 4.7609 4.7868 4.8837 4.9426 5.0089 5.0282 5.1078 5.1109 5.4623 5.4708 5.6599 5.6731 5.9121 5.9165 5.9742 5.9755 6.2799 6.2814 6.3648 6.3818 9.6223 9.6622 9.9318 9.9394 10.3094 10.3115 10.7221 10.7411 11.0940 11.0965 k = 0.1638 0.2989 0.7150 ( 5808 PWs) bands (ev): -6.9186 -6.9174 -6.7945 -6.7938 -6.5726 -6.5711 -6.5101 -6.5093 0.1976 0.2170 0.4900 0.5022 1.0849 1.0850 1.3065 1.3069 2.7263 2.7536 2.7964 2.8559 3.1640 3.1865 3.3284 3.3328 3.3863 3.4154 3.4678 3.4763 3.5613 3.5620 3.6716 3.6736 4.7621 4.7852 4.8806 4.9427 5.0156 5.0368 5.1125 5.1141 5.4629 5.4678 5.6851 5.6935 5.9291 5.9331 5.9973 5.9983 6.2803 6.2812 6.3905 6.4087 9.6116 9.6526 9.9078 9.9158 10.3064 10.3090 10.6667 10.6841 11.0906 11.0932 k = 0.1724 0.2867 0.7299 ( 5810 PWs) bands (ev): -6.9039 -6.9027 -6.7834 -6.7827 -6.5856 -6.5840 -6.5210 -6.5202 0.1933 0.2127 0.4593 0.4719 1.0654 1.0655 1.2671 1.2672 2.7659 2.7953 2.8285 2.8865 3.1567 3.1800 3.3366 3.3473 3.3752 3.4129 3.4780 3.4852 3.5681 3.5686 3.6789 3.6814 4.7637 4.7838 4.8775 4.9428 5.0225 5.0459 5.1139 5.1195 5.4650 5.4668 5.7026 5.7076 5.9471 5.9516 6.0202 6.0208 6.2843 6.2848 6.4126 6.4319 9.6045 9.6464 9.8830 9.8919 10.3011 10.3040 10.6136 10.6293 11.0958 11.0984 k = 0.1810 0.2746 0.7448 ( 5806 PWs) bands (ev): -6.8888 -6.8875 -6.7725 -6.7718 -6.5984 -6.5969 -6.5323 -6.5315 0.1909 0.2104 0.4298 0.4428 1.0488 1.0489 1.2300 1.2302 2.8041 2.8360 2.8592 2.9149 3.1492 3.1733 3.3407 3.3538 3.3672 3.4083 3.4874 3.4917 3.5760 3.5767 3.6866 3.6893 4.7657 4.7827 4.8743 4.9427 5.0293 5.0555 5.1152 5.1239 5.4678 5.4688 5.7108 5.7137 5.9677 5.9734 6.0423 6.0425 6.2918 6.2918 6.4305 6.4509 9.6007 9.6431 9.8576 9.8680 10.2944 10.2973 10.5632 10.5772 11.1085 11.1113 k = 0.1897 0.2625 0.7597 ( 5804 PWs) bands (ev): -6.8734 -6.8721 -6.7621 -6.7615 -6.6108 -6.6094 -6.5438 -6.5431 0.1906 0.2101 0.4018 0.4152 1.0353 1.0353 1.1953 1.1958 2.8404 2.8755 2.8888 2.9412 3.1416 3.1664 3.3371 3.3373 3.3784 3.4065 3.4951 3.4958 3.5841 3.5855 3.6944 3.6969 4.7678 4.7816 4.8713 4.9427 5.0360 5.0652 5.1164 5.1273 5.4712 5.4745 5.7098 5.7117 5.9913 5.9985 6.0630 6.0632 6.3018 6.3023 6.4438 6.4651 9.6000 9.6425 9.8319 9.8442 10.2875 10.2902 10.5160 10.5284 11.1274 11.1306 k = 0.1983 0.2503 0.7745 ( 5802 PWs) bands (ev): -6.8578 -6.8565 -6.7529 -6.7523 -6.6223 -6.6209 -6.5556 -6.5549 0.1924 0.2119 0.3752 0.3890 1.0249 1.0251 1.1633 1.1640 2.8739 2.9135 2.9177 2.9654 3.1342 3.1594 3.3150 3.3250 3.3916 3.4102 3.4976 3.5008 3.5919 3.5943 3.7018 3.7040 4.7700 4.7808 4.8685 4.9426 5.0421 5.0748 5.1175 5.1296 5.4770 5.4822 5.7011 5.7027 6.0170 6.0254 6.0818 6.0823 6.3140 6.3153 6.4524 6.4745 9.6021 9.6444 9.8063 9.8210 10.2812 10.2836 10.4724 10.4832 11.1515 11.1552 k = 0.2069 0.2382 0.7894 ( 5802 PWs) bands (ev): -6.8421 -6.8408 -6.7456 -6.7452 -6.6319 -6.6306 -6.5676 -6.5668 0.1963 0.2157 0.3502 0.3643 1.0178 1.0180 1.1343 1.1351 2.9036 2.9465 2.9493 2.9878 3.1273 3.1526 3.2906 3.3061 3.4046 3.4175 3.4973 3.5045 3.5991 3.6026 3.7086 3.7103 4.7722 4.7801 4.8659 4.9425 5.0475 5.0841 5.1185 5.1308 5.4853 5.4919 5.6868 5.6883 6.0432 6.0521 6.0984 6.0991 6.3280 6.3302 6.4562 6.4790 9.6069 9.6486 9.7811 9.7985 10.2766 10.2787 10.4327 10.4420 11.1796 11.1839 k = 0.2155 0.2260 0.8043 ( 5800 PWs) bands (ev): -6.8264 -6.8251 -6.7413 -6.7412 -6.6385 -6.6375 -6.5796 -6.5789 0.2022 0.2216 0.3269 0.3413 1.0140 1.0143 1.1082 1.1092 2.9287 2.9749 2.9816 3.0091 3.1218 3.1467 3.2644 3.2833 3.4169 3.4262 3.4952 3.5062 3.6052 3.6099 3.7145 3.7157 4.7742 4.7795 4.8636 4.9424 5.0521 5.0929 5.1195 5.1309 5.4959 5.5036 5.6688 5.6705 6.0679 6.0768 6.1125 6.1131 6.3434 6.3468 6.4553 6.4788 9.6141 9.6549 9.7570 9.7772 10.2743 10.2761 10.3973 10.4050 11.2109 11.2158 k = 0.2241 0.2139 0.8192 ( 5796 PWs) bands (ev): -6.8108 -6.8095 -6.7415 -6.7413 -6.6408 -6.6403 -6.5915 -6.5908 0.2101 0.2296 0.3055 0.3199 1.0135 1.0139 1.0853 1.0864 2.9489 3.0014 3.0074 3.0308 3.1192 3.1427 3.2370 3.2581 3.4283 3.4348 3.4916 3.5063 3.6102 3.6158 3.7194 3.7201 4.7760 4.7791 4.8617 4.9424 5.0558 5.1011 5.1202 5.1299 5.5085 5.5171 5.6491 5.6508 6.0897 6.0980 6.1235 6.1238 6.3597 6.3641 6.4501 6.4743 9.6234 9.6630 9.7342 9.7572 10.2751 10.2769 10.3662 10.3726 11.2446 11.2500 k = 0.2328 0.2017 0.8341 ( 5796 PWs) bands (ev): -6.7956 -6.7943 -6.7466 -6.7460 -6.6386 -6.6384 -6.6031 -6.6025 0.2196 0.2395 0.2861 0.3003 1.0163 1.0167 1.0658 1.0670 2.9643 3.0225 3.0248 3.0518 3.1225 3.1429 3.2091 3.2322 3.4383 3.4421 3.4872 3.5055 3.6138 3.6203 3.7229 3.7232 4.7773 4.7787 4.8603 4.9424 5.0584 5.1084 5.1208 5.1278 5.5222 5.5317 5.6297 5.6312 6.1072 6.1144 6.1308 6.1308 6.3764 6.3812 6.4412 6.4665 9.6344 9.6725 9.7135 9.7391 10.2794 10.2814 10.3398 10.3448 11.2799 11.2855 k = 0.2414 0.1896 0.8490 ( 5804 PWs) bands (ev): -6.7811 -6.7798 -6.7556 -6.7548 -6.6327 -6.6326 -6.6142 -6.6137 0.2301 0.2513 0.2699 0.2828 1.0217 1.0220 1.0503 1.0516 2.9741 3.0351 3.0352 3.0659 3.1348 3.1500 3.1814 3.2080 3.4459 3.4472 3.4829 3.5044 3.6160 3.6230 3.7251 3.7251 4.7782 4.7785 4.8594 4.9423 5.0600 5.1147 5.1211 5.1246 5.5346 5.5452 5.6136 5.6143 6.1191 