Program PWSCF v.5.1.1 starts on 15Jun2016 at 4:53: 6 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: ./KCoO2.save/ file Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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 56 32 9 1645 717 110 Max 57 33 10 1650 740 113 Sum 2713 1579 437 79047 34923 5337 bravais-lattice index = 14 lattice parameter (alat) = 10.2791 a.u. unit-cell volume = 801.9850 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.279150 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.449033 celldm(5)= -0.449033 celldm(6)= -0.101934 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.101934 0.994791 0.000000 ) a(3) = ( -0.449033 -0.497396 0.742271 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.102468 0.673608 ) b(2) = ( 0.000000 1.005236 0.673608 ) b(3) = ( 0.000000 0.000000 1.347216 ) PseudoPot. # 1 for Co read from file: /home/autes/Pseudo/Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6e843fd57bb34a371311d5dc8eddf880 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1193 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for K read from file: /home/autes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Co 9.00 58.93320 Co( 1.00) O 6.00 15.99940 O( 1.00) K 9.00 39.09830 K( 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 =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.3711357 ) 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= 312 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0000000 0.0000000 0.0172720), wk = 0.0032051 k( 3) = ( 0.0000000 0.0000000 0.0345440), wk = 0.0032051 k( 4) = ( 0.0000000 0.0000000 0.0518160), wk = 0.0032051 k( 5) = ( 0.0000000 0.0000000 0.0690880), wk = 0.0032051 k( 6) = ( 0.0000000 0.0000000 0.0863600), wk = 0.0032051 k( 7) = ( 0.0000000 0.0000000 0.1036320), wk = 0.0032051 k( 8) = ( 0.0000000 0.0000000 0.1209040), wk = 0.0032051 k( 9) = ( 0.0000000 0.0000000 0.1381760), wk = 0.0032051 k( 10) = ( 0.0000000 0.0000000 0.1554480), wk = 0.0032051 k( 11) = ( 0.0000000 0.0000000 0.1727200), wk = 0.0032051 k( 12) = ( 0.0000000 0.0000000 0.1899920), wk = 0.0032051 k( 13) = ( 0.0000000 0.0000000 0.2072640), wk = 0.0032051 k( 14) = ( 0.0000000 0.0000000 0.2245360), wk = 0.0032051 k( 15) = ( 0.0000000 0.0000000 0.2418080), wk = 0.0032051 k( 16) = ( 0.0000000 0.0000000 0.2590800), wk = 0.0032051 k( 17) = ( 0.0000000 0.0000000 0.2763520), wk = 0.0032051 k( 18) = ( 0.0000000 0.0000000 0.2936240), wk = 0.0032051 k( 19) = ( 0.0000000 0.0000000 0.3108960), wk = 0.0032051 k( 20) = ( 0.0000000 0.0000000 0.3281680), wk = 0.0032051 k( 21) = ( 0.0000000 0.0000000 0.3454400), wk = 0.0032051 k( 22) = ( 0.0000000 0.0000000 0.3627120), wk = 0.0032051 k( 23) = ( 0.0000000 0.0000000 0.3799840), wk = 0.0032051 k( 24) = ( 0.0000000 0.0000000 0.3972560), wk = 0.0032051 k( 25) = ( 0.0000000 0.0000000 0.4145280), wk = 0.0032051 k( 26) = ( 0.0000000 0.0000000 0.4318000), wk = 0.0032051 k( 27) = ( 0.0000000 0.0000000 0.4490720), wk = 0.0032051 k( 28) = ( 0.0000000 0.0000000 0.4663440), wk = 0.0032051 k( 29) = ( 0.0000000 0.0000000 0.4836160), wk = 0.0032051 k( 30) = ( 0.0000000 0.0000000 0.5008880), wk = 0.0032051 k( 31) = ( 0.0000000 0.0000000 0.5181600), wk = 0.0032051 k( 32) = ( 0.0000000 0.0000000 0.5354320), wk = 0.0032051 k( 33) = ( 0.0000000 0.0000000 0.5527040), wk = 0.0032051 k( 34) = ( 0.0000000 0.0000000 0.5699760), wk = 0.0032051 k( 35) = ( 0.0000000 0.0000000 0.5872480), wk = 0.0032051 k( 36) = ( 0.0000000 0.0000000 0.6045200), wk = 0.0032051 k( 37) = ( 0.0000000 0.0000000 0.6217920), wk = 0.0032051 k( 38) = ( 0.0000000 0.0000000 0.6390640), wk = 0.0032051 k( 39) = ( 0.0000000 0.0000000 0.6563360), wk = 0.0032051 k( 40) = ( 0.0000000 0.0000000 0.6736080), wk = 0.0032051 k( 41) = ( 0.0000000 0.0000000 0.6736080), wk = 0.0032051 k( 42) = ( -0.0127813 0.0115386 0.6736080), wk = 0.0032051 k( 43) = ( -0.0255626 0.0230772 0.6736080), wk = 0.0032051 k( 44) = ( -0.0383440 0.0346157 0.6736080), wk = 0.0032051 k( 45) = ( -0.0511253 0.0461543 0.6736080), wk = 0.0032051 k( 46) = ( -0.0639066 0.0576929 0.6736080), wk = 0.0032051 k( 47) = ( -0.0766880 0.0692315 0.6736080), wk = 0.0032051 k( 48) = ( -0.0894693 0.0807701 0.6736080), wk = 0.0032051 k( 49) = ( -0.1022506 0.0923086 0.6736080), wk = 0.0032051 k( 50) = ( -0.1150319 0.1038472 0.6736080), wk = 0.0032051 k( 51) = ( -0.1278133 0.1153858 0.6736080), wk = 0.0032051 k( 52) = ( -0.1405946 0.1269244 0.6736080), wk = 0.0032051 k( 53) = ( -0.1533759 0.1384630 0.6736080), wk = 0.0032051 k( 54) = ( -0.1661572 0.1500015 0.6736080), wk = 0.0032051 k( 55) = ( -0.1789386 0.1615401 0.6736080), wk = 0.0032051 k( 56) = ( -0.1917199 0.1730787 0.6736080), wk = 0.0032051 k( 57) = ( -0.2045012 0.1846173 0.6736080), wk = 0.0032051 k( 58) = ( -0.2172825 0.1961559 0.6736080), wk = 0.0032051 k( 59) = ( -0.2300639 0.2076944 0.6736080), wk = 0.0032051 k( 60) = ( -0.2428452 0.2192330 0.6736080), wk = 0.0032051 k( 61) = ( -0.2556265 0.2307716 0.6736080), wk = 0.0032051 k( 62) = ( -0.2684079 0.2423102 0.6736080), wk = 0.0032051 k( 63) = ( -0.2811892 0.2538487 0.6736080), wk = 0.0032051 k( 64) = ( -0.2939705 0.2653873 0.6736080), wk = 0.0032051 k( 65) = ( -0.3067518 0.2769259 0.6736080), wk = 0.0032051 k( 66) = ( -0.3067518 0.2769259 0.6736080), wk = 0.0032051 k( 67) = ( -0.3155358 0.2848558 0.6617741), wk = 0.0032051 k( 68) = ( -0.3243199 0.2927858 0.6499401), wk = 0.0032051 k( 69) = ( -0.3331038 0.3007157 0.6381062), wk = 0.0032051 k( 70) = ( -0.3418879 0.3086456 0.6262722), wk = 0.0032051 k( 71) = ( -0.3506719 0.3165755 0.6144382), wk = 0.0032051 k( 72) = ( -0.3594559 0.3245055 0.6026043), wk = 0.0032051 k( 73) = ( -0.3682399 0.3324354 0.5907703), wk = 0.0032051 k( 74) = ( -0.3770239 0.3403653 0.5789364), wk = 0.0032051 k( 75) = ( -0.3858079 0.3482952 0.5671024), wk = 0.0032051 k( 76) = ( -0.3945919 0.3562252 0.5552685), wk = 0.0032051 k( 77) = ( -0.4033759 0.3641551 0.5434345), wk = 0.0032051 k( 78) = ( -0.4033759 0.3641551 0.5434345), wk = 0.0032051 k( 79) = ( -0.3944120 0.3560628 0.5313582), wk = 0.0032051 k( 80) = ( -0.3854481 0.3479704 0.5192819), wk = 0.0032051 k( 81) = ( -0.3764842 0.3398781 0.5072055), wk = 0.0032051 k( 82) = ( -0.3675203 0.3317858 0.4951292), wk = 0.0032051 k( 83) = ( -0.3585564 0.3236934 0.4830529), wk = 0.0032051 k( 84) = ( -0.3495925 0.3156011 0.4709766), wk = 0.0032051 k( 85) = ( -0.3406285 0.3075087 0.4589002), wk = 0.0032051 k( 86) = ( -0.3316646 0.2994164 0.4468239), wk = 0.0032051 k( 87) = ( -0.3227007 0.2913241 0.4347476), wk = 0.0032051 k( 88) = ( -0.3137368 0.2832317 0.4226713), wk = 0.0032051 k( 89) = ( -0.3047729 0.2751394 0.4105950), wk = 0.0032051 k( 90) = ( -0.2958090 0.2670471 0.3985186), wk = 0.0032051 k( 91) = ( -0.2868451 0.2589547 0.3864423), wk = 0.0032051 k( 92) = ( -0.2778812 0.2508624 0.3743660), wk = 0.0032051 k( 93) = ( -0.2689173 0.2427701 0.3622897), wk = 0.0032051 k( 94) = ( -0.2599534 0.2346777 0.3502133), wk = 0.0032051 k( 95) = ( -0.2509895 0.2265854 0.3381370), wk = 0.0032051 k( 96) = ( -0.2420256 0.2184931 0.3260607), wk = 0.0032051 k( 97) = ( -0.2330616 0.2104007 0.3139844), wk = 0.0032051 k( 98) = ( -0.2240977 0.2023084 0.3019081), wk = 0.0032051 k( 99) = ( -0.2151338 0.1942160 0.2898317), wk = 0.0032051 k( 100) = ( -0.2061699 0.1861237 0.2777554), wk = 0.0032051 k( 101) = ( -0.1972060 0.1780314 0.2656791), wk = 0.0032051 k( 102) = ( -0.1882421 0.1699390 0.2536028), wk = 0.0032051 k( 103) = ( -0.1792782 0.1618467 0.2415264), wk = 0.0032051 k( 104) = ( -0.1703143 0.1537544 0.2294501), wk = 0.0032051 k( 105) = ( -0.1613504 0.1456620 0.2173738), wk = 0.0032051 k( 106) = ( -0.1523865 0.1375697 0.2052975), wk = 0.0032051 k( 107) = ( -0.1434226 0.1294774 0.1932212), wk = 0.0032051 k( 108) = ( -0.1344586 0.1213850 0.1811448), wk = 0.0032051 k( 109) = ( -0.1254947 0.1132927 0.1690685), wk = 0.0032051 k( 110) = ( -0.1165308 0.1052004 0.1569922), wk = 0.0032051 k( 111) = ( -0.1075669 0.0971080 0.1449159), wk = 0.0032051 k( 112) = ( -0.0986030 0.0890157 0.1328395), wk = 0.0032051 k( 113) = ( -0.0896391 0.0809234 0.1207632), wk = 0.0032051 k( 114) = ( -0.0806752 0.0728310 0.1086869), wk = 0.0032051 k( 115) = ( -0.0717113 0.0647387 0.0966106), wk = 0.0032051 k( 116) = ( -0.0627474 0.0566463 0.0845342), wk = 0.0032051 k( 117) = ( -0.0537835 0.0485540 0.0724579), wk = 0.0032051 k( 118) = ( -0.0448195 0.0404617 0.0603816), wk = 0.0032051 k( 119) = ( -0.0358556 0.0323693 0.0483053), wk = 0.0032051 k( 120) = ( -0.0268917 0.0242770 0.0362290), wk = 0.0032051 k( 121) = ( -0.0179278 0.0161847 0.0241526), wk = 0.0032051 k( 122) = ( -0.0089639 0.0080923 0.0120763), wk = 0.0032051 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 125) = ( 0.0113636 0.0125875 -0.0000000), wk = 0.0032051 k( 126) = ( 0.0227273 0.0251751 -0.0000000), wk = 0.0032051 k( 127) = ( 0.0340909 0.0377626 -0.0000000), wk = 0.0032051 k( 128) = ( 0.0454546 0.0503502 -0.0000000), wk = 0.0032051 k( 129) = ( 0.0568182 0.0629377 -0.0000000), wk = 0.0032051 k( 130) = ( 0.0681818 0.0755252 -0.0000000), wk = 0.0032051 k( 131) = ( 0.0795455 0.0881128 -0.0000000), wk = 0.0032051 k( 132) = ( 0.0909091 0.1007003 -0.0000000), wk = 0.0032051 k( 133) = ( 0.1022727 0.1132879 0.0000000), wk = 0.0032051 k( 134) = ( 0.1136364 0.1258754 -0.0000000), wk = 0.0032051 k( 135) = ( 0.1250000 0.1384630 -0.0000000), wk = 0.0032051 k( 136) = ( 0.1363636 0.1510505 -0.0000000), wk = 0.0032051 k( 137) = ( 0.1477273 0.1636380 -0.0000000), wk = 0.0032051 k( 138) = ( 0.1590909 0.1762256 -0.0000000), wk = 0.0032051 k( 139) = ( 0.1704546 0.1888131 -0.0000000), wk = 0.0032051 k( 140) = ( 0.1818182 0.2014007 -0.0000000), wk = 0.0032051 k( 141) = ( 0.1931818 0.2139882 -0.0000000), wk = 0.0032051 k( 142) = ( 0.2045454 0.2265757 -0.0000000), wk = 0.0032051 k( 143) = ( 0.2159091 0.2391633 -0.0000000), wk = 0.0032051 k( 144) = ( 0.2272727 0.2517508 -0.0000000), wk = 0.0032051 k( 145) = ( 0.2386364 0.2643384 -0.0000000), wk = 0.0032051 k( 146) = ( 0.2500000 0.2769259 -0.0000000), wk = 0.0032051 k( 147) = ( 0.2613636 0.2895135 -0.0000000), wk = 0.0032051 k( 148) = ( 0.2727273 0.3021010 -0.0000000), wk = 0.0032051 k( 149) = ( 0.2840909 0.3146885 -0.0000000), wk = 0.0032051 k( 150) = ( 0.2954545 0.3272761 -0.0000000), wk = 0.0032051 k( 151) = ( 0.3068182 0.3398636 -0.0000000), wk = 0.0032051 k( 152) = ( 0.3181818 0.3524512 -0.0000000), wk = 0.0032051 k( 153) = ( 0.3295455 0.3650387 -0.0000000), wk = 0.0032051 k( 154) = ( 0.3409091 0.3776262 -0.0000000), wk = 0.0032051 k( 155) = ( 0.3522727 0.3902138 -0.0000000), wk = 0.0032051 k( 156) = ( 0.3636364 0.4028013 -0.0000000), wk = 0.0032051 k( 157) = ( 0.3750000 0.4153889 -0.0000000), wk = 0.0032051 k( 158) = ( 0.3863636 0.4279764 -0.0000000), wk = 0.0032051 k( 159) = ( 0.3977273 0.4405639 -0.0000000), wk = 0.0032051 k( 160) = ( 0.4090909 0.4531515 -0.0000000), wk = 0.0032051 k( 161) = ( 0.4204545 0.4657390 -0.0000000), wk = 0.0032051 k( 162) = ( 0.4318182 0.4783266 -0.0000000), wk = 0.0032051 k( 163) = ( 0.4431818 0.4909141 -0.0000000), wk = 0.0032051 k( 164) = ( 0.4545455 0.5035016 -0.0000000), wk = 0.0032051 k( 165) = ( 0.4659091 0.5160892 -0.0000000), wk = 0.0032051 k( 166) = ( 0.4772727 0.5286767 -0.0000000), wk = 0.0032051 k( 167) = ( 0.4886364 0.5412643 -0.0000000), wk = 0.0032051 k( 168) = ( 0.5000000 0.5538518 -0.0000000), wk = 0.0032051 k( 169) = ( 0.5000000 0.5538518 -0.0000000), wk = 0.0032051 k( 170) = ( 0.4912160 0.5617817 0.0118340), wk = 0.0032051 k( 171) = ( 0.4824320 0.5697117 0.0236679), wk = 0.0032051 k( 172) = ( 0.4736480 0.5776416 0.0355019), wk = 0.0032051 k( 173) = ( 0.4648640 0.5855715 0.0473358), wk = 0.0032051 k( 174) = ( 0.4560800 0.5935014 0.0591698), wk = 0.0032051 k( 175) = ( 0.4472959 0.6014314 0.0710037), wk = 0.0032051 k( 176) = ( 0.4385119 0.6093613 0.0828377), wk = 0.0032051 k( 177) = ( 0.4297279 0.6172912 0.0946716), wk = 0.0032051 k( 178) = ( 0.4209439 0.6252211 0.1065056), wk = 0.0032051 k( 179) = ( 0.4121599 0.6331511 0.1183396), wk = 0.0032051 k( 180) = ( 0.4033759 0.6410810 0.1301735), wk = 0.0032051 k( 181) = ( 0.4033759 0.6410810 0.1301735), wk = 0.0032051 k( 182) = ( 0.3889696 0.6361359 0.1375532), wk = 0.0032051 k( 183) = ( 0.3745634 0.6311908 0.1449328), wk = 0.0032051 k( 184) = ( 0.3601571 0.6262457 0.1523125), wk = 0.0032051 k( 185) = ( 0.3457508 0.6213006 0.1596922), wk = 0.0032051 k( 186) = ( 0.3313445 0.6163555 0.1670718), wk = 0.0032051 k( 187) = ( 0.3169382 0.6114104 0.1744515), wk = 0.0032051 k( 188) = ( 0.3025319 0.6064653 0.1818311), wk = 0.0032051 k( 189) = ( 0.2881257 0.6015202 0.1892108), wk = 0.0032051 k( 190) = ( 0.2737194 0.5965750 0.1965905), wk = 0.0032051 k( 191) = ( 0.2593131 0.5916299 0.2039701), wk = 0.0032051 k( 192) = ( 0.2449068 0.5866848 0.2113498), wk = 0.0032051 k( 193) = ( 0.2305005 0.5817397 0.2187294), wk = 0.0032051 k( 194) = ( 0.2160942 0.5767946 0.2261091), wk = 0.0032051 k( 195) = ( 0.2016880 0.5718495 0.2334888), wk = 0.0032051 k( 196) = ( 0.1872817 0.5669044 0.2408684), wk = 0.0032051 k( 197) = ( 0.1728754 0.5619593 0.2482481), wk = 0.0032051 k( 198) = ( 0.1584691 0.5570142 0.2556277), wk = 0.0032051 k( 199) = ( 0.1440628 0.5520691 0.2630074), wk = 0.0032051 k( 200) = ( 0.1296565 0.5471240 0.2703871), wk = 0.0032051 k( 201) = ( 0.1152503 0.5421789 0.2777667), wk = 0.0032051 k( 202) = ( 0.1008440 0.5372338 0.2851464), wk = 0.0032051 k( 203) = ( 0.0864377 0.5322887 0.2925260), wk = 0.0032051 k( 204) = ( 0.0720314 0.5273436 0.2999057), wk = 0.0032051 k( 205) = ( 0.0576251 0.5223985 0.3072854), wk = 0.0032051 k( 206) = ( 0.0432189 0.5174534 0.3146650), wk = 0.0032051 k( 207) = ( 0.0288126 0.5125083 0.3220447), wk = 0.0032051 k( 208) = ( 0.0144063 0.5075631 0.3294244), wk = 0.0032051 k( 209) = ( 0.0000000 0.5026180 0.3368040), wk = 0.0032051 k( 210) = ( 0.0000000 0.5026180 0.3368040), wk = 0.0032051 k( 211) = ( 0.0089286 0.4945576 0.3488327), wk = 0.0032051 k( 212) = ( 0.0178571 0.4864972 0.3608614), wk = 0.0032051 k( 213) = ( 0.0267857 0.4784367 0.3728901), wk = 0.0032051 k( 214) = ( 0.0357143 0.4703763 0.3849189), wk = 0.0032051 k( 215) = ( 0.0446429 0.4623159 0.3969476), wk = 0.0032051 k( 216) = ( 0.0535714 0.4542554 0.4089763), wk = 0.0032051 k( 217) = ( 0.0625000 0.4461950 0.4210050), wk = 0.0032051 k( 218) = ( 0.0714286 0.4381346 0.4330337), wk = 0.0032051 k( 219) = ( 0.0803571 0.4300741 0.4450624), wk = 0.0032051 k( 220) = ( 0.0892857 0.4220137 0.4570912), wk = 0.0032051 k( 221) = ( 0.0982143 0.4139533 0.4691199), wk = 0.0032051 k( 222) = ( 0.1071429 0.4058928 0.4811486), wk = 0.0032051 k( 223) = ( 0.1160714 0.3978324 0.4931773), wk = 0.0032051 k( 224) = ( 0.1250000 0.3897720 0.5052060), wk = 0.0032051 k( 225) = ( 0.1339286 0.3817115 0.5172347), wk = 0.0032051 k( 226) = ( 0.1428571 0.3736511 0.5292634), wk = 0.0032051 k( 227) = ( 0.1517857 0.3655907 0.5412922), wk = 0.0032051 k( 228) = ( 0.1607143 0.3575302 0.5533209), wk = 0.0032051 k( 229) = ( 0.1696429 0.3494698 0.5653496), wk = 0.0032051 k( 230) = ( 0.1785714 0.3414094 0.5773783), wk = 0.0032051 k( 231) = ( 0.1875000 0.3333489 0.5894070), wk = 0.0032051 k( 232) = ( 0.1964286 0.3252885 0.6014357), wk = 0.0032051 k( 233) = ( 0.2053571 0.3172281 0.6134644), wk = 0.0032051 k( 234) = ( 0.2142857 0.3091676 0.6254932), wk = 0.0032051 k( 235) = ( 0.2232143 0.3011072 0.6375219), wk = 0.0032051 k( 236) = ( 0.2321429 0.2930468 0.6495506), wk = 0.0032051 k( 237) = ( 0.2410714 0.2849863 0.6615793), wk = 0.0032051 k( 238) = ( 0.2500000 0.2769259 0.6736080), wk = 0.0032051 k( 239) = ( 0.2500000 0.2769259 0.6736080), wk = 0.0032051 k( 240) = ( 0.2575758 0.2853176 0.6610850), wk = 0.0032051 k( 241) = ( 0.2651515 0.2937093 0.6485619), wk = 0.0032051 k( 242) = ( 0.2727273 0.3021010 0.6360388), wk = 0.0032051 k( 243) = ( 0.2803030 0.3104927 0.6235158), wk = 0.0032051 k( 244) = ( 0.2878788 0.3188844 0.6109927), wk = 0.0032051 k( 245) = ( 0.2954545 0.3272761 0.5984697), wk = 0.0032051 k( 246) = ( 0.3030303 0.3356678 0.5859466), wk = 0.0032051 k( 247) = ( 0.3106061 0.3440595 0.5734235), wk = 0.0032051 k( 248) = ( 0.3181818 0.3524512 0.5609005), wk = 0.0032051 k( 249) = ( 0.3257576 0.3608429 0.5483774), wk = 0.0032051 k( 250) = ( 0.3333333 0.3692345 0.5358544), wk = 0.0032051 k( 251) = ( 0.3409091 0.3776262 0.5233313), wk = 0.0032051 k( 252) = ( 0.3484849 0.3860179 0.5108082), wk = 0.0032051 k( 253) = ( 0.3560606 0.3944096 0.4982852), wk = 0.0032051 k( 254) = ( 0.3636364 0.4028013 0.4857621), wk = 0.0032051 k( 255) = ( 0.3712121 0.4111930 0.4732391), wk = 0.0032051 k( 256) = ( 0.3787879 0.4195847 0.4607160), wk = 0.0032051 k( 257) = ( 0.3863636 0.4279764 0.4481929), wk = 0.0032051 k( 258) = ( 0.3939394 0.4363681 0.4356699), wk = 0.0032051 k( 259) = ( 0.4015151 0.4447598 0.4231468), wk = 0.0032051 k( 260) = ( 0.4090909 0.4531515 0.4106238), wk = 0.0032051 k( 261) = ( 0.4166667 0.4615432 0.3981007), wk = 0.0032051 k( 262) = ( 0.4242424 0.4699349 0.3855776), wk = 0.0032051 k( 263) = ( 0.4318182 0.4783266 0.3730546), wk = 0.0032051 k( 264) = ( 0.4393939 0.4867183 0.3605315), wk = 0.0032051 k( 265) = ( 0.4469697 0.4951100 0.3480085), wk = 0.0032051 k( 266) = ( 0.4545455 0.5035016 0.3354854), wk = 0.0032051 k( 267) = ( 0.4621212 0.5118933 0.3229623), wk = 0.0032051 k( 268) = ( 0.4696970 0.5202850 0.3104393), wk = 0.0032051 k( 269) = ( 0.4772727 0.5286767 0.2979162), wk = 0.0032051 k( 270) = ( 0.4848485 0.5370684 0.2853931), wk = 0.0032051 k( 271) = ( 0.4924242 0.5454601 0.2728701), wk = 0.0032051 k( 272) = ( 0.5000000 0.5538518 0.2603470), wk = 0.0032051 k( 273) = ( 0.5000000 0.5538518 0.2603470), wk = 