6.1257 6.1339 6.1342 6.3924 6.3956 6.4298 6.4579 9.6456 9.6825 9.6963 9.7240 10.2878 10.2902 10.3179 10.3219 11.3161 11.3213 k = 0.2500 0.1774 0.8639 ( 5804 PWs) bands (ev): -6.7686 -6.7664 -6.7664 -6.7664 -6.6247 -6.6247 -6.6239 -6.6232 0.2364 0.2616 0.2616 0.2706 1.0261 1.0261 1.0425 1.0442 2.9775 3.0389 3.0389 3.0704 3.1539 3.1574 3.1574 3.1950 3.4490 3.4490 3.4809 3.5040 3.6167 3.6239 3.7258 3.7258 4.7785 4.7785 4.8591 4.9423 5.0605 5.1191 5.1213 5.1213 5.5403 5.5517 5.6066 5.6066 6.1238 6.1305 6.1343 6.1343 6.4019 6.4019 6.4219 6.4535 9.6518 9.6881 9.6881 9.7166 10.2992 10.3020 10.3020 10.3053 11.3503 11.3503 k = 0.2500 0.1774 0.8639 ( 5804 PWs) bands (ev): -6.7686 -6.7664 -6.7664 -6.7664 -6.6247 -6.6247 -6.6239 -6.6232 0.2364 0.2616 0.2616 0.2706 1.0261 1.0261 1.0425 1.0442 2.9775 3.0389 3.0389 3.0704 3.1539 3.1574 3.1574 3.1950 3.4490 3.4490 3.4809 3.5040 3.6167 3.6239 3.7258 3.7258 4.7785 4.7785 4.8591 4.9423 5.0605 5.1191 5.1213 5.1213 5.5403 5.5517 5.6066 5.6066 6.1238 6.1305 6.1343 6.1343 6.4019 6.4019 6.4219 6.4535 9.6518 9.6881 9.6881 9.7166 10.2992 10.3020 10.3020 10.3053 11.3503 11.3503 k = 0.2639 0.1873 0.8518 ( 5798 PWs) bands (ev): -6.7747 -6.7735 -6.7607 -6.7599 -6.6294 -6.6291 -6.6188 -6.6183 0.2330 0.2555 0.2639 0.2753 1.0256 1.0280 1.0471 1.0486 2.9697 3.0231 3.0312 3.0556 3.1503 3.1594 3.1846 3.2072 3.4484 3.4484 3.4816 3.5043 3.6167 3.6237 3.7249 3.7259 4.7731 4.7848 4.8591 4.9423 5.0606 5.1145 5.1205 5.1256 5.5381 5.5487 5.6088 5.6093 6.1236 6.1298 6.1336 6.1369 6.3996 6.4002 6.4252 6.4551 9.6404 9.6764 9.6848 9.7132 10.3004 10.3030 10.3141 10.3184 11.3337 11.3368 k = 0.2778 0.1971 0.8397 ( 5805 PWs) bands (ev): -6.7814 -6.7803 -6.7554 -6.7547 -6.6337 -6.6335 -6.6132 -6.6126 0.2251 0.2453 0.2688 0.2817 1.0291 1.0331 1.0582 1.0595 2.9487 2.9918 3.0074 3.0254 3.1574 3.1645 3.2239 3.2371 3.4463 3.4470 3.4838 3.5055 3.6166 3.6229 3.7232 3.7250 4.7688 4.7918 4.8592 4.9422 5.0607 5.1077 5.1205 5.1292 5.5320 5.5401 5.6151 5.6165 6.1234 6.1284 6.1345 6.1398 6.3966 6.3972 6.4308 6.4584 9.6051 9.6391 9.6779 9.7058 10.3184 10.3192 10.3373 10.3427 11.3169 11.3198 k = 0.2917 0.2070 0.8277 ( 5801 PWs) bands (ev): -6.7877 -6.7866 -6.7511 -6.7505 -6.6373 -6.6371 -6.6078 -6.6072 0.2153 0.2342 0.2743 0.2874 1.0375 1.0429 1.0737 1.0749 2.9184 2.9532 2.9763 2.9897 3.1710 3.1740 3.2615 3.2708 3.4431 3.4451 3.4872 3.5075 3.6164 3.6218 3.7208 3.7233 4.7655 4.7996 4.8593 4.9421 5.0612 5.1008 5.1197 5.1318 5.5236 5.5286 5.6234 5.6258 6.1239 6.1271 6.1365 6.1427 6.3947 6.3960 6.4357 6.4617 9.5519 9.5833 9.6668 9.6935 10.3499 10.3520 10.3690 10.3755 11.3014 11.3039 k = 0.3056 0.2169 0.8156 ( 5803 PWs) bands (ev): -6.7934 -6.7923 -6.7477 -6.7472 -6.6402 -6.6401 -6.6031 -6.6023 0.2052 0.2231 0.2794 0.2922 1.0506 1.0571 1.0927 1.0939 2.8825 2.9114 2.9416 2.9516 3.1873 3.1873 3.2944 3.3019 3.4392 3.4428 3.4917 3.5104 3.6164 3.6203 3.7176 3.7206 4.7632 4.8078 4.8593 4.9419 5.0617 5.0937 5.1180 5.1332 5.5147 5.5160 5.6315 5.6350 6.1249 6.1260 6.1394 6.1456 6.3952 6.3972 6.4389 6.4638 9.4884 9.5169 9.6511 9.6764 10.3915 10.3966 10.4076 10.4150 11.2870 11.2891 k = 0.3194 0.2267 0.8035 ( 5806 PWs) bands (ev): -6.7985 -6.7975 -6.7449 -6.7446 -6.6424 -6.6424 -6.5991 -6.5983 0.1957 0.2127 0.2840 0.2961 1.0678 1.0753 1.1145 1.1161 2.8436 2.8682 2.9051 2.9124 3.2030 3.2049 3.3213 3.3280 3.4348 3.4403 3.4971 3.5143 3.6165 3.6184 3.7138 3.7171 4.7619 4.8162 4.8591 4.9417 5.0622 5.0866 5.1156 5.1333 5.5038 5.5065 5.6379 5.6427 6.1251 6.1262 6.1429 6.1482 6.3982 6.4010 6.4402 6.4643 9.4208 9.4462 9.6317 9.6555 10.4404 10.4463 10.4537 10.4596 11.2735 11.2755 k = 0.3333 0.2366 0.7914 ( 5806 PWs) bands (ev): -6.8029 -6.8019 -6.7427 -6.7425 -6.6441 -6.6441 -6.5961 -6.5953 0.1877 0.2038 0.2881 0.2993 1.0883 1.0966 1.1385 1.1406 2.8034 2.8249 2.8677 2.8730 3.2200 3.2229 3.3420 3.3483 3.4301 3.4376 3.5031 3.5193 3.6163 3.6170 3.7093 3.7126 4.7614 4.8248 4.8587 4.9415 5.0625 5.0794 5.1126 5.1318 5.4927 5.4998 5.6418 5.6481 6.1247 6.1276 6.1469 6.1507 6.4038 6.4069 6.4394 6.4631 9.3536 9.3761 9.6097 9.6320 10.4941 10.4947 10.5079 10.5093 11.2611 11.2632 k = 0.3472 0.2464 0.7793 ( 5801 PWs) bands (ev): -6.8066 -6.8057 -6.7410 -6.7409 -6.6451 -6.6451 -6.5943 -6.5935 0.1817 0.1969 0.2918 0.3020 1.1113 1.1203 1.1642 1.1669 2.7631 2.7821 2.8304 2.8342 3.2376 3.2409 3.3567 3.3627 3.4254 3.4349 3.5092 3.5251 3.6138 3.6178 3.7043 3.7073 4.7619 4.8332 4.8581 4.9414 5.0625 5.0718 5.1093 5.1288 5.4833 5.4949 5.6425 5.6508 6.1249 6.1290 6.1511 6.1531 6.4109 6.4142 6.4366 6.4601 9.2906 9.3101 9.5859 9.6068 10.5440 10.5504 10.5590 10.5692 11.2500 11.2524 k = 0.3611 0.2563 0.7672 ( 5801 PWs) bands (ev): -6.8094 -6.8086 -6.7397 -6.7397 -6.6455 -6.6455 -6.5938 -6.5929 0.1782 0.1925 0.2953 0.3042 1.1360 1.1455 1.1909 1.1943 2.7239 2.7409 2.7940 2.7965 3.2553 3.2583 3.3659 3.3718 3.4208 3.4320 3.5148 3.5310 3.6112 3.6191 3.6986 3.7011 4.7630 4.8410 4.8574 4.9414 5.0619 5.0638 5.1061 5.1242 5.4760 5.4920 5.6398 5.6506 6.1256 6.1303 6.1553 6.1554 6.4180 6.4212 6.4323 6.4558 9.2347 9.2513 9.5611 9.5808 10.5947 10.6075 10.6123 10.6305 11.2402 11.2434 k = 0.3750 0.2661 0.7551 ( 5805 PWs) bands (ev): -6.8114 -6.8107 -6.7390 -6.7389 -6.6454 -6.6454 -6.5944 -6.5935 0.1776 0.1910 0.2986 0.3062 1.1617 1.1715 1.2178 1.2219 2.6866 2.7019 2.7591 2.7606 3.2727 3.2749 3.3708 3.3763 3.4165 3.4291 3.5192 3.5363 3.6086 3.6206 3.6923 3.6941 4.7647 4.8463 4.8584 4.9413 5.0555 5.0605 5.1030 5.1182 5.4708 5.4912 5.6340 5.6475 6.1270 6.1315 6.1576 6.1596 6.4208 6.4222 6.4321 6.4514 9.1883 9.2020 9.5359 9.5545 10.6464 10.6635 10.6676 10.6918 11.2322 11.2363 k = 0.3889 0.2760 0.7430 ( 5805 PWs) bands (ev): -6.8125 -6.8119 -6.7388 -6.7387 -6.6447 -6.6446 -6.5962 -6.5954 0.1802 0.1928 0.3018 0.3082 1.1876 1.1977 1.2442 1.2490 2.6522 2.6659 2.7265 2.7271 3.2891 3.2902 3.3725 3.3771 3.4128 3.4261 3.5219 3.5400 3.6060 3.6220 3.6855 3.6863 4.7671 4.8464 4.8637 4.9413 5.0471 5.0583 5.1001 5.1111 5.4676 5.4921 5.6252 5.6419 6.1290 6.1327 6.1602 6.1637 6.4120 6.4200 6.4358 6.4488 9.1535 9.1641 9.5109 9.5283 10.6986 10.7181 10.7234 10.7517 11.2262 11.2314 k = 0.4028 0.2859 0.7310 ( 5811 PWs) bands (ev): -6.8127 -6.8121 -6.7393 -6.7392 -6.6434 -6.6433 -6.5991 -6.5983 0.1863 0.1979 0.3051 0.3101 1.2131 1.2232 1.2692 1.2746 2.6215 2.6338 2.6967 2.6967 3.3036 3.3042 3.3718 3.3750 3.4097 3.4234 3.5228 3.5412 3.6039 3.6231 3.6778 3.6782 4.7699 4.8433 4.8711 4.9411 5.0388 5.0552 5.0972 5.1033 5.4663 5.4947 5.6139 5.6342 6.1318 6.1341 6.1630 6.1679 6.4003 6.4110 6.4365 6.4469 9.1317 9.1393 9.4863 9.5027 10.7506 10.7707 10.7782 10.8085 11.2225 11.2290 k = 0.4167 0.2957 0.7189 ( 5807 PWs) bands (ev): -6.8120 -6.8115 -6.7407 -6.7405 -6.6415 -6.6415 -6.6027 -6.6020 0.1960 0.2066 0.3085 0.3121 1.2374 1.2474 1.2921 1.2980 2.5954 2.6063 2.6700 2.6705 3.3144 3.3170 3.3695 3.3708 3.4076 3.4214 3.5218 3.5393 3.6024 3.6235 3.6687 3.6705 4.7731 4.8388 4.8788 4.9406 5.0311 5.0510 5.0942 5.0951 5.4667 5.4987 5.6006 5.6246 6.1353 6.1360 6.1660 6.1719 6.3866 6.3979 6.4322 6.4420 9.1239 9.1285 9.4624 9.4779 10.8018 10.8190 10.8321 10.8603 11.2213 11.2290 k = 0.4306 0.3056 0.7068 ( 5814 PWs) bands (ev): -6.8103 -6.8099 -6.7434 -6.7432 -6.6392 -6.6391 -6.6068 -6.6061 0.2092 0.2189 0.3121 0.3144 1.2601 1.2697 1.3121 1.3184 2.5745 2.5840 2.6475 2.6483 3.3219 3.3266 3.3653 3.3659 3.4071 3.4209 3.5187 3.5340 3.6014 3.6230 3.6592 3.6625 4.7766 4.8332 4.8865 4.9396 5.0242 5.0457 5.0872 5.0908 5.4685 5.5037 5.5855 5.6135 6.1385 6.1397 6.1693 6.1758 6.3711 6.3820 6.4221 6.4317 9.1306 9.1322 9.4395 9.4541 10.8509 10.8602 10.8846 10.9048 11.2226 11.2310 k = 0.4444 0.3154 0.6947 ( 5824 PWs) bands (ev): -6.8076 -6.8073 -6.7476 -6.7474 -6.6363 -6.6363 -6.6110 -6.6104 0.2261 0.2347 0.3159 0.3169 1.2806 1.2896 1.3288 1.3352 2.5595 2.5674 2.6298 2.6308 3.3254 3.3316 3.3591 3.3612 3.4089 3.4222 3.5136 3.5254 3.6008 3.6212 3.6498 3.6543 4.7804 4.8268 4.8938 4.9379 5.0184 5.0392 5.0801 5.0869 5.4715 5.5096 5.5694 5.6012 6.1419 6.1448 6.1727 6.1793 6.3545 6.3645 6.4058 6.4154 9.1503 9.1515 9.4178 9.4315 10.8928 10.8957 10.9339 10.9399 11.2242 11.2338 k = 0.4583 0.3253 0.6826 ( 5826 PWs) bands (ev): -6.8040 -6.8037 -6.7537 -6.7536 -6.6329 -6.6329 -6.6147 -6.6143 0.2463 0.2539 0.3197 0.3200 1.2986 1.3066 1.3417 1.3478 2.5505 2.5567 2.6172 2.6182 3.3252 3.3314 3.3527 3.3555 3.4132 3.4253 3.5062 3.5139 3.6003 3.6178 3.6411 3.6462 4.7846 4.8199 4.9008 4.9352 5.0138 5.0318 5.0743 5.0824 5.4756 5.5156 5.5530 5.5880 6.1459 6.1503 6.1757 6.1819 6.3375 6.3460 6.3838 6.3930 9.1820 9.1859 9.3974 9.4103 10.9152 10.9312 10.9642 10.9753 11.2180 11.2327 k = 0.4722 0.3351 0.6705 ( 5822 PWs) bands (ev): -6.7994 -6.7992 -6.7623 -6.7621 -6.6291 -6.6290 -6.6176 -6.6173 0.2697 0.2760 0.3229 0.3244 1.3138 1.3203 1.3511 1.3563 2.5475 2.5519 2.6102 2.6110 3.3217 3.3264 3.3463 3.3486 3.4190 3.4289 3.4968 3.5002 3.5995 3.6123 3.6341 3.6385 4.7889 4.8127 4.9072 4.9311 5.0106 5.0237 5.0701 5.0774 5.4806 5.5186 5.5396 5.5742 6.1501 6.1552 6.1778 6.1827 6.3214 6.3277 6.3573 6.3655 9.2259 9.2323 9.3786 9.3907 10.9259 10.9482 10.9776 10.9995 11.2046 11.2174 k = 0.4861 0.3450 0.6584 ( 5821 PWs) bands (ev): -6.7938 -6.7937 -6.7734 -6.7733 -6.6248 -6.6247 -6.6194 -6.6192 0.2955 0.3002 0.3273 0.3295 1.3260 1.3299 1.3576 1.3608 2.5501 2.5524 2.6089 2.6094 3.3159 3.3183 3.3395 3.3408 3.4241 3.4304 3.4858 3.4863 3.5983 3.6049 3.6290 3.6314 4.7935 4.8054 4.9131 4.9256 5.0087 5.0155 5.0674 5.0719 5.4862 5.5092 5.5388 5.5600 6.1532 6.1574 6.1780 6.1808 6.3075 6.3109 6.3292 6.3348 9.2803 9.2886 9.3619 9.3729 10.9232 10.9396 10.9749 10.9923 11.2034 11.2177 k = 0.5000 0.3549 0.6463 ( 5808 PWs) bands (ev): -6.7876 -6.7876 -6.7867 -6.7867 -6.6205 -6.6205 -6.6192 -6.6192 0.3203 0.3203 0.3383 0.3383 1.3346 1.3346 1.3627 1.3627 2.5573 2.5573 2.6135 2.6135 3.3081 3.3081 3.3321 3.3321 3.4249 3.4249 3.4761 3.4761 3.5964 3.5964 3.6254 3.6254 4.7983 4.7983 4.9184 4.9184 5.0079 5.0079 5.0660 5.0660 5.4924 5.4924 5.5456 5.5456 6.1523 6.1523 6.1752 6.1752 6.2946 6.2946 6.3073 6.3073 9.3386 9.3386 9.3614 9.3614 10.9038 10.9038 10.9524 10.9524 11.2207 11.2207 k = 0.5000 0.3549 0.6463 ( 5808 PWs) bands (ev): -6.7876 -6.7876 -6.7867 -6.7867 -6.6205 -6.6205 -6.6192 -6.6192 0.3203 0.3203 0.3383 0.3383 1.3346 1.3346 1.3627 1.3627 2.5573 2.5573 2.6135 2.6135 3.3081 3.3081 3.3321 3.3321 3.4249 3.4249 3.4761 3.4761 3.5964 3.5964 3.6254 3.6254 4.7983 4.7983 4.9184 4.9184 5.0079 5.0079 5.0660 5.0660 5.4924 5.4924 5.5456 5.5456 6.1523 6.1523 6.1752 6.1752 6.2946 6.2946 6.3073 6.3073 9.3386 9.3386 9.3614 9.3614 10.9038 10.9038 10.9524 10.9524 11.2207 11.2207 k = 0.5000 0.3549 0.6255 ( 5810 PWs) bands (ev): -6.7954 -6.7954 -6.7946 -6.7946 -6.6153 -6.6153 -6.6140 -6.6140 0.3492 0.3492 0.3683 0.3683 1.3427 1.3427 1.3685 1.3685 2.5716 2.5716 2.6265 2.6265 3.2908 3.2908 3.3172 3.3172 3.4128 3.4128 3.4633 3.4633 3.5870 3.5870 3.6181 3.6181 4.7966 4.7966 4.9158 4.9158 5.0013 5.0013 5.0604 5.0604 5.4819 5.4819 5.5396 5.5396 6.1391 6.1391 6.1632 6.1632 6.2655 6.2655 6.2791 6.2791 9.3845 9.3845 9.4078 9.4078 10.8238 10.8238 10.8690 10.8690 11.2357 11.2357 k = 0.5000 0.3549 0.6046 ( 5806 PWs) bands (ev): -6.8045 -6.8045 -6.8038 -6.8038 -6.6087 -6.6087 -6.6073 -6.6073 0.3785 0.3785 0.3987 0.3987 1.3521 1.3521 1.3758 1.3758 2.5869 2.5869 2.6405 2.6405 3.2723 3.2723 3.3010 3.3010 3.4002 3.4002 3.4499 3.4499 3.5780 3.5780 3.6105 3.6105 4.7951 4.7951 4.9133 4.9133 4.9948 4.9948 5.0554 5.0554 5.4703 5.4703 5.5325 5.5325 6.1246 6.1246 6.1499 6.1499 6.2383 6.2383 6.2533 6.2533 9.4318 9.4318 9.4557 9.4557 10.7297 10.7297 10.7717 10.7717 11.2412 11.2412 k = 0.5000 0.3549 0.5838 ( 5794 PWs) bands (ev): -6.8150 -6.8150 -6.8143 -6.8143 -6.6008 -6.6008 -6.5993 -6.5993 0.4075 0.4075 0.4290 0.4290 1.3632 1.3632 1.3849 1.3849 2.6031 2.6031 2.6554 2.6554 3.2530 3.2530 3.2838 3.2838 3.3874 3.3874 3.4362 3.4362 3.5694 3.5694 3.6029 3.6029 4.7940 4.7940 4.9109 4.9109 4.9884 4.9884 5.0511 5.0511 5.4579 5.4579 5.5244 5.5244 6.1088 6.1088 6.1355 6.1355 6.2132 6.2132 6.2301 6.2301 9.4797 9.4797 9.5041 9.5041 10.6294 10.6294 10.6687 10.6687 11.2291 11.2291 k = 0.5000 0.3549 0.5629 ( 5798 PWs) bands (ev): -6.8266 -6.8266 -6.8260 -6.8260 -6.5917 -6.5917 -6.5900 -6.5900 0.4357 0.4357 0.4584 0.4584 1.3761 1.3761 1.3961 1.3961 2.6202 2.6202 2.6713 2.6713 3.2331 3.2331 3.2657 3.2657 3.3745 3.3745 3.4224 3.4224 3.5611 3.5611 3.5951 3.5951 4.7932 4.7932 4.9085 4.9085 4.9823 4.9823 5.0473 5.0473 5.4448 5.4448 5.5153 5.5153 6.0920 6.0920 6.1201 6.1201 6.1905 6.1905 6.2096 6.2096 9.5270 9.5270 9.5519 9.5519 10.5269 10.5269 10.5637 10.5637 11.1991 11.1991 k = 0.5000 0.3549 0.5421 ( 5802 PWs) bands (ev): -6.8392 -6.8392 -6.8385 -6.8385 -6.5815 -6.5815 -6.5798 -6.5798 0.4622 0.4622 0.4862 0.4862 1.3912 1.3912 1.4100 1.4100 2.6381 2.6381 2.6881 2.6881 3.2129 3.2129 3.2471 3.2471 3.3616 3.3616 3.4087 3.4087 3.5533 3.5533 3.5873 3.5873 4.7928 4.7928 4.9064 4.9064 4.9764 4.9764 5.0441 5.0441 5.4315 5.4315 5.5053 5.5053 6.0747 6.0747 6.1042 6.1042 6.1699 6.1699 6.1913 6.1913 9.5724 9.5724 9.5977 9.5977 10.4247 10.4247 10.4590 10.4590 11.1536 11.1536 k = 0.5000 0.3549 0.5212 ( 5796 PWs) bands (ev): -6.8525 -6.8525 -6.8518 -6.8518 -6.5703 -6.5703 -6.5686 -6.5686 0.4865 0.4865 0.5117 0.5117 1.4086 1.4086 1.4271 1.4271 2.6565 2.6565 2.7056 2.7056 3.1928 3.1928 3.2284 3.2284 3.3490 3.3490 3.3953 3.3953 3.5457 3.5457 3.5795 3.5795 4.7928 4.7928 4.9044 4.9044 4.9708 4.9708 5.0411 5.0411 5.4182 5.4182 5.4948 5.4948 6.0575 6.0575 6.0880 6.0880 6.1514 6.1514 6.1750 6.1750 9.6139 9.6139 9.6395 9.6395 10.3249 10.3249 10.3571 10.3571 11.0962 11.0962 k = 0.5000 0.3549 0.5004 ( 5792 PWs) bands (ev): -6.8664 -6.8664 -6.8657 -6.8657 -6.5584 -6.5584 -6.5566 -6.5566 0.5078 0.5078 0.5342 0.5342 1.4288 1.4288 1.4478 1.4478 2.6754 2.6754 2.7238 2.7238 3.1730 3.1730 3.2099 3.2099 3.3367 3.3367 3.3825 3.3825 3.5385 3.5385 3.5717 3.5717 4.7933 4.7933 4.9027 4.9027 4.9655 4.9655 5.0382 5.0382 5.4055 5.4055 5.4839 5.4839 6.0408 6.0408 6.0721 6.0721 6.1347 6.1347 6.1599 6.1599 9.6487 9.6487 9.6747 9.6747 10.2302 10.2302 10.2607 10.2607 11.0303 11.0303 k = 0.5000 0.3549 0.4795 ( 5784 PWs) bands (ev): -6.8808 -6.8808 -6.8800 -6.8800 -6.5458 -6.5458 -6.5440 -6.5440 0.5256 0.5256 0.5530 0.5530 1.4520 1.4520 1.4722 1.4722 2.6946 2.6946 2.7424 2.7424 3.1540 3.1540 3.1921 3.1921 3.3248 3.3248 3.3703 3.3703 3.5316 3.5316 3.5640 3.5640 4.7943 4.7943 4.9012 4.9012 4.9604 4.9604 5.0351 5.0351 5.3938 5.3938 5.4729 5.4729 6.0249 6.0249 6.0567 6.0567 6.1195 6.1195 6.1460 6.1460 9.6723 9.6723 9.6990 9.6990 10.1443 10.1443 10.1740 10.1740 10.9591 10.9591 k = 0.5000 0.3549 0.4587 ( 5784 PWs) bands (ev): -6.8955 -6.8955 -6.8947 -6.8947 -6.5327 -6.5327 -6.5309 -6.5309 0.5395 0.5395 0.5676 0.5676 1.4785 1.4785 1.5003 1.5003 2.7140 2.7140 2.7614 2.7614 3.1361 3.1361 3.1753 3.1753 3.3136 3.3136 3.3589 3.3589 3.5249 3.5249 3.5563 3.5563 4.7957 4.7957 4.8998 4.8998 4.9554 4.9554 5.0316 5.0316 5.3836 5.3836 5.4623 5.4623 6.0099 6.0099 6.0421 6.0421 6.1056 6.1056 6.1328 6.1328 9.6779 9.6779 9.7063 9.7063 10.0728 10.0728 10.1036 10.1036 10.8850 10.8850 k = 0.5000 0.3549 0.4378 ( 5772 PWs) bands (ev): -6.9103 -6.9103 -6.9095 -6.9095 -6.5191 -6.5191 -6.5173 -6.5173 0.5493 0.5493 0.5778 0.5778 