0.0032051 k( 274) = ( 0.5000000 0.5538518 0.2440753), wk = 0.0032051 k( 275) = ( 0.5000000 0.5538518 0.2278037), wk = 0.0032051 k( 276) = ( 0.5000000 0.5538518 0.2115320), wk = 0.0032051 k( 277) = ( 0.5000000 0.5538518 0.1952603), wk = 0.0032051 k( 278) = ( 0.5000000 0.5538518 0.1789886), wk = 0.0032051 k( 279) = ( 0.5000000 0.5538518 0.1627169), wk = 0.0032051 k( 280) = ( 0.5000000 0.5538518 0.1464452), wk = 0.0032051 k( 281) = ( 0.5000000 0.5538518 0.1301735), wk = 0.0032051 k( 282) = ( 0.5000000 0.5538518 0.1139018), wk = 0.0032051 k( 283) = ( 0.5000000 0.5538518 0.0976301), wk = 0.0032051 k( 284) = ( 0.5000000 0.5538518 0.0813584), wk = 0.0032051 k( 285) = ( 0.5000000 0.5538518 0.0650868), wk = 0.0032051 k( 286) = ( 0.5000000 0.5538518 0.0488151), wk = 0.0032051 k( 287) = ( 0.5000000 0.5538518 0.0325434), wk = 0.0032051 k( 288) = ( 0.5000000 0.5538518 0.0162717), wk = 0.0032051 k( 289) = ( 0.5000000 0.5538518 -0.0000000), wk = 0.0032051 k( 290) = ( 0.0000000 0.0000000 0.6736080), wk = 0.0032051 k( 291) = ( 0.0113636 0.0125875 0.6736080), wk = 0.0032051 k( 292) = ( 0.0227273 0.0251751 0.6736080), wk = 0.0032051 k( 293) = ( 0.0340909 0.0377626 0.6736080), wk = 0.0032051 k( 294) = ( 0.0454546 0.0503502 0.6736080), wk = 0.0032051 k( 295) = ( 0.0568182 0.0629377 0.6736080), wk = 0.0032051 k( 296) = ( 0.0681818 0.0755252 0.6736080), wk = 0.0032051 k( 297) = ( 0.0795455 0.0881128 0.6736080), wk = 0.0032051 k( 298) = ( 0.0909091 0.1007003 0.6736080), wk = 0.0032051 k( 299) = ( 0.1022727 0.1132879 0.6736080), wk = 0.0032051 k( 300) = ( 0.1136364 0.1258754 0.6736080), wk = 0.0032051 k( 301) = ( 0.1250000 0.1384630 0.6736080), wk = 0.0032051 k( 302) = ( 0.1363636 0.1510505 0.6736080), wk = 0.0032051 k( 303) = ( 0.1477273 0.1636380 0.6736080), wk = 0.0032051 k( 304) = ( 0.1590909 0.1762256 0.6736080), wk = 0.0032051 k( 305) = ( 0.1704546 0.1888131 0.6736080), wk = 0.0032051 k( 306) = ( 0.1818182 0.2014007 0.6736080), wk = 0.0032051 k( 307) = ( 0.1931818 0.2139882 0.6736080), wk = 0.0032051 k( 308) = ( 0.2045454 0.2265757 0.6736080), wk = 0.0032051 k( 309) = ( 0.2159091 0.2391633 0.6736080), wk = 0.0032051 k( 310) = ( 0.2272727 0.2517508 0.6736080), wk = 0.0032051 k( 311) = ( 0.2386364 0.2643384 0.6736080), wk = 0.0032051 k( 312) = ( 0.2500000 0.2769259 0.6736080), wk = 0.0032051 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0032051 k( 3) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0032051 k( 4) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0032051 k( 5) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0032051 k( 6) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0032051 k( 7) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0032051 k( 8) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0032051 k( 9) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0032051 k( 10) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0032051 k( 11) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0032051 k( 12) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0032051 k( 13) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0032051 k( 14) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0032051 k( 15) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0032051 k( 16) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0032051 k( 17) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0032051 k( 18) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0032051 k( 19) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0032051 k( 20) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0032051 k( 21) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0032051 k( 22) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0032051 k( 23) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0032051 k( 24) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0032051 k( 25) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0032051 k( 26) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0032051 k( 27) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0032051 k( 28) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0032051 k( 29) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0032051 k( 30) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0032051 k( 31) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0032051 k( 32) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0032051 k( 33) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0032051 k( 34) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0032051 k( 35) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0032051 k( 36) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0032051 k( 37) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0032051 k( 38) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0032051 k( 39) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0032051 k( 40) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 42) = ( -0.0127813 0.0127813 0.5000000), wk = 0.0032051 k( 43) = ( -0.0255626 0.0255626 0.5000000), wk = 0.0032051 k( 44) = ( -0.0383440 0.0383440 0.5000000), wk = 0.0032051 k( 45) = ( -0.0511253 0.0511253 0.5000000), wk = 0.0032051 k( 46) = ( -0.0639066 0.0639066 0.5000000), wk = 0.0032051 k( 47) = ( -0.0766880 0.0766880 0.5000000), wk = 0.0032051 k( 48) = ( -0.0894693 0.0894693 0.5000000), wk = 0.0032051 k( 49) = ( -0.1022506 0.1022506 0.5000000), wk = 0.0032051 k( 50) = ( -0.1150319 0.1150319 0.5000000), wk = 0.0032051 k( 51) = ( -0.1278133 0.1278133 0.5000000), wk = 0.0032051 k( 52) = ( -0.1405946 0.1405946 0.5000000), wk = 0.0032051 k( 53) = ( -0.1533759 0.1533759 0.5000000), wk = 0.0032051 k( 54) = ( -0.1661572 0.1661572 0.5000000), wk = 0.0032051 k( 55) = ( -0.1789386 0.1789386 0.5000000), wk = 0.0032051 k( 56) = ( -0.1917199 0.1917199 0.5000000), wk = 0.0032051 k( 57) = ( -0.2045012 0.2045012 0.5000000), wk = 0.0032051 k( 58) = ( -0.2172825 0.2172825 0.5000000), wk = 0.0032051 k( 59) = ( -0.2300639 0.2300639 0.5000000), wk = 0.0032051 k( 60) = ( -0.2428452 0.2428452 0.5000000), wk = 0.0032051 k( 61) = ( -0.2556265 0.2556265 0.5000000), wk = 0.0032051 k( 62) = ( -0.2684079 0.2684079 0.5000000), wk = 0.0032051 k( 63) = ( -0.2811892 0.2811892 0.5000000), wk = 0.0032051 k( 64) = ( -0.2939705 0.2939705 0.5000000), wk = 0.0032051 k( 65) = ( -0.3067518 0.3067518 0.5000000), wk = 0.0032051 k( 66) = ( -0.3067518 0.3067518 0.5000000), wk = 0.0032051 k( 67) = ( -0.3155358 0.3155358 0.4912160), wk = 0.0032051 k( 68) = ( -0.3243199 0.3243198 0.4824320), wk = 0.0032051 k( 69) = ( -0.3331038 0.3331038 0.4736480), wk = 0.0032051 k( 70) = ( -0.3418879 0.3418879 0.4648640), wk = 0.0032051 k( 71) = ( -0.3506719 0.3506719 0.4560800), wk = 0.0032051 k( 72) = ( -0.3594559 0.3594559 0.4472959), wk = 0.0032051 k( 73) = ( -0.3682399 0.3682399 0.4385119), wk = 0.0032051 k( 74) = ( -0.3770239 0.3770239 0.4297279), wk = 0.0032051 k( 75) = ( -0.3858079 0.3858079 0.4209439), wk = 0.0032051 k( 76) = ( -0.3945919 0.3945919 0.4121599), wk = 0.0032051 k( 77) = ( -0.4033759 0.4033759 0.4033759), wk = 0.0032051 k( 78) = ( -0.4033759 0.4033759 0.4033759), wk = 0.0032051 k( 79) = ( -0.3944120 0.3944120 0.3944120), wk = 0.0032051 k( 80) = ( -0.3854481 0.3854481 0.3854481), wk = 0.0032051 k( 81) = ( -0.3764842 0.3764842 0.3764842), wk = 0.0032051 k( 82) = ( -0.3675203 0.3675203 0.3675203), wk = 0.0032051 k( 83) = ( -0.3585564 0.3585564 0.3585564), wk = 0.0032051 k( 84) = ( -0.3495925 0.3495925 0.3495925), wk = 0.0032051 k( 85) = ( -0.3406285 0.3406285 0.3406285), wk = 0.0032051 k( 86) = ( -0.3316646 0.3316646 0.3316646), wk = 0.0032051 k( 87) = ( -0.3227007 0.3227007 0.3227007), wk = 0.0032051 k( 88) = ( -0.3137368 0.3137368 0.3137368), wk = 0.0032051 k( 89) = ( -0.3047729 0.3047729 0.3047729), wk = 0.0032051 k( 90) = ( -0.2958090 0.2958090 0.2958090), wk = 0.0032051 k( 91) = ( -0.2868451 0.2868451 0.2868451), wk = 0.0032051 k( 92) = ( -0.2778812 0.2778812 0.2778812), wk = 0.0032051 k( 93) = ( -0.2689173 0.2689173 0.2689173), wk = 0.0032051 k( 94) = ( -0.2599534 0.2599534 0.2599534), wk = 0.0032051 k( 95) = ( -0.2509895 0.2509895 0.2509895), wk = 0.0032051 k( 96) = ( -0.2420256 0.2420255 0.2420255), wk = 0.0032051 k( 97) = ( -0.2330616 0.2330616 0.2330616), wk = 0.0032051 k( 98) = ( -0.2240977 0.2240977 0.2240977), wk = 0.0032051 k( 99) = ( -0.2151338 0.2151338 0.2151338), wk = 0.0032051 k( 100) = ( -0.2061699 0.2061699 0.2061699), wk = 0.0032051 k( 101) = ( -0.1972060 0.1972060 0.1972060), wk = 0.0032051 k( 102) = ( -0.1882421 0.1882421 0.1882421), wk = 0.0032051 k( 103) = ( -0.1792782 0.1792782 0.1792782), wk = 0.0032051 k( 104) = ( -0.1703143 0.1703143 0.1703143), wk = 0.0032051 k( 105) = ( -0.1613504 0.1613504 0.1613504), wk = 0.0032051 k( 106) = ( -0.1523865 0.1523865 0.1523865), wk = 