1.5084 1.5084 1.5322 1.5322 2.7333 2.7333 2.7805 2.7805 3.1196 3.1196 3.1599 3.1599 3.3031 3.3031 3.3484 3.3484 3.5185 3.5185 3.5487 3.5487 4.7975 4.7975 4.8987 4.8987 4.9504 4.9504 5.0273 5.0273 5.3755 5.3755 5.4525 5.4525 5.9959 5.9959 6.0283 6.0283 6.0928 6.0928 6.1203 6.1203 9.6586 9.6586 9.6890 9.6890 10.0224 10.0224 10.0559 10.0559 10.8101 10.8101 k = 0.5000 0.3549 0.4170 ( 5774 PWs) bands (ev): -6.9251 -6.9251 -6.9243 -6.9243 -6.5053 -6.5053 -6.5035 -6.5035 0.5548 0.5548 0.5835 0.5835 1.5416 1.5416 1.5673 1.5673 2.7525 2.7525 2.7994 2.7994 3.1047 3.1047 3.1463 3.1463 3.2934 3.2934 3.3389 3.3389 3.5124 3.5124 3.5412 3.5412 4.7997 4.7997 4.8975 4.8975 4.9453 4.9453 5.0220 5.0220 5.3698 5.3698 5.4439 5.4439 5.9826 5.9826 6.0154 6.0154 6.0812 6.0812 6.1085 6.1085 9.6136 9.6136 9.6447 9.6447 9.9950 9.9950 10.0306 10.0306 10.7364 10.7364 k = 0.5000 0.3549 0.3961 ( 5778 PWs) bands (ev): -6.9399 -6.9399 -6.9391 -6.9391 -6.4912 -6.4912 -6.4894 -6.4894 0.5564 0.5564 0.5848 0.5848 1.5778 1.5778 1.6054 1.6054 2.7712 2.7712 2.8177 2.8177 3.0918 3.0918 3.1347 3.1347 3.2847 3.2847 3.3303 3.3303 3.5066 3.5066 3.5338 3.5338 4.8022 4.8022 4.8965 4.8965 4.9398 4.9398 5.0155 5.0155 5.3670 5.3670 5.4368 5.4368 5.9699 5.9699 6.0033 6.0033 6.0706 6.0706 6.0974 6.0974 9.5505 9.5505 9.5804 9.5804 9.9831 9.9831 10.0192 10.0192 10.6653 10.6653 k = 0.5000 0.3549 0.3753 ( 5790 PWs) bands (ev): -6.9545 -6.9545 -6.9537 -6.9537 -6.4770 -6.4770 -6.4753 -6.4753 0.5541 0.5541 0.5819 0.5819 1.6167 1.6167 1.6458 1.6458 2.7894 2.7894 2.8352 2.8352 3.0811 3.0811 3.1254 3.1254 3.2769 3.2769 3.3228 3.3228 3.5012 3.5012 3.5267 3.5267 4.8050 4.8050 4.8954 4.8954 4.9337 4.9337 5.0077 5.0077 5.3674 5.3674 5.4318 5.4318 5.9575 5.9575 5.9920 5.9920 6.0612 6.0612 6.0871 6.0871 9.4778 9.4778 9.5057 9.5057 9.9765 9.9765 10.0121 10.0121 10.5983 10.5983 k = 0.5000 0.3549 0.3544 ( 5792 PWs) bands (ev): -6.9688 -6.9688 -6.9680 -6.9680 -6.4629 -6.4629 -6.4611 -6.4611 0.5483 0.5483 0.5754 0.5754 1.6577 1.6577 1.6880 1.6880 2.8069 2.8069 2.8513 2.8513 3.0728 3.0728 3.1186 3.1186 3.2702 3.2702 3.3165 3.3165 3.4961 3.4961 3.5199 3.5199 4.8081 4.8081 4.8942 4.8942 4.9270 4.9270 4.9987 4.9987 5.3710 5.3710 5.4291 5.4291 5.9452 5.9452 5.9812 5.9812 6.0530 6.0530 6.0778 6.0778 9.4014 9.4014 9.4272 9.4272 9.9679 9.9679 10.0027 10.0027 10.5367 10.5367 k = 0.5000 0.3549 0.3336 ( 5792 PWs) bands (ev): -6.9828 -6.9828 -6.9820 -6.9820 -6.4488 -6.4488 -6.4471 -6.4471 0.5396 0.5396 0.5656 0.5656 1.7001 1.7001 1.7312 1.7312 2.8235 2.8235 2.8658 2.8658 3.0671 3.0671 3.1146 3.1146 3.2646 3.2646 3.3112 3.3112 3.4915 3.4915 3.5134 3.5134 4.8112 4.8112 4.8926 4.8926 4.9197 4.9197 4.9888 4.9888 5.3778 5.3778 5.4290 5.4290 5.9329 5.9329 5.9707 5.9707 6.0461 6.0461 6.0696 6.0696 9.3248 9.3248 9.3485 9.3485 9.9535 9.9535 9.9873 9.9873 10.4814 10.4814 k = 0.5000 0.3549 0.3127 ( 5786 PWs) bands (ev): -6.9963 -6.9963 -6.9955 -6.9955 -6.4350 -6.4350 -6.4334 -6.4334 0.5284 0.5284 0.5532 0.5532 1.7432 1.7432 1.7749 1.7749 2.8391 2.8391 2.8784 2.8784 3.0640 3.0640 3.1134 3.1134 3.2600 3.2600 3.3069 3.3069 3.4874 3.4874 3.5074 3.5074 4.8143 4.8143 4.8901 4.8901 4.9119 4.9119 4.9782 4.9782 5.3877 5.3877 5.4318 5.4318 5.9204 5.9204 5.9602 5.9602 6.0407 6.0407 6.0628 6.0628 9.2499 9.2499 9.2716 9.2716 9.9317 9.9317 9.9641 9.9641 10.4325 10.4325 k = 0.5000 0.3549 0.2919 ( 5784 PWs) bands (ev): -7.0093 -7.0093 -7.0085 -7.0085 -6.4215 -6.4215 -6.4199 -6.4199 0.5153 0.5153 0.5386 0.5386 1.7865 1.7865 1.8182 1.8182 2.8535 2.8535 2.8890 2.8890 3.0632 3.0632 3.1149 3.1149 3.2566 3.2566 3.3036 3.3036 3.4838 3.4838 3.5020 3.5020 4.8171 4.8171 4.8860 4.8860 4.9045 4.9045 4.9676 4.9676 5.4004 5.4004 5.4374 5.4374 5.9076 5.9076 5.9495 5.9495 6.0366 6.0366 6.0574 6.0574 9.1779 9.1779 9.1977 9.1977 9.9025 9.9025 9.9330 9.9330 10.3895 10.3895 k = 0.5000 0.3549 0.2710 ( 5784 PWs) bands (ev): -7.0217 -7.0217 -7.0209 -7.0209 -6.4084 -6.4084 -6.4069 -6.4069 0.5006 0.5006 0.5225 0.5225 1.8291 1.8291 1.8606 1.8606 2.8667 2.8667 2.8980 2.8980 3.0646 3.0646 3.1188 3.1188 3.2541 3.2541 3.3010 3.3010 3.4809 3.4809 3.4974 3.4974 4.8192 4.8192 4.8789 4.8789 4.8986 4.8986 4.9575 4.9575 5.4156 5.4156 5.4458 5.4458 5.8945 5.8945 5.9383 5.9383 6.0341 6.0341 6.0537 6.0537 9.1095 9.1095 9.1275 9.1275 9.8669 9.8669 9.8952 9.8952 10.3510 10.3510 k = 0.5000 0.3549 0.2502 ( 5782 PWs) bands (ev): -7.0334 -7.0334 -7.0327 -7.0327 -6.3958 -6.3958 -6.3944 -6.3944 0.4851 0.4851 0.5054 0.5054 1.8707 1.8707 1.9015 1.9015 2.8787 2.8787 2.9058 2.9058 3.0679 3.0679 3.1245 3.1245 3.2525 3.2525 3.2991 3.2991 3.4786 3.4786 3.4936 3.4936 4.8202 4.8202 4.8690 4.8690 4.8944 4.8944 4.9486 4.9486 5.4329 5.4329 5.4569 5.4569 5.8811 5.8811 5.9265 5.9265 6.0329 6.0329 6.0515 6.0515 9.0454 9.0454 9.0617 9.0617 9.8266 9.8266 9.8525 9.8525 10.3154 10.3154 k = 0.5000 0.3549 0.2293 ( 5776 PWs) bands (ev): -7.0443 -7.0443 -7.0437 -7.0437 -6.3838 -6.3838 -6.3825 -6.3825 0.4690 0.4690 0.4877 0.4877 1.9106 1.9106 1.9402 1.9402 2.8893 2.8893 2.9128 2.9128 3.0726 3.0726 3.1314 3.1314 3.2518 3.2518 3.2975 3.2975 3.4771 3.4771 3.4908 3.4908 4.8193 4.8193 4.8575 4.8575 4.8914 4.8914 4.9413 4.9413 5.4521 5.4521 5.4703 5.4703 5.8675 5.8675 5.9140 5.9140 6.0332 6.0332 6.0509 6.0509 8.9859 8.9859 9.0006 9.0006 9.7836 9.7836 9.8068 9.8068 10.2811 10.2811 k = 0.5000 0.3549 0.2085 ( 5776 PWs) bands (ev): -7.0545 -7.0545 -7.0540 -7.0540 -6.3725 -6.3725 -6.3713 -6.3713 0.4530 0.4530 0.4699 0.4699 1.9482 1.9482 1.9764 1.9764 2.8987 2.8987 2.9197 2.9197 3.0785 3.0785 3.1389 3.1389 3.2516 3.2516 3.2960 3.2960 3.4763 3.4763 3.4891 3.4891 4.8161 4.8161 4.8452 4.8452 4.8894 4.8894 4.9358 4.9358 5.4727 5.4727 5.4858 5.4858 5.8536 5.8536 5.9008 5.9008 6.0348 6.0348 6.0516 6.0516 8.9314 8.9314 8.9445 8.9445 9.7394 9.7394 9.7599 9.7599 10.2466 10.2466 k = 0.5000 0.3549 0.1876 ( 5778 PWs) bands (ev): -7.0639 -7.0639 -7.0634 -7.0634 -6.3620 -6.3620 -6.3609 -6.3609 0.4372 0.4372 0.4525 0.4525 1.9833 1.9833 2.0096 2.0096 2.9070 2.9070 2.9266 2.9266 3.0853 3.0853 3.1463 3.1463 3.2518 3.2518 3.2942 3.2942 3.4764 3.4764 3.4885 3.4885 4.8101 4.8101 4.8326 4.8326 4.8888 4.8888 4.9319 4.9319 5.4944 5.4944 5.5029 5.5029 5.8395 5.8395 5.8869 5.8869 6.0375 6.0375 6.0535 6.0535 8.8820 8.8820 8.8936 8.8936 9.6954 9.6954 9.7133 9.7133 10.2115 10.2115 k = 0.5000 0.3549 0.1668 ( 5788 PWs) bands (ev): -7.0724 -7.0724 -7.0719 -7.0719 -6.3524 -6.3524 -6.3513 -6.3513 0.4223 0.4223 0.4359 0.4359 2.0154 2.0154 2.0395 2.0395 2.9145 2.9145 2.9334 2.9334 3.0930 3.0930 3.1532 3.1532 3.2524 3.2524 3.2921 3.2921 3.4774 3.4774 3.4890 3.4890 4.8021 4.8021 4.8203 4.8203 4.8897 4.8897 4.9292 4.9292 5.5166 5.5166 5.5215 5.5215 5.8252 5.8252 5.8722 5.8722 6.0412 6.0412 6.0563 6.0563 8.8380 8.8380 8.8481 8.8481 9.6528 9.6528 9.6681 9.6681 10.1756 10.1756 k = 0.5000 0.3549 0.1459 ( 5790 PWs) bands (ev): -7.0800 -7.0800 -7.0796 -7.0796 -6.3437 -6.3437 -6.3427 -6.3427 0.4084 0.4084 0.4203 0.4203 2.0442 2.0442 2.0659 2.0659 2.9213 2.9213 2.9400 2.9400 3.1012 3.1012 3.1592 3.1592 3.2531 3.2531 3.2893 3.2893 3.4793 3.4793 3.4902 3.4902 4.7928 4.7928 4.8083 4.8083 4.8919 4.8919 4.9273 4.9273 5.5382 5.5382 5.5418 5.5418 5.8109 5.8109 5.8570 5.8570 6.0457 6.0457 6.0597 6.0597 8.7994 8.7994 8.8081 8.8081 9.6125 9.6125 9.6254 9.6254 10.1395 10.1395 k = 0.5000 0.3549 0.1251 ( 5794 PWs) bands (ev): -7.0866 -7.0866 -7.0863 -7.0863 -6.3359 -6.3359 -6.3351 -6.3351 0.3958 0.3958 0.4060 0.4060 2.0697 2.0697 2.0886 2.0886 2.9278 2.9278 2.9461 2.9461 3.1098 3.1098 3.1640 3.1640 3.2538 3.2538 3.2859 3.2859 3.4819 3.4819 3.4920 3.4920 4.7834 4.7834 4.7968 4.7968 4.8949 4.8949 4.9259 4.9259 5.5582 5.5582 5.5640 5.5640 5.7967 5.7967 5.8412 5.8412 6.0508 6.0508 6.0634 6.0634 8.7662 8.7662 8.7736 8.7736 9.5753 9.5753 9.5860 9.5860 10.1042 10.1042 k = 0.5000 0.3549 0.1042 ( 5790 PWs) bands (ev): -7.0923 -7.0923 -7.0920 -7.0920 -6.3293 -6.3293 -6.3286 -6.3286 0.3849 0.3849 0.3934 0.3934 2.0915 2.0915 2.1076 2.1076 2.9341 2.9341 2.9512 2.9512 3.1188 3.1188 3.1674 3.1674 3.2546 3.2546 3.2820 3.2820 3.4850 3.4850 3.4940 3.4940 4.7746 4.7746 4.7861 4.7861 4.8984 4.8984 4.9245 4.9245 5.5776 5.5776 5.5864 5.5864 5.7827 5.7827 5.8249 5.8249 6.0560 6.0560 6.0672 6.0672 8.7385 8.7385 8.7446 8.7446 9.5421 9.5421 9.5507 9.5507 10.0712 10.0712 k = 0.5000 0.3549 0.0834 ( 5776 PWs) bands (ev): -7.0970 -7.0970 -7.0967 -7.0967 -6.3238 -6.3238 -6.3232 -6.3232 0.3759 0.3759 0.3827 0.3827 2.1098 2.1098 2.1227 2.1227 2.9401 2.9401 2.9552 2.9552 3.1279 3.1279 3.1694 3.1694 3.2554 3.2554 3.2777 3.2777 3.4883 3.4883 3.4960 3.4960 4.7670 4.7670 4.7766 4.7766 4.9021 4.9021 4.9233 4.9233 5.5963 5.5963 5.6078 5.6078 5.7694 5.7694 5.8083 5.8083 6.0612 6.0612 6.0705 6.0705 8.7162 8.7162 8.7210 8.7210 9.5136 9.5136 9.5203 9.5203 10.0421 10.0421 k = 0.5000 0.3549 0.0625 ( 5768 PWs) bands (ev): -7.1006 -7.1006 -7.1004 -7.1004 -6.3194 -6.3194 -6.3190 -6.3190 0.3688 0.3688 0.3739 0.3739 2.1243 2.1243 2.1341 2.1341 2.9455 2.9455 2.9579 2.9579 3.1368 3.1368 3.1696 3.1696 3.2565 3.2565 3.2733 3.2733 3.4916 3.4916 3.4976 3.4976 4.7611 4.7611 4.7685 4.7685 4.9058 4.9058 4.9218 4.9218 5.6139 5.6139 5.6270 5.6270 5.7575 5.7575 5.7916 5.7916 6.0660 6.0660 6.0732 6.0732 8.6991 8.6991 8.7028 8.7028 9.4905 9.4905 9.4955 9.4955 10.0182 10.0182 k = 0.5000 0.3549 0.0417 ( 5758 PWs) bands (ev): -7.1032 -7.1032 -7.1031 -7.1031 -6.3162 -6.3162 -6.3160 -6.3160 0.3639 0.3639 0.3673 0.3673 2.1352 2.1352 2.1418 2.1418 2.9504 2.9504 2.9591 2.9591 3.1453 3.1453 3.1680 3.1680 3.2578 3.2578 3.2691 3.2691 3.4945 3.4945 3.4987 3.4987 4.7571 4.7571 4.7621 4.7621 4.9093 4.9093 4.9200 4.9200 5.6299 5.6299 5.6425 5.6425 5.7486 5.7486 5.7754 5.7754 6.0701 6.0701 6.0750 6.0750 8.6872 8.6872 8.6897 8.6897 9.4737 9.4737 9.4769 9.4769 10.0007 10.0007 k = 0.5000 0.3549 0.0208 ( 5738 PWs) bands (ev): -7.1048 -7.1048 -7.1047 -7.1047 -6.3143 -6.3143 -6.3142 -6.3142 0.3613 0.3613 0.3630 0.3630 2.1424 2.1424 2.1457 2.1457 2.9543 2.9543 2.9589 2.9589 3.1530 3.1530 3.1646 3.1646 3.2597 3.2597 3.2653 3.2653 3.4968 3.4968 3.4989 3.4989 4.7552 4.7552 4.7577 4.7577 4.9126 4.9126 4.9179 4.9179 5.6430 5.6430 5.6512 5.6512 5.7453 5.7453 5.7607 5.7607 