0.0032051 k( 107) = ( -0.1434226 0.1434225 0.1434226), wk = 0.0032051 k( 108) = ( -0.1344586 0.1344586 0.1344586), wk = 0.0032051 k( 109) = ( -0.1254947 0.1254947 0.1254947), wk = 0.0032051 k( 110) = ( -0.1165308 0.1165308 0.1165308), wk = 0.0032051 k( 111) = ( -0.1075669 0.1075669 0.1075669), wk = 0.0032051 k( 112) = ( -0.0986030 0.0986030 0.0986030), wk = 0.0032051 k( 113) = ( -0.0896391 0.0896391 0.0896391), wk = 0.0032051 k( 114) = ( -0.0806752 0.0806752 0.0806752), wk = 0.0032051 k( 115) = ( -0.0717113 0.0717113 0.0717113), wk = 0.0032051 k( 116) = ( -0.0627474 0.0627474 0.0627474), wk = 0.0032051 k( 117) = ( -0.0537835 0.0537835 0.0537835), wk = 0.0032051 k( 118) = ( -0.0448195 0.0448195 0.0448195), wk = 0.0032051 k( 119) = ( -0.0358556 0.0358556 0.0358556), wk = 0.0032051 k( 120) = ( -0.0268917 0.0268917 0.0268917), wk = 0.0032051 k( 121) = ( -0.0179278 0.0179278 0.0179278), wk = 0.0032051 k( 122) = ( -0.0089639 0.0089639 0.0089639), wk = 0.0032051 k( 123) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 125) = ( 0.0113636 0.0113636 -0.0113636), wk = 0.0032051 k( 126) = ( 0.0227273 0.0227273 -0.0227273), wk = 0.0032051 k( 127) = ( 0.0340909 0.0340909 -0.0340909), wk = 0.0032051 k( 128) = ( 0.0454546 0.0454545 -0.0454545), wk = 0.0032051 k( 129) = ( 0.0568182 0.0568182 -0.0568182), wk = 0.0032051 k( 130) = ( 0.0681818 0.0681818 -0.0681818), wk = 0.0032051 k( 131) = ( 0.0795455 0.0795454 -0.0795454), wk = 0.0032051 k( 132) = ( 0.0909091 0.0909091 -0.0909091), wk = 0.0032051 k( 133) = ( 0.1022727 0.1022727 -0.1022727), wk = 0.0032051 k( 134) = ( 0.1136364 0.1136364 -0.1136364), wk = 0.0032051 k( 135) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0032051 k( 136) = ( 0.1363636 0.1363636 -0.1363636), wk = 0.0032051 k( 137) = ( 0.1477273 0.1477273 -0.1477273), wk = 0.0032051 k( 138) = ( 0.1590909 0.1590909 -0.1590909), wk = 0.0032051 k( 139) = ( 0.1704546 0.1704545 -0.1704545), wk = 0.0032051 k( 140) = ( 0.1818182 0.1818182 -0.1818182), wk = 0.0032051 k( 141) = ( 0.1931818 0.1931818 -0.1931818), wk = 0.0032051 k( 142) = ( 0.2045454 0.2045454 -0.2045454), wk = 0.0032051 k( 143) = ( 0.2159091 0.2159091 -0.2159091), wk = 0.0032051 k( 144) = ( 0.2272727 0.2272727 -0.2272727), wk = 0.0032051 k( 145) = ( 0.2386364 0.2386364 -0.2386364), wk = 0.0032051 k( 146) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0032051 k( 147) = ( 0.2613636 0.2613636 -0.2613636), wk = 0.0032051 k( 148) = ( 0.2727273 0.2727273 -0.2727273), wk = 0.0032051 k( 149) = ( 0.2840909 0.2840909 -0.2840909), wk = 0.0032051 k( 150) = ( 0.2954545 0.2954545 -0.2954545), wk = 0.0032051 k( 151) = ( 0.3068182 0.3068182 -0.3068182), wk = 0.0032051 k( 152) = ( 0.3181818 0.3181818 -0.3181818), wk = 0.0032051 k( 153) = ( 0.3295455 0.3295454 -0.3295454), wk = 0.0032051 k( 154) = ( 0.3409091 0.3409091 -0.3409091), wk = 0.0032051 k( 155) = ( 0.3522727 0.3522727 -0.3522727), wk = 0.0032051 k( 156) = ( 0.3636364 0.3636364 -0.3636364), wk = 0.0032051 k( 157) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0032051 k( 158) = ( 0.3863636 0.3863636 -0.3863636), wk = 0.0032051 k( 159) = ( 0.3977273 0.3977273 -0.3977273), wk = 0.0032051 k( 160) = ( 0.4090909 0.4090909 -0.4090909), wk = 0.0032051 k( 161) = ( 0.4204545 0.4204545 -0.4204545), wk = 0.0032051 k( 162) = ( 0.4318182 0.4318182 -0.4318182), wk = 0.0032051 k( 163) = ( 0.4431818 0.4431818 -0.4431818), wk = 0.0032051 k( 164) = ( 0.4545455 0.4545454 -0.4545454), wk = 0.0032051 k( 165) = ( 0.4659091 0.4659091 -0.4659091), wk = 0.0032051 k( 166) = ( 0.4772727 0.4772727 -0.4772727), wk = 0.0032051 k( 167) = ( 0.4886364 0.4886364 -0.4886364), wk = 0.0032051 k( 168) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032051 k( 169) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032051 k( 170) = ( 0.4912160 0.5087840 -0.4912160), wk = 0.0032051 k( 171) = ( 0.4824320 0.5175680 -0.4824320), wk = 0.0032051 k( 172) = ( 0.4736480 0.5263520 -0.4736480), wk = 0.0032051 k( 173) = ( 0.4648640 0.5351360 -0.4648640), wk = 0.0032051 k( 174) = ( 0.4560800 0.5439200 -0.4560800), wk = 0.0032051 k( 175) = ( 0.4472959 0.5527040 -0.4472959), wk = 0.0032051 k( 176) = ( 0.4385119 0.5614881 -0.4385119), wk = 0.0032051 k( 177) = ( 0.4297279 0.5702721 -0.4297279), wk = 0.0032051 k( 178) = ( 0.4209439 0.5790561 -0.4209439), wk = 0.0032051 k( 179) = ( 0.4121599 0.5878401 -0.4121599), wk = 0.0032051 k( 180) = ( 0.4033759 0.5966241 -0.4033759), wk = 0.0032051 k( 181) = ( 0.4033759 0.5966241 -0.4033759), wk = 0.0032051 k( 182) = ( 0.3889696 0.5931732 -0.3889696), wk = 0.0032051 k( 183) = ( 0.3745634 0.5897224 -0.3745633), wk = 0.0032051 k( 184) = ( 0.3601571 0.5862715 -0.3601571), wk = 0.0032051 k( 185) = ( 0.3457508 0.5828206 -0.3457508), wk = 0.0032051 k( 186) = ( 0.3313445 0.5793698 -0.3313445), wk = 0.0032051 k( 187) = ( 0.3169382 0.5759189 -0.3169382), wk = 0.0032051 k( 188) = ( 0.3025319 0.5724681 -0.3025319), wk = 0.0032051 k( 189) = ( 0.2881257 0.5690172 -0.2881256), wk = 0.0032051 k( 190) = ( 0.2737194 0.5655663 -0.2737194), wk = 0.0032051 k( 191) = ( 0.2593131 0.5621155 -0.2593131), wk = 0.0032051 k( 192) = ( 0.2449068 0.5586646 -0.2449068), wk = 0.0032051 k( 193) = ( 0.2305005 0.5552138 -0.2305005), wk = 0.0032051 k( 194) = ( 0.2160942 0.5517629 -0.2160942), wk = 0.0032051 k( 195) = ( 0.2016880 0.5483120 -0.2016880), wk = 0.0032051 k( 196) = ( 0.1872817 0.5448612 -0.1872817), wk = 0.0032051 k( 197) = ( 0.1728754 0.5414103 -0.1728754), wk = 0.0032051 k( 198) = ( 0.1584691 0.5379595 -0.1584691), wk = 0.0032051 k( 199) = ( 0.1440628 0.5345086 -0.1440628), wk = 0.0032051 k( 200) = ( 0.1296565 0.5310577 -0.1296565), wk = 0.0032051 k( 201) = ( 0.1152503 0.5276069 -0.1152503), wk = 0.0032051 k( 202) = ( 0.1008440 0.5241560 -0.1008440), wk = 0.0032051 k( 203) = ( 0.0864377 0.5207052 -0.0864377), wk = 0.0032051 k( 204) = ( 0.0720314 0.5172543 -0.0720314), wk = 0.0032051 k( 205) = ( 0.0576251 0.5138034 -0.0576251), wk = 0.0032051 k( 206) = ( 0.0432189 0.5103526 -0.0432188), wk = 0.0032051 k( 207) = ( 0.0288126 0.5069017 -0.0288126), wk = 0.0032051 k( 208) = ( 0.0144063 0.5034509 -0.0144063), wk = 0.0032051 k( 209) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032051 k( 210) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032051 k( 211) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0032051 k( 212) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0032051 k( 213) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0032051 k( 214) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0032051 k( 215) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0032051 k( 216) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0032051 k( 217) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0032051 k( 218) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0032051 k( 219) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0032051 k( 220) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0032051 k( 221) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0032051 k( 222) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0032051 k( 223) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0032051 k( 224) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0032051 k( 225) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0032051 k( 226) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0032051 k( 227) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0032051 k( 228) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0032051 k( 229) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0032051 k( 230) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0032051 k( 231) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0032051 k( 232) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0032051 k( 233) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0032051 k( 234) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0032051 k( 235) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0032051 k( 236) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0032051 k( 237) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0032051 k( 238) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032051 k( 239) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032051 k( 240) = ( 0.2575758 0.2575758 0.2331287), wk = 0.0032051 k( 241) = ( 0.2651515 0.2651515 0.2162575), wk = 0.0032051 k( 242) = ( 0.2727273 0.2727273 0.1993862), wk = 0.0032051 k( 243) = ( 0.2803030 0.2803030 0.1825149), wk = 0.0032051 k( 244) = ( 0.2878788 0.2878788 0.1656437), wk = 0.0032051 k( 245) = ( 0.2954545 0.2954545 0.1487724), wk = 0.0032051 k( 246) = ( 0.3030303 0.3030303 0.1319011), wk = 0.0032051 k( 247) = ( 0.3106061 0.3106061 0.1150299), wk = 0.0032051 k( 248) = ( 0.3181818 0.3181818 0.0981586), wk = 0.0032051 k( 249) = ( 0.3257576 0.3257576 0.0812873), wk = 0.0032051 k( 250) = ( 0.3333333 0.3333333 0.0644161), wk = 0.0032051 k( 251) = ( 0.3409091 0.3409091 0.0475448), wk = 0.0032051 k( 252) = ( 0.3484849 0.3484849 0.0306735), wk = 0.0032051 k( 253) = ( 0.3560606 0.3560606 0.0138023), wk = 0.0032051 k( 254) = ( 0.3636364 0.3636364 -0.0030690), wk = 0.0032051 k( 255) = ( 0.3712121 0.3712121 -0.0199403), wk = 0.0032051 k( 256) = ( 0.3787879 0.3787879 -0.0368115), wk = 0.0032051 k( 257) = ( 0.3863636 0.3863636 -0.0536828), wk = 0.0032051 k( 258) = ( 0.3939394 0.3939394 -0.0705541), wk = 0.0032051 k( 259) = ( 0.4015151 0.4015151 -0.0874253), wk = 0.0032051 k( 260) = ( 0.4090909 0.4090909 -0.1042966), wk = 0.0032051 k( 261) = ( 0.4166667 0.4166667 -0.1211679), wk = 0.0032051 k( 262) = ( 0.4242424 0.4242424 -0.1380392), wk = 0.0032051 k( 263) = ( 0.4318182 0.4318182 -0.1549104), wk = 0.0032051 k( 264) = ( 0.4393939 0.4393939 -0.1717817), wk = 0.0032051 k( 265) = ( 0.4469697 0.4469697 -0.1886530), wk = 0.0032051 k( 266) = ( 0.4545455 0.4545454 -0.2055242), wk = 0.0032051 k( 267) = ( 0.4621212 0.4621212 -0.2223955), wk = 0.0032051 k( 268) = ( 0.4696970 0.4696970 -0.2392668), wk = 0.0032051 k( 269) = ( 0.4772727 0.4772727 -0.2561380), wk = 0.0032051 k( 270) = ( 0.4848485 0.4848485 -0.2730093), wk = 0.0032051 k( 271) = ( 0.4924242 0.4924242 -0.2898806), wk = 0.0032051 k( 272) = ( 0.5000000 0.5000000 -0.3067518), wk = 0.0032051 k( 273) = ( 0.5000000 0.5000000 -0.3067518), wk = 0.0032051 k( 274) = ( 0.5000000 0.5000000 -0.3188298), wk = 0.0032051 k( 275) = ( 0.5000000 0.5000000 -0.3309079), wk = 0.0032051 k( 276) = ( 0.5000000 0.5000000 -0.3429859), wk = 0.0032051 k( 277) = ( 0.5000000 0.5000000 -0.3550639), wk = 0.0032051 k( 278) = ( 0.5000000 0.5000000 -0.3671419), wk = 0.0032051 k( 279) = ( 0.5000000 0.5000000 -0.3792199), wk = 0.0032051 k( 280) = ( 0.5000000 0.5000000 -0.3912979), wk = 0.0032051 k( 281) = ( 0.5000000 0.5000000 -0.4033759), wk = 0.0032051 k( 282) = ( 0.5000000 0.5000000 -0.4154539), wk = 0.0032051 k( 283) = ( 0.5000000 0.5000000 -0.4275319), wk = 0.0032051 k( 284) = ( 0.5000000 0.5000000 -0.4396099), wk = 0.0032051 k( 285) = ( 0.5000000 0.5000000 -0.4516880), wk = 0.0032051 k( 286) = ( 0.5000000 0.5000000 -0.4637660), wk = 0.0032051 k( 287) = ( 0.5000000 0.5000000 -0.4758440), wk = 0.0032051 k( 288) = ( 0.5000000 0.5000000 -0.4879220), wk = 0.0032051 k( 289) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032051 k( 290) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 291) = ( 0.0113636 0.0113636 0.4886364), wk = 0.0032051 k( 292) = ( 0.0227273 0.0227273 0.4772727), wk = 0.0032051 k( 293) = ( 0.0340909 0.0340909 0.4659091), wk = 0.0032051 k( 294) = ( 0.0454546 0.0454545 0.4545454), wk = 0.0032051 k( 295) = ( 0.0568182 0.0568182 0.4431818), wk = 0.0032051 k( 296) = ( 0.0681818 0.0681818 0.4318182), wk = 0.0032051 k( 297) = ( 0.0795455 0.0795454 0.4204545), wk = 0.0032051 k( 298) = ( 0.0909091 0.0909091 0.4090909), wk = 0.0032051 k( 299) = ( 0.1022727 0.1022727 0.3977273), wk = 0.0032051 k( 300) = ( 0.1136364 0.1136364 0.3863636), wk = 0.0032051 k( 301) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0032051 k( 302) = ( 0.1363636 0.1363636 0.3636364), wk = 0.0032051 k( 303) = ( 0.1477273 0.1477273 0.3522727), wk = 0.0032051 k( 304) = ( 0.1590909 0.1590909 0.3409091), wk = 0.0032051 k( 305) = ( 0.1704546 0.1704545 0.3295455), wk = 0.0032051 k( 306) = ( 0.1818182 0.1818182 0.3181818), wk = 0.0032051 k( 307) = ( 0.1931818 0.1931818 0.3068182), wk = 0.0032051 k( 308) = ( 0.2045454 0.2045454 0.2954545), wk = 0.0032051 k( 309) = ( 0.2159091 0.2159091 0.2840909), wk = 0.0032051 k( 310) = ( 0.2272727 0.2272727 0.2727273), wk = 0.0032051 k( 311) = ( 0.2386364 0.2386364 0.2613636), wk = 0.0032051 k( 312) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032051 Dense grid: 79047 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 34923 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.22 Mb ( 196, 72) NL pseudopotentials 0.29 Mb ( 98, 192) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1646) G-vector shells 0.01 Mb ( 761) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.86 Mb ( 196, 288) Each subspace H/S matrix 1.27 Mb ( 288, 288) Each matrix 0.42 Mb ( 192, 2, 72) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./KCoO2.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 47.2 secs Computing kpt #: 2 total cpu time spent up to now is 51.9 secs Computing kpt #: 3 total cpu time spent up to now is 56.3 secs Computing kpt #: 4 total cpu time spent up to now is 61.1 secs Computing kpt #: 5 total cpu time spent up to now is 65.9 secs Computing kpt #: 6 total cpu time spent up to now is 70.6 secs Computing kpt #: 7 total cpu time spent up to now is 75.8 secs Computing kpt #: 8 total cpu time spent up to now is 82.7 secs Computing kpt #: 9 total cpu time spent up to now is 87.5 secs Computing kpt #: 10 total cpu time spent up to now is 92.7 secs Computing kpt #: 11 total cpu time spent up to now is 98.0 secs Computing kpt #: 12 total cpu time spent up to now is 103.7 secs Computing kpt #: 13 total cpu time spent up to now is 109.1 secs Computing kpt #: 14 total cpu time spent up to now is 115.2 secs Computing kpt #: 15 total cpu time spent up to now is 121.4 secs Computing kpt #: 16 total cpu time spent up to now is 127.7 secs Computing kpt #: 17 total cpu time spent up to now is 134.5 secs Computing kpt #: 18 total cpu time spent up to now is 141.8 secs Computing kpt #: 19 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 149.2 secs Computing kpt #: 20 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 156.8 secs Computing kpt #: 21 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 164.3 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 171.8 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 179.3 secs Computing kpt #: 24 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 186.8 secs Computing kpt #: 25 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 194.3 secs Computing kpt #: 26 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 201.8 secs Computing kpt #: 27 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 209.3 secs Computing kpt #: 28 total cpu time spent up to now is 216.1 secs Computing kpt #: 29 total cpu time spent up to now is 222.3 secs Computing kpt #: 30 total cpu time spent up to now is 228.2 secs Computing kpt #: 31 total cpu time spent up to now is 233.8 secs Computing kpt #: 32 total cpu time spent up to now is 238.7 secs Computing kpt #: 33 total cpu time spent up to now is 243.3 secs Computing kpt #: 34 total cpu time spent up to now is 247.9 secs Computing kpt #: 35 total cpu time spent up to now is 252.1 secs Computing kpt #: 36 total cpu time spent up to now is 256.5 secs Computing kpt #: 37 total cpu time spent up to now is 260.9 secs Computing kpt #: 38 total cpu time spent up to now is 265.1 secs Computing kpt #: 39 total cpu time spent up to now is 269.2 secs Computing kpt #: 40 total cpu time spent up to now is 273.7 secs Computing kpt #: 41 total cpu time spent up to now is 277.6 secs Computing kpt #: 42 total cpu time spent up to now is 281.6 secs Computing kpt #: 43 total cpu time spent up to now is 285.6 secs Computing kpt #: 44 total cpu time spent up to now is 289.6 secs Computing kpt #: 45 total cpu time spent up to now is 293.6 secs Computing kpt #: 46 total cpu time spent up to now is 297.5 secs Computing kpt #: 47 total cpu time spent up to now is 301.5 secs Computing kpt #: 48 total cpu time spent up to now is 305.6 secs Computing kpt #: 49 total cpu time spent up to now is 309.6 secs Computing kpt #: 50 total cpu time spent up to now is 313.6 secs Computing kpt #: 51 total cpu time spent up to now is 317.6 secs Computing kpt #: 52 total cpu time spent up to now is 321.6 secs Computing kpt #: 53 total cpu time spent up to now is 325.7 secs Computing kpt #: 54 total cpu time spent up to now is 329.7 secs Computing kpt #: 55 total cpu time spent up to now is 333.9 secs Computing kpt #: 56 total cpu time spent up to now is 338.1 secs Computing kpt #: 57 total cpu time spent up to now is 342.4 secs Computing kpt #: 58 total cpu time spent up to now is 346.7 secs Computing kpt #: 59 total cpu time spent up to now is 351.2 secs Computing kpt #: 60 total cpu time spent up to now is 355.5 secs Computing kpt #: 61 total cpu time spent up to now is 359.9 secs Computing kpt #: 62 total cpu time spent up to now is 364.4 secs Computing kpt #: 63 total cpu time spent up to now is 369.0 secs Computing kpt #: 64 total cpu time spent up to now is 373.7 secs Computing kpt #: 65 total cpu time spent up to now is 379.4 secs Computing kpt #: 66 total cpu time spent up to now is 385.1 secs