6.0732 6.0732 6.0757 6.0757 8.6804 8.6804 8.6816 8.6816 9.4636 9.4636 9.4652 9.4652 9.9905 9.9905 k = 0.5000 0.3549 0.0000 ( 5742 PWs) bands (ev): -7.1053 -7.1053 -7.1053 -7.1053 -6.3136 -6.3136 -6.3136 -6.3136 0.3610 0.3610 0.3610 0.3610 2.1458 2.1458 2.1458 2.1458 2.9572 2.9572 2.9572 2.9572 3.1596 3.1596 3.1596 3.1596 3.2622 3.2622 3.2622 3.2622 3.4983 3.4983 3.4983 3.4983 4.7553 4.7553 4.7553 4.7553 4.9154 4.9154 4.9154 4.9154 5.6511 5.6511 5.6511 5.6511 5.7497 5.7497 5.7497 5.7497 6.0751 6.0751 6.0751 6.0751 8.6785 8.6785 8.6785 8.6785 9.4608 9.4608 9.4608 9.4608 9.9881 9.9881 k = 0.0000 0.0000 0.8639 ( 5828 PWs) bands (ev): -6.7699 -6.7699 -6.7681 -6.7681 -6.6219 -6.6219 -6.6217 -6.6217 0.1491 0.1491 0.1614 0.1614 1.3011 1.3011 1.3410 1.3410 2.4830 2.4830 2.5470 2.5470 3.3976 3.3976 3.4053 3.4053 3.4925 3.4925 3.5433 3.5433 3.6658 3.6658 3.6710 3.6710 4.8126 4.8126 4.9348 4.9348 5.0526 5.0526 5.1183 5.1183 5.5360 5.5360 5.5649 5.5649 6.2178 6.2178 6.2307 6.2307 6.5257 6.5257 6.5356 6.5356 9.0776 9.0776 9.0968 9.0968 10.5784 10.5784 10.5819 10.5819 11.6012 11.6012 k = 0.0167 0.0118 0.8639 ( 5828 PWs) bands (ev): -6.7700 -6.7698 -6.7681 -6.7681 -6.6219 -6.6218 -6.6218 -6.6216 0.1490 0.1510 0.1619 0.1627 1.2966 1.2991 1.3365 1.3381 2.4866 2.4890 2.5511 2.5516 3.3963 3.3978 3.4029 3.4063 3.4908 3.4930 3.5377 3.5470 3.6583 3.6653 3.6734 3.6766 4.8057 4.8193 4.9296 4.9383 5.0513 5.0549 5.1155 5.1215 5.5317 5.5409 5.5619 5.5679 6.2160 6.2182 6.2297 6.2306 6.5227 6.5252 6.5323 6.5357 9.0809 9.0842 9.1008 9.1027 10.5774 10.5775 10.5808 10.5811 11.5981 11.5992 k = 0.0333 0.0237 0.8639 ( 5822 PWs) bands (ev): -6.7700 -6.7697 -6.7681 -6.7680 -6.6220 -6.6220 -6.6219 -6.6216 0.1508 0.1547 0.1643 0.1660 1.2859 1.2908 1.3248 1.3279 2.4996 2.5044 2.5637 2.5647 3.3938 3.3967 3.3989 3.4057 3.4880 3.4924 3.5304 3.5485 3.6513 3.6597 3.6808 3.6820 4.7988 4.8257 4.9228 4.9406 5.0511 5.0578 5.1131 5.1248 5.5284 5.5464 5.5590 5.5710 6.2128 6.2171 6.2275 6.2293 6.5162 6.5212 6.5260 6.5328 9.0939 9.1005 9.1146 9.1184 10.5743 10.5746 10.5777 10.5785 11.5898 11.5920 k = 0.0500 0.0355 0.8639 ( 5824 PWs) bands (ev): -6.7700 -6.7695 -6.7680 -6.7679 -6.6222 -6.6222 -6.6220 -6.6217 0.1542 0.1601 0.1686 0.1710 1.2696 1.2767 1.3066 1.3112 2.5212 2.5283 2.5842 2.5855 3.3900 3.3933 3.3941 3.4031 3.4843 3.4909 3.5216 3.5477 3.6450 3.6541 3.6872 3.6879 4.7920 4.8317 4.9143 4.9418 5.0523 5.0607 5.1112 5.1282 5.5260 5.5523 5.5562 5.5741 6.2084 6.2144 6.2239 6.2268 6.5068 6.5143 6.5170 6.5272 9.1163 9.1260 9.1378 9.1436 10.5690 10.5693 10.5726 10.5736 11.5765 11.5797 k = 0.0667 0.0473 0.8639 ( 5816 PWs) bands (ev): -6.7699 -6.7692 -6.7679 -6.7677 -6.6224 -6.6224 -6.6221 -6.6217 0.1593 0.1672 0.1745 0.1777 1.2486 1.2578 1.2832 1.2891 2.5504 2.5597 2.6119 2.6133 3.3845 3.3859 3.3897 3.3981 3.4798 3.4889 3.5118 3.5448 3.6398 3.6487 3.6923 3.6946 4.7856 4.8371 4.9043 4.9424 5.0548 5.0635 5.1099 5.1313 5.5248 5.5536 5.5585 5.5773 6.2029 6.2101 6.2190 6.2231 6.4949 6.5049 6.5057 6.5196 9.1475 9.1603 9.1698 9.1775 10.5610 10.5615 10.5649 10.5662 11.5584 11.5627 k = 0.0833 0.0591 0.8639 ( 5808 PWs) bands (ev): -6.7698 -6.7689 -6.7678 -6.7675 -6.6227 -6.6226 -6.6223 -6.6219 0.1658 0.1757 0.1819 0.1859 1.2240 1.2351 1.2558 1.2628 2.5860 2.5973 2.6457 2.6469 3.3763 3.3770 3.3830 3.3904 3.4750 3.4867 3.5015 3.5401 3.6357 3.6436 3.6971 3.7007 4.7796 4.8420 4.8931 4.9426 5.0584 5.0657 5.1093 5.1342 5.5247 5.5511 5.5648 5.5806 6.1962 6.2041 6.2127 6.2180 6.4814 6.4930 6.4940 6.5107 9.1866 9.2023 9.2098 9.2195 10.5499 10.5505 10.5542 10.5557 11.5360 11.5413 k = 0.1000 0.0710 0.8639 ( 5816 PWs) bands (ev): -6.7697 -6.7686 -6.7676 -6.7673 -6.6229 -6.6229 -6.6225 -6.6220 0.1735 0.1855 0.1907 0.1954 1.1969 1.2098 1.2258 1.2338 2.6265 2.6398 2.6845 2.6852 3.3641 3.3669 3.3735 3.3794 3.4700 3.4846 3.4911 3.5342 3.6325 3.6387 3.7016 3.7061 4.7743 4.8461 4.8808 4.9424 5.0631 5.0671 5.1092 5.1366 5.5257 5.5489 5.5711 5.5839 6.1885 6.1964 6.2049 6.2114 6.4671 6.4795 6.4822 6.5011 9.2327 9.2511 9.2567 9.2684 10.5351 10.5358 10.5398 10.5414 11.5103 11.5165 k = 0.1167 0.0828 0.8639 ( 5816 PWs) bands (ev): -6.7695 -6.7683 -6.7674 -6.7671 -6.6232 -6.6232 -6.6227 -6.6222 0.1822 0.1962 0.2004 0.2058 1.1687 1.1831 1.1944 1.2034 2.6706 2.6861 2.7271 2.7273 3.3491 3.3535 3.3606 3.3650 3.4654 3.4814 3.4830 3.5279 3.6302 3.6343 3.7058 3.7110 4.7697 4.8495 4.8680 4.9422 5.0677 5.0685 5.1098 5.1384 5.5278 5.5468 5.5773 5.5873 6.1800 6.1873 6.1958 6.2034 6.4531 6.4659 6.4704 6.4916 9.2845 9.3056 9.3095 9.3231 10.5160 10.5169 10.5211 10.5228 11.4826 11.4895 k = 0.1333 0.0946 0.8639 ( 5814 PWs) bands (ev): -6.7693 -6.7680 -6.7672 -6.7669 -6.6235 -6.6235 -6.6229 -6.6224 0.1915 0.2074 0.2108 0.2170 1.1403 1.1561 1.1629 1.1727 2.7172 2.7349 2.7716 2.7729 3.3310 3.3364 3.3439 3.3471 3.4612 3.4729 3.4818 3.5219 3.6284 3.6303 3.7097 3.7151 4.7661 4.8524 4.8549 4.9421 5.0676 5.0747 5.1108 5.1394 5.5308 5.5451 5.5833 5.5907 6.1710 6.1770 6.1855 6.1942 6.4400 6.4528 6.4593 6.4827 9.3407 9.3642 9.3666 9.3823 10.4923 10.4934 10.4978 10.4993 11.4545 