Computing kpt #: 67 total cpu time spent up to now is 390.2 secs Computing kpt #: 68 total cpu time spent up to now is 395.0 secs Computing kpt #: 69 total cpu time spent up to now is 399.8 secs Computing kpt #: 70 total cpu time spent up to now is 404.7 secs Computing kpt #: 71 total cpu time spent up to now is 409.8 secs Computing kpt #: 72 total cpu time spent up to now is 414.7 secs Computing kpt #: 73 total cpu time spent up to now is 419.6 secs Computing kpt #: 74 total cpu time spent up to now is 424.4 secs Computing kpt #: 75 total cpu time spent up to now is 429.6 secs Computing kpt #: 76 total cpu time spent up to now is 434.8 secs Computing kpt #: 77 total cpu time spent up to now is 439.7 secs Computing kpt #: 78 total cpu time spent up to now is 444.6 secs Computing kpt #: 79 total cpu time spent up to now is 449.4 secs Computing kpt #: 80 total cpu time spent up to now is 454.5 secs Computing kpt #: 81 total cpu time spent up to now is 460.2 secs Computing kpt #: 82 total cpu time spent up to now is 465.9 secs Computing kpt #: 83 total cpu time spent up to now is 472.2 secs Computing kpt #: 84 total cpu time spent up to now is 478.1 secs Computing kpt #: 85 total cpu time spent up to now is 485.0 secs Computing kpt #: 86 total cpu time spent up to now is 492.0 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 499.5 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 507.1 secs Computing kpt #: 89 total cpu time spent up to now is 514.0 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 521.7 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 529.3 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 536.9 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 544.6 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 552.3 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 559.9 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 567.7 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 575.3 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 582.9 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 590.4 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 597.9 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 605.4 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 613.1 secs Computing kpt #: 103 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 620.6 secs Computing kpt #: 104 total cpu time spent up to now is 627.8 secs Computing kpt #: 105 total cpu time spent up to now is 635.1 secs Computing kpt #: 106 total cpu time spent up to now is 642.0 secs Computing kpt #: 107 total cpu time spent up to now is 648.7 secs Computing kpt #: 108 total cpu time spent up to now is 654.9 secs Computing kpt #: 109 total cpu time spent up to now is 660.7 secs Computing kpt #: 110 total cpu time spent up to now is 666.5 secs Computing kpt #: 111 total cpu time spent up to now is 671.8 secs Computing kpt #: 112 total cpu time spent up to now is 677.5 secs Computing kpt #: 113 total cpu time spent up to now is 683.2 secs Computing kpt #: 114 total cpu time spent up to now is 688.5 secs Computing kpt #: 115 total cpu time spent up to now is 694.1 secs Computing kpt #: 116 total cpu time spent up to now is 699.2 secs Computing kpt #: 117 total cpu time spent up to now is 704.0 secs Computing kpt #: 118 total cpu time spent up to now is 709.2 secs Computing kpt #: 119 total cpu time spent up to now is 713.9 secs Computing kpt #: 120 total cpu time spent up to now is 718.5 secs Computing kpt #: 121 total cpu time spent up to now is 723.1 secs Computing kpt #: 122 total cpu time spent up to now is 727.8 secs Computing kpt #: 123 total cpu time spent up to now is 732.1 secs Computing kpt #: 124 total cpu time spent up to now is 736.5 secs Computing kpt #: 125 total cpu time spent up to now is 740.8 secs Computing kpt #: 126 total cpu time spent up to now is 745.1 secs Computing kpt #: 127 total cpu time spent up to now is 749.4 secs Computing kpt #: 128 total cpu time spent up to now is 753.5 secs Computing kpt #: 129 total cpu time spent up to now is 757.9 secs Computing kpt #: 130 total cpu time spent up to now is 762.2 secs Computing kpt #: 131 total cpu time spent up to now is 766.6 secs Computing kpt #: 132 total cpu time spent up to now is 771.0 secs Computing kpt #: 133 total cpu time spent up to now is 775.4 secs Computing kpt #: 134 total cpu time spent up to now is 779.5 secs Computing kpt #: 135 total cpu time spent up to now is 784.2 secs Computing kpt #: 136 total cpu time spent up to now is 789.2 secs Computing kpt #: 137 total cpu time spent up to now is 793.8 secs Computing kpt #: 138 total cpu time spent up to now is 798.6 secs Computing kpt #: 139 total cpu time spent up to now is 803.2 secs Computing kpt #: 140 total cpu time spent up to now is 808.0 secs Computing kpt #: 141 total cpu time spent up to now is 812.8 secs Computing kpt #: 142 total cpu time spent up to now is 817.7 secs Computing kpt #: 143 total cpu time spent up to now is 822.4 secs Computing kpt #: 144 total cpu time spent up to now is 826.9 secs Computing kpt #: 145 total cpu time spent up to now is 831.4 secs Computing kpt #: 146 total cpu time spent up to now is 835.8 secs Computing kpt #: 147 total cpu time spent up to now is 840.0 secs Computing kpt #: 148 total cpu time spent up to now is 844.3 secs Computing kpt #: 149 total cpu time spent up to now is 848.5 secs Computing kpt #: 150 total cpu time spent up to now is 852.6 secs Computing kpt #: 151 total cpu time spent up to now is 856.8 secs Computing kpt #: 152 total cpu time spent up to now is 861.0 secs Computing kpt #: 153 total cpu time spent up to now is 865.1 secs Computing kpt #: 154 total cpu time spent up to now is 869.5 secs Computing kpt #: 155 total cpu time spent up to now is 873.4 secs Computing kpt #: 156 total cpu time spent up to now is 877.4 secs Computing kpt #: 157 total cpu time spent up to now is 881.4 secs Computing kpt #: 158 total cpu time spent up to now is 885.5 secs Computing kpt #: 159 total cpu time spent up to now is 889.4 secs Computing kpt #: 160 total cpu time spent up to now is 893.6 secs Computing kpt #: 161 total cpu time spent up to now is 897.6 secs Computing kpt #: 162 total cpu time spent up to now is 902.6 secs Computing kpt #: 163 total cpu time spent up to now is 906.8 secs Computing kpt #: 164 total cpu time spent up to now is 911.7 secs Computing kpt #: 165 total cpu time spent up to now is 916.0 secs Computing kpt #: 166 total cpu time spent up to now is 920.3 secs Computing kpt #: 167 total cpu time spent up to now is 924.6 secs Computing kpt #: 168 total cpu time spent up to now is 929.5 secs Computing kpt #: 169 total cpu time spent up to now is 933.8 secs Computing kpt #: 170 total cpu time spent up to now is 938.2 secs Computing kpt #: 171 total cpu time spent up to now is 942.6 secs Computing kpt #: 172 total cpu time spent up to now is 947.1 secs Computing kpt #: 173 total cpu time spent up to now is 951.8 secs Computing kpt #: 174 total cpu time spent up to now is 956.3 secs Computing kpt #: 175 total cpu time spent up to now is 960.8 secs Computing kpt #: 176 total cpu time spent up to now is 965.3 secs Computing kpt #: 177 total cpu time spent up to now is 970.2 secs Computing kpt #: 178 total cpu time spent up to now is 974.8 secs Computing kpt #: 179 total cpu time spent up to now is 980.3 secs Computing kpt #: 180 total cpu time spent up to now is 985.2 secs Computing kpt #: 181 total cpu time spent up to now is 990.4 secs Computing kpt #: 182 total cpu time spent up to now is 995.3 secs Computing kpt #: 183 total cpu time spent up to now is 1000.6 secs Computing kpt #: 184 total cpu time spent up to now is 1005.8 secs Computing kpt #: 185 total cpu time spent up to now is 1011.0 secs Computing kpt #: 186 total cpu time spent up to now is 1016.2 secs Computing kpt #: 187 total cpu time spent up to now is 1021.2 secs Computing kpt #: 188 total cpu time spent up to now is 1026.5 secs Computing kpt #: 189 total cpu time spent up to now is 1031.4 secs Computing kpt #: 190 total cpu time spent up to now is 1036.9 secs Computing kpt #: 191 total cpu time spent up to now is 1041.5 secs Computing kpt #: 192 total cpu time spent up to now is 1046.3 secs Computing kpt #: 193 total cpu time spent up to now is 1050.9 secs Computing kpt #: 194 total cpu time spent up to now is 1055.5 secs Computing kpt #: 195 total cpu time spent up to now is 1059.9 secs Computing kpt #: 196 total cpu time spent up to now is 1064.3 secs Computing kpt #: 197 total cpu time spent up to now is 1068.5 secs Computing kpt #: 198 total cpu time spent up to now is 1072.7 secs Computing kpt #: 199 total cpu time spent up to now is 1076.8 secs Computing kpt #: 200 total cpu time spent up to now is 1080.8 secs Computing kpt #: 201 total cpu time spent up to now is 1085.0 secs Computing kpt #: 202 total cpu time spent up to now is 1089.0 secs Computing kpt #: 203 total cpu time spent up to now is 1093.0 secs Computing kpt #: 204 total cpu time spent up to now is 1097.0 secs Computing kpt #: 205 total cpu time spent up to now is 1101.4 secs Computing kpt #: 206 total cpu time spent up to now is 1105.1 secs Computing kpt #: 207 total cpu time spent up to now is 1108.9 secs Computing kpt #: 208 total cpu time spent up to now is 1112.6 secs Computing kpt #: 209 total cpu time spent up to now is 1116.3 secs Computing kpt #: 210 total cpu time spent up to now is 1120.1 secs Computing kpt #: 211 total cpu time spent up to now is 1123.8 secs Computing kpt #: 212 total cpu time spent up to now is 1127.6 secs Computing kpt #: 213 total cpu time spent up to now is 1131.5 secs Computing kpt #: 214 total cpu time spent up to now is 1135.6 secs Computing kpt #: 215 total cpu time spent up to now is 1139.6 secs Computing kpt #: 216 total cpu time spent up to now is 1143.4 secs Computing kpt #: 217 total cpu time spent up to now is 1147.3 secs Computing kpt #: 218 total cpu time spent up to now is 1151.3 secs Computing kpt #: 219 total cpu time spent up to now is 1155.3 secs Computing kpt #: 220 total cpu time spent up to now is 1159.3 secs Computing kpt #: 221 total cpu time spent up to now is 1163.3 secs Computing kpt #: 222 total cpu time spent up to now is 1167.5 secs Computing kpt #: 223 total cpu time spent up to now is 1171.5 secs Computing kpt #: 224 total cpu time spent up to now is 1175.5 secs Computing kpt #: 225 total cpu time spent up to now is 1179.7 secs Computing kpt #: 226 total cpu time spent up to now is 1183.9 secs Computing kpt #: 227 total cpu time spent up to now is 1188.2 secs Computing kpt #: 228 total cpu time spent up to now is 1192.6 secs Computing kpt #: 229 total cpu time spent up to now is 1197.1 secs Computing kpt #: 230 total cpu time spent up to now is 1201.9 secs Computing kpt #: 231 total cpu time spent up to now is 1206.6 secs Computing kpt #: 232 total cpu time spent up to now is 1211.6 secs Computing kpt #: 233 total cpu time spent up to now is 1216.7 secs Computing kpt #: 234 total cpu time spent up to now is 1221.7 secs Computing kpt #: 235 total cpu time spent up to now is 1227.0 secs Computing kpt #: 236 total cpu time spent up to now is 1231.8 secs Computing kpt #: 237 total cpu time spent up to now is 1237.0 secs Computing kpt #: 238 total cpu time spent up to now is 1242.2 secs Computing kpt #: 239 total cpu time spent up to now is 1247.3 secs Computing kpt #: 240 total cpu time spent up to now is 1252.6 secs Computing kpt #: 241 total cpu time spent up to now is 1257.9 secs Computing kpt #: 242 total cpu time spent up to now is 1263.1 secs Computing kpt #: 243 total cpu time spent up to now is 1268.3 secs Computing kpt #: 244 total cpu time spent up to now is 1273.5 secs Computing kpt #: 245 total cpu time spent up to now is 1278.9 secs Computing kpt #: 246 total cpu time spent up to now is 1284.0 secs Computing kpt #: 247 total cpu time spent up to now is 1289.0 secs Computing kpt #: 248 total cpu time spent up to now is 1294.1 secs Computing kpt #: 249 total cpu time spent up to now is 1299.0 secs Computing kpt #: 250 total cpu time spent up to now is 1304.4 secs Computing kpt #: 251 total cpu time spent up to now is 1309.5 secs Computing kpt #: 252 total cpu time spent up to now is 1314.7 secs Computing kpt #: 253 total cpu time spent up to now is 1319.8 secs Computing kpt #: 254 total cpu time spent up to now is 1325.0 secs Computing kpt #: 255 total cpu time spent up to now is 1330.1 secs Computing kpt #: 256 total cpu time spent up to now is 1335.1 secs Computing kpt #: 257 total cpu time spent up to now is 1340.0 secs Computing kpt #: 258 total cpu time spent up to now is 1345.2 secs Computing kpt #: 259 total cpu time spent up to now is 1350.4 secs Computing kpt #: 260 total cpu time spent up to now is 1355.2 secs Computing kpt #: 261 total cpu time spent up to now is 1360.3 secs Computing kpt #: 262 total cpu time spent up to now is 1365.4 secs Computing kpt #: 263 total cpu time spent up to now is 1370.4 secs Computing kpt #: 264 total cpu time spent up to now is 1375.3 secs Computing kpt #: 265 total cpu time spent up to now is 1380.1 secs Computing kpt #: 266 total cpu time spent up to now is 1384.8 secs Computing kpt #: 267 total cpu time spent up to now is 1389.7 secs Computing kpt #: 268 total cpu time spent up to now is 1395.3 secs Computing kpt #: 269 total cpu time spent up to now is 1400.2 secs Computing kpt #: 270 total cpu time spent up to now is 1405.0 secs Computing kpt #: 271 total cpu time spent up to now is 1409.9 secs Computing kpt #: 272 total cpu time spent up to now is 1414.6 secs Computing kpt #: 273 total cpu time spent up to now is 1419.3 secs Computing kpt #: 274 total cpu time spent up to now is 1424.0 secs Computing kpt #: 275 total cpu time spent up to now is 1428.6 secs Computing kpt #: 276 total cpu time spent up to now is 1433.1 secs Computing kpt #: 277 total cpu time spent up to now is 1437.6 secs Computing kpt #: 278 total cpu time spent up to now is 1442.3 secs Computing kpt #: 279 total cpu time spent up to now is 1446.8 secs Computing kpt #: 280 total cpu time spent up to now is 1451.2 secs Computing kpt #: 281 total cpu time spent up to now is 1455.8 secs Computing kpt #: 282 total cpu time spent up to now is 1460.7 secs Computing kpt #: 283 total cpu time spent up to now is 1465.2 secs Computing kpt #: 284 total cpu time spent up to now is 1469.5 secs Computing kpt #: 285 total cpu time spent up to now is 1474.4 secs Computing kpt #: 286 total cpu time spent up to now is 1478.9 secs Computing kpt #: 287 total cpu time spent up to now is 1483.4 secs Computing kpt #: 288 total cpu time spent up to now is 1488.0 secs Computing kpt #: 289 total cpu time spent up to now is 1492.3 secs Computing kpt #: 290 total cpu time spent up to now is 1496.2 secs Computing kpt #: 291 total cpu time spent up to now is 1500.2 secs Computing kpt #: 292 total cpu time spent up to now is 1504.3 secs Computing kpt #: 293 total cpu time spent up to now is 1508.4 secs Computing kpt #: 294 total cpu time spent up to now is 1512.5 secs Computing kpt #: 295 total cpu time spent up to now is 1516.7 secs Computing kpt #: 296 total cpu time spent up to now is 1520.7 secs Computing kpt #: 297 total cpu time spent up to now is 1524.7 secs Computing kpt #: 298 total cpu time spent up to now is 1528.8 secs Computing kpt #: 299 total cpu time spent up to now is 1533.0 secs Computing kpt #: 300 total cpu time spent up to now is 1537.1 secs Computing kpt #: 301 total cpu time spent up to now is 1541.3 secs Computing kpt #: 302 total cpu time spent up to now is 1545.6 secs Computing kpt #: 303 total cpu time spent up to now is 1549.9 secs Computing kpt #: 304 total cpu time spent up to now is 1554.4 secs Computing kpt #: 305 total cpu time spent up to now is 1558.8 secs Computing kpt #: 306 total cpu time spent up to now is 1563.9 secs Computing kpt #: 307 total cpu time spent up to now is 1568.7 secs Computing kpt #: 308 total cpu time spent up to now is 1573.4 secs Computing kpt #: 309 total cpu time spent up to now is 1578.7 secs Computing kpt #: 310 total cpu time spent up to now is 1584.9 secs Computing kpt #: 311 total cpu time spent up to now is 1590.0 secs Computing kpt #: 312 total cpu time spent up to now is 1595.4 secs ethr = 1.67E-11, avg # of iterations = 62.3 total cpu time spent up to now is 1595.