11.4618 k = 0.1500 0.1065 0.8639 ( 5806 PWs) bands (ev): -6.7692 -6.7677 -6.7671 -6.7668 -6.6238 -6.6238 -6.6231 -6.6225 0.2010 0.2189 0.2215 0.2283 1.1130 1.1300 1.1324 1.1432 2.7650 2.7852 2.8176 2.8204 3.3097 3.3152 3.3232 3.3258 3.4577 3.4658 3.4811 3.5167 3.6268 3.6271 3.7132 3.7186 4.7637 4.8419 4.8546 4.9420 5.0669 5.0812 5.1122 5.1396 5.5345 5.5437 5.5888 5.5941 6.1619 6.1661 6.1745 6.1839 6.4285 6.4408 6.4493 6.4748 9.3995 9.4255 9.4266 9.4444 10.4639 10.4653 10.4697 10.4707 11.4275 11.4352 k = 0.1667 0.1183 0.8639 ( 5810 PWs) bands (ev): -6.7690 -6.7674 -6.7669 -6.7666 -6.6241 -6.6240 -6.6233 -6.6227 0.2102 0.2300 0.2319 0.2393 1.0879 1.1040 1.1058 1.1158 2.8128 2.8361 2.8642 2.8689 3.2854 3.2901 3.2984 3.3017 3.4547 3.4602 3.4808 3.5124 3.6237 3.6261 3.7164 3.7214 4.7625 4.8292 4.8562 4.9420 5.0657 5.0882 5.1138 5.1389 5.5385 5.5425 5.5939 5.5974 6.1532 6.1552 6.1634 6.1731 6.4189 6.4302 6.4408 6.4681 9.4590 9.4873 9.4874 9.5074 10.4314 10.4332 10.4372 10.4376 11.4034 11.4112 k = 0.1833 0.1301 0.8639 ( 5810 PWs) bands (ev): -6.7689 -6.7671 -6.7667 -6.7665 -6.6243 -6.6243 -6.6235 -6.6229 0.2187 0.2402 0.2416 0.2494 1.0659 1.0788 1.0844 1.0916 2.8593 2.8865 2.9103 2.9175 3.2583 3.2615 3.2699 3.2755 3.4524 3.4560 3.4807 3.5091 3.6212 3.6253 3.7192 3.7235 4.7627 4.8170 4.8574 4.9420 5.0642 5.0951 5.1154 5.1372 5.5417 5.5426 5.5982 5.6004 6.1451 6.1454 6.1529 6.1624 6.4114 6.4211 6.4338 6.4627 9.5167 9.5466 9.5473 9.5690 10.3963 10.3986 10.4014 10.4018 11.3832 11.3909 k = 0.2000 0.1419 0.8639 ( 5808 PWs) bands (ev): -6.7687 -6.7668 -6.7666 -6.7664 -6.6245 -6.6245 -6.6237 -6.6230 0.2260 0.2489 0.2499 0.2582 1.0479 1.0577 1.0667 1.0716 2.9026 2.9353 2.9548 2.9652 3.2290 3.2302 3.2381 3.2484 3.4507 3.4530 3.4807 3.5067 3.6193 3.6247 3.7216 3.7250 4.7643 4.8056 4.8582 4.9421 5.0628 5.1021 5.1169 5.1346 5.5410 5.5462 5.6018 5.6030 6.1363 6.1392 6.1437 6.1526 6.4061 6.4137 6.4285 6.4586 9.5693 9.6010 9.6021 9.6256 10.3613 10.3643 10.3646 10.3662 11.3676 11.3749 k = 0.2167 0.1538 0.8639 ( 5804 PWs) bands (ev): -6.7687 -6.7666 -6.7665 -6.7663 -6.6246 -6.6246 -6.6238 -6.6231 0.2316 0.2557 0.2563 0.2649 1.0350 1.0415 1.0534 1.0566 2.9401 2.9808 2.9956 3.0107 3.1980 3.1988 3.2043 3.2227 3.4496 3.4509 3.4808 3.5052 3.6179 3.6242 3.7235 3.7259 4.7675 4.7953 4.8587 4.9422 5.0616 5.1089 5.1180 5.1310 5.5406 5.5492 5.6044 5.6050 6.1296 6.1351 6.1366 6.1443 6.4028 6.4081 6.4248 6.4557 9.6125 9.6462 9.6473 9.6729 10.3305 10.3316 10.3341 10.3342 11.3570 11.3626 k = 0.2333 0.1656 0.8639 ( 5796 PWs) bands (ev): -6.7686 -6.7665 -6.7664 -6.7663 -6.6247 -6.6247 -6.6239 -6.6232 0.2352 0.2600 0.2603 0.2691 1.0275 1.0308 1.0452 1.0473 2.9673 3.0189 3.0278 3.0504 3.1695 3.1714 3.1716 3.2028 3.4490 3.4496 3.4809 3.5043 3.6170 3.6240 3.7249 3.7261 4.7722 4.7862 4.8590 4.9423 5.0608 5.1154 5.1188 5.1265 5.5404 5.5511 5.6060 5.6063 6.1253 6.1321 6.1334 6.1380 6.4014 6.4041 6.4226 6.4540 9.6415 9.6769 9.6776 9.7051 10.3080 10.3091 10.3111 10.3130 11.3512 11.3541 k = 0.2500 0.1774 0.8639 ( 5804 PWs) bands (ev): -6.7686 -6.7664 -6.7664 -6.7664 -6.6247 -6.6247 -6.6239 -6.6232 0.2364 0.2616 0.2616 0.2706 1.0261 1.0261 1.0425 1.0442 2.9775 3.0389 3.0389 3.0704 3.1539 3.1574 3.1574 3.1950 3.4490 3.4490 3.4809 3.5040 3.6167 3.6239 3.7258 3.7258 4.7785 4.7785 4.8591 4.9423 5.0605 5.1191 5.1213 5.1213 5.5403 5.5517 5.6066 5.6066 6.1238 6.1305 6.1343 6.1343 6.4019 6.4019 6.4219 6.4535 9.6518 9.6881 9.6881 9.7166 10.2992 10.3020 10.3020 10.3053 11.3503 11.3503 Writing output data file AlCuSe2.save init_run : 3.67s CPU 13.14s WALL ( 1 calls) electrons : 1249.99s CPU 1260.13s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.29s CPU 1.52s WALL ( 1 calls) Called by electrons: c_bands : 1249.92s CPU 1259.62s WALL ( 1 calls) v_of_rho : 0.12s CPU 0.87s WALL ( 1 calls) v_h : 0.04s CPU 0.04s WALL ( 1 calls) v_xc : 0.07s CPU 0.59s WALL ( 1 calls) newd : 0.49s CPU 0.63s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.10s WALL ( 282 calls) cegterg : 1143.37s CPU 1149.10s WALL ( 759 calls) Called by sum_band: Called by *egterg: h_psi : 632.20s CPU 641.15s WALL ( 13127 calls) s_psi : 40.75s CPU 41.23s WALL ( 13127 calls) g_psi : 0.98s CPU 0.99s WALL ( 12086 calls) cdiaghg : 363.28s CPU 360.67s WALL ( 12368 calls) cegterg:over : 74.94s CPU 71.91s WALL ( 12086 calls) cegterg:upda : 22.11s CPU 25.69s WALL ( 12086 calls) cegterg:last : 18.11s CPU 18.78s WALL ( 1871 calls) Called by h_psi: h_psi:vloc : 547.71s CPU 554.90s WALL ( 13127 calls) h_psi:vnl : 83.98s CPU 85.13s WALL ( 13127 calls) add_vuspsi : 30.78s CPU 34.77s WALL ( 13127 calls) General routines calbec : 53.14s CPU 50.24s WALL ( 13127 calls) fft : 0.28s CPU 0.88s WALL ( 19 calls) ffts : 0.01s CPU 0.08s WALL ( 4 calls) fftw : 519.40s CPU 524.68s WALL ( 1314244 calls) interpolate : 0.03s CPU 0.11s WALL ( 4 calls) davcio : 0.04s CPU 2.99s WALL ( 564 calls) Parallel routines fft_scatter : 289.96s CPU 291.63s WALL ( 1314267 calls) PWSCF : 21m56.74s CPU 24m49.61s WALL This run was terminated on: 13:10:58 12Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=