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4323 PWs) bands (ev): -23.2210 -23.2210 -23.0720 -23.0720 -11.9891 -11.9891 -11.4141 -11.4141 -11.4039 -11.4039 -11.2836 -11.2836 -7.0304 -7.0304 -6.7832 -6.7832 -6.7668 -6.7668 -6.7144 -6.7144 -6.4640 -6.4640 -6.3955 -6.3955 0.7239 0.7239 1.1549 1.1549 1.6207 1.6207 1.6260 1.6260 1.6894 1.6894 2.3518 2.3518 2.3808 2.3808 2.3945 2.3945 2.6390 2.6390 3.7241 3.7241 4.0781 4.0781 4.0845 4.0845 5.3542 5.3542 5.3931 5.3931 5.5532 5.5532 5.7290 5.7290 5.7988 5.7988 6.6136 6.6136 6.9535 6.9535 7.8149 7.8149 7.8491 7.8491 8.5443 8.5443 9.2725 9.2725 12.5297 12.5297 k = 0.0000 0.0000 0.0173 ( 4323 PWs) bands (ev): -23.2209 -23.2209 -23.0721 -23.0721 -11.9889 -11.9889 -11.4142 -11.4142 -11.4039 -11.4039 -11.2839 -11.2836 -7.0314 -7.0292 -6.7835 -6.7834 -6.7705 -6.7640 -6.7144 -6.7126 -6.4652 -6.4628 -6.3955 -6.3955 0.7239 0.7242 1.1550 1.1551 1.6185 1.6211 1.6250 1.6255 1.6895 1.6919 2.3468 2.3535 2.3805 2.3823 2.3918 2.3987 2.6393 2.6395 3.7237 3.7240 4.0763 4.0778 4.0831 4.0837 5.3547 5.3557 5.3908 5.3967 5.5502 5.5541 5.7292 5.7322 5.7951 5.8053 6.6128 6.6155 6.9526 6.9538 7.8131 7.8149 7.8472 7.8491 8.5435 8.5435 9.2758 9.2762 12.5307 12.5310 k = 0.0000 0.0000 0.0345 ( 4315 PWs) bands (ev): -23.2207 -23.2207 -23.0723 -23.0723 -11.9886 -11.9886 -11.4144 -11.4144 -11.4041 -11.4040 -11.2845 -11.2839 -7.0323 -7.0279 -6.7845 -6.7842 -6.7749 -6.7621 -6.7126 -6.7093 -6.4662 -6.4615 -6.3955 -6.3955 0.7243 0.7248 1.1553 1.1556 1.6147 1.6199 1.6224 1.6237 1.6922 1.6966 2.3406 2.3511 2.3778 2.3833 2.3928 2.4056 2.6405 2.6410 3.7227 3.7234 4.0722 4.0752 4.0795 4.0808 5.3575 5.3592 5.3896 5.4018 5.5460 5.5525 5.7316 5.7389 5.7943 5.8151 6.6131 6.6185 6.9512 6.9536 7.8095 7.8131 7.8437 7.8476 8.5410 8.5410 9.2860 9.2868 12.5339 12.5344 k = 0.0000 0.0000 0.0518 ( 4329 PWs) bands (ev): -23.2204 -23.2204 -23.0726 -23.0726 -11.9880 -11.9880 -11.4149 -11.4147 -11.4043 -11.4041 -11.2854 -11.2845 -7.0331 -7.0266 -6.7865 -6.7857 -6.7792 -6.7607 -6.7091 -6.7050 -6.4670 -6.4601 -6.3956 -6.3956 0.7250 0.7257 1.1559 1.1564 1.6097 1.6172 1.6182 1.6207 1.6971 1.7029 2.3345 2.3468 2.3720 2.3782 2.4012 2.4149 2.6426 2.6431 3.7212 3.7222 4.0659 4.0703 4.0738 4.0757 5.3624 5.3642 5.3894 5.4079 5.5420 5.5489 5.7346 5.7475 5.7970 5.8286 6.6145 6.6227 6.9491 6.9526 7.8041 7.8092 7.8386 7.8446 8.5368 8.5369 9.3030 9.3042 12.5392 12.5400 k = 0.0000 0.0000 0.0691 ( 4331 PWs) bands (ev): -23.2200 -23.2200 -23.0730 -23.0730 -11.9872 -11.9872 -11.4157 -11.4154 -11.4044 -11.4041 -11.2865 -11.2853 -7.0337 -7.0251 -6.7893 -6.7891 -6.7821 -6.7594 -6.7044 -6.6999 -6.4678 -6.4586 -6.3956 -6.3956 0.7260 0.7269 1.1568 1.1575 1.6038 1.6128 1.6133 1.6166 1.7037 1.7104 2.3291 2.3420 2.3636 2.3703 2.4124 2.4258 2.6454 2.6460 3.7191 3.7205 4.0576 4.0632 4.0659 4.0685 5.3692 5.3694 5.3912 5.4151 5.5396 5.5448 5.7375 5.7554 5.8054 5.8458 6.6171 6.6280 6.9464 6.9512 7.7971 7.8034 7.8321 7.8405 8.5310 8.5311 9.3266 9.3282 12.5466 12.5477 k = 0.0000 0.0000 0.0864 ( 4335 PWs) bands (ev): -23.2195 -23.2195 -23.0735 -23.0735 -11.9861 -11.9861 -11.4170 -11.4165 -11.4044 -11.4038 -11.2879 -11.2865 -7.0342 -7.0236 -6.7943 -6.7930 -6.7834 -6.7581 -6.6988 -6.6943 -6.4683 -6.4571 -6.3956 -6.3956 0.7273 0.7285 1.1579 1.1588 1.5975 1.6068 1.6080 1.6114 1.7116 1.7188 2.3245 2.3370 2.3529 2.3608 2.4249 2.4378 2.6488 2.6493 3.7165 3.7182 4.0472 4.0540 4.0561 4.0593 5.3718 5.3784 5.3967 5.4225 5.5399 5.5417 5.7399 5.7602 5.8206 5.8664 6.6209 6.6344 6.9431 6.9491 7.7883 7.7956 7.8245 7.8354 8.5236 8.5237 9.3566 9.3584 12.5561 12.5575 k = 0.0000 0.0000 0.1036 ( 4339 PWs) bands (ev): -23.2188 -23.2188 -23.0742 -23.0742 -11.9848 -11.9847 -11.4187 -11.4180 -11.4040 -11.4033 -11.2896 -11.2879 -7.0344 -7.0221 -6.8001 -6.7972 -6.7839 -6.7566 -6.6926 -6.6884 -6.4687 -6.4555 -6.3957 -6.3956 0.7290 0.7304 1.1593 1.1604 1.5908 1.6002 1.6018 1.6052 1.7204 1.7279 2.3210 2.3312 2.3404 2.3511 2.4383 2.4505 2.6526 2.6530 3.7134 3.7153 4.0348 4.0428 4.0443 4.0481 5.3706 5.3890 5.4069 5.4294 5.5413 5.5434 5.7418 5.7621 5.8416 5.8899 6.6258 6.6419 6.9392 6.9465 7.7778 7.7859 7.8160 7.8294 8.5145 8.5146 9.3925 9.3946 12.5674 12.5691 k = 0.0000 0.0000 0.1209 ( 4341 PWs) bands (ev): -23.2180 -23.2180 -23.0749 -23.0749 -11.9831 -11.9831 -11.4210 -11.4202 -11.4034 -11.4024 -11.2915 -11.2896 -7.0345 -7.0205 -6.8061 -6.8018 -6.7841 -6.7549 -6.6861 -6.6822 -6.4690 -6.4538 -6.3957 -6.3957 0.7310 0.7327 1.1610 1.1622 1.5839 1.5930 1.5947 1.5979 1.7300 1.7375 2.3180 2.3224 2.3267 2.3437 2.4524 2.4639 2.6569 2.6570 3.7098 3.7119 4.0206 4.0295 4.0306 4.0350 5.3669 5.4005 5.4204 5.4355 5.5451 5.5504 5.7436 5.7626 5.8664 5.9157 6.6318 6.6506 6.9346 6.9433 7.7658 7.7744 7.8066 7.8227 8.5037 8.5039 9.4341 9.4363 12.5805 12.5825 k = 0.0000 0.0000 0.1382 ( 4341 PWs) bands (ev): -23.2171 -23.2171 -23.0758 -23.0758 -11.9812 -11.9812 -11.4238 -11.4228 -11.4026 -11.4014 -11.2937 -11.2916 -7.0343 -7.0188 -6.8122 -6.8068 -6.7840 -6.7530 -6.6793 -6.6759 -6.4691 -6.4521 -6.3958 -6.3957 0.7334 0.7353 1.1630 1.1643 1.5767 1.5847 1.5874 1.5897 1.7401 1.7476 2.3090 2.3095 2.3189 2.3400 2.4670 2.4779 2.6612 2.6614 3.7055 3.7080 4.0047 4.0145 4.0152 4.0201 5.3617 5.4111 5.4364 5.4418 5.5541 5.5603 5.7457 5.7623 5.8938 5.9435 6.6389 6.6603 6.9294 6.9395 7.7526 7.7617 7.7964 7.8152 8.4913 8.4915 9.4810 9.4833 12.5951 12.5974 k = 0.0000 0.0000 0.1554 ( 4349 PWs) bands (ev): -23.2160 -23.2160 -23.0768 -23.0768 -11.9791 -11.9790 -11.4271 -11.4260 -11.4015 -11.4001 -11.2961 -11.2938 -7.0340 -7.0172 -6.8182 -6.8119 -6.7835 -6.7510 -6.6725 -6.6695 -6.4690 -6.4504 -6.3959 -6.3958 0.7362 0.7383 1.1652 1.1667 1.5693 1.5753 1.5802 1.5807 1.7507 1.7581 2.2927 2.2939 2.3184 2.3391 2.4821 2.4922 2.6654 2.6660 3.7007 3.7034 3.9872 3.9979 3.9982 4.0035 5.3557 5.4176 5.4516 5.4543 5.5679 5.5723 5.7485 5.7617 5.9231 5.9728 6.6471 6.6710 6.9236 6.9353 7.7382 7.7477 7.7854 7.8068 8.4772 8.4774 9.5329 9.5351 12.6110 12.6136 k = 0.0000 0.0000 0.1727 ( 4349 PWs) bands (ev): -23.2149 -23.2149 -23.0779 -23.0779 -11.9765 -11.9765 -11.4308 -11.4297 -11.4002 -11.3987 -11.2988 -11.2963 -7.0334 -7.0155 -6.8242 -6.8170 -6.7827 -6.7489 -6.6656 -6.6631 -6.4687 -6.4487 -6.3961 -6.3960 0.7393 0.7416 1.1677 1.1694 1.5615 1.5648 1.5711 1.5729 1.7617 1.7690 2.2750 2.2766 2.3196 2.3399 2.4974 2.5067 2.6697 2.6708 3.6953 3.6982 3.9683 3.9797 3.9798 3.9854 5.3495 5.4188 5.4666 5.4739 5.5856 5.5857 5.7530 5.7613 5.9538 6.0033 6.6563 6.6828 6.9172 6.9305 7.7231 7.7329 7.7737 7.7976 8.4614 8.4618 9.5893 9.5915 12.6280 12.6309 k = 0.0000 0.0000 0.1900 ( 4353 PWs) bands (ev): -23.2136 -23.2136 -23.0792 -23.0792 -11.9737 -11.9736 -11.4350 -11.4338 -11.3988 -11.3971 -11.3016 -11.2990 -7.0326 -7.0139 -6.8301 -6.8222 -6.7815 -6.7467 -6.6587 -6.6567 -6.4683 -6.4471 -6.3962 -6.3961 0.7429 0.7454 1.1705 1.1723 1.5527 1.5533 1.5615 1.5656 1.7730 1.7800 2.2566 2.2584 2.3221 2.3422 2.5130 2.5215 2.6739 2.6755 3.6892 3.6924 3.9482 3.9599 3.9605 3.9659 5.3433 5.4170 5.4852 5.4950 5.5990 5.6063 5.7599 5.7616 5.9857 6.0350 6.6665 6.6955 6.9102 6.9253 7.7074 7.7174 7.7611 7.7875 8.4440 8.4445 9.6500 9.6521 12.6457 12.6490 k = 0.0000 0.0000 0.2073 ( 4353 PWs) bands (ev): -23.2123 -23.2123 -23.0805 -23.0805 -11.9705 -11.9704 -11.4396 -11.4385 -11.3973 -11.3955 -11.3046 -11.3019 -7.0315 -7.0122 -6.8359 -6.8274 -6.7799 -6.7444 -6.6520 -6.6503 -6.4678 -6.4454 -6.3964 -6.3964 0.7469 0.7496 1.1735 1.1755 1.5410 1.5424 1.5525 1.5583 1.7846 1.7914 2.2376 2.2394 2.3259 2.3459 2.5286 2.5363 2.6781 2.6802 3.6823 3.6858 3.9269 3.9390 3.9400 3.9452 5.3375 5.4141 5.5061 5.5172 5.6111 5.6283 5.7634 5.7704 6.0185 6.0674 6.6776 6.7092 6.9027 6.9198 7.6912 7.7015 7.7477 7.7766 8.4249 8.4256 9.7146 9.7165 12.6638 12.6674 k = 0.0000 0.0000 0.2245 ( 4353 PWs) bands (ev): -23.2108 -23.2108 -23.0819 -23.0819 -11.9670 -11.9669 -11.4447 -11.4436 -11.3957 -11.3937 -11.3077 -11.3049 -7.0302 -7.0105 -6.8416 -6.8325 -6.7779 -6.7419 -6.6454 -6.6440 -6.4671 -6.4437 -6.3967 -6.3966 0.7513 0.7542 1.1767 1.1789 1.5278 1.5304 1.5443 1.5509 1.7964 1.8028 2.2182 2.2201 2.3310 2.3509 2.5443 2.5512 2.6821 2.6848 3.6745 3.6784 3.9047 3.9173 3.9187 3.9236 5.3322 5.4109 5.5287 5.5404 5.6210 5.6497 5.7680 5.7852 6.0520 6.1006 6.6894 6.7236 6.8949 6.9141 7.6747 7.6853 7.7335 7.7647 8.4042 8.4051 9.7828 9.7845 12.6819 12.6859 k = 0.0000 0.0000 0.2418 ( 4357 PWs) bands (ev): -23.2092 -23.2092 -23.0834 -23.0834 -11.9631 -11.9630 -11.4503 -11.4492 -11.3941 -11.3920 -11.3110 -11.3082 -7.0288 -7.0088 -6.8472 -6.8376 -6.7755 -6.7394 -6.6390 -6.6379 -6.4662 -6.4421 -6.3970 -6.3970 0.7561 0.7593 1.1802 1.1825 1.5139 1.5172 1.5366 1.5435 1.8083 1.8144 2.1988 2.2005 2.3374 2.3572 2.5598 2.5658 2.6859 2.6893 3.6656 3.6699 3.8818 3.8950 3.8966 3.9015 5.3276 5.4079 5.5525 5.5640 5.6283 5.6683 5.7776 5.8047 6.0860 6.1343 6.7018 6.7385 6.8868 6.9083 7.6580 7.6688 7.7185 7.7519 8.3818 8.3830 9.8544 9.8559 12.6995 12.7039 k = 0.0000 0.0000 0.2591 ( 4353 PWs) bands (ev): -23.2075 -23.2075 -23.0851 -23.0851 -11.9588 -11.9586 -11.4563 -11.4552 -11.3924 -11.3901 -11.3143 -11.3115 -7.0270 -7.0071 -6.8527 -6.8427 -6.7727 -6.7367 -6.6328 -6.6319 -6.4652 -6.4406 -6.3974 -6.3974 0.7614 0.7648 1.1840 1.1865 1.4992 1.5030 1.5291 1.5360 1.8202 1.8260 2.1794 2.1810 2.3452 2.3647 2.5751 2.5803 2.6896 2.6935 3.6554 3.6601 3.8585 3.8723 3.8741 3.8791 5.3238 5.4054 5.5773 5.5871 5.6341 5.6815 5.7942 5.8287 6.1206 6.1685 6.7146 6.7536 6.8790 6.9028 7.6411 7.6522 7.7027 7.7382 8.3579 8.3594 9.9291 9.9303 12.7163 12.7210 k = 0.0000 0.0000 0.2764 ( 4357 PWs) bands (ev): -23.2057 -23.2057 -23.0868 -23.0868 -11.9541 -11.9539 -11.4627 -11.4618 -11.3906 -11.3883 -11.3177 -11.3149 -7.0251 -7.0054 -6.8580 -6.8476 -6.7694 -6.7339 -6.6269 -6.6262 -6.4641 -6.4391 -6.3979 -6.3978 0.7672 0.7708 1.1880 1.1906 1.4839 1.4881 1.5217 1.5286 1.8321 1.8375 2.1601 2.1617 2.3542 2.3736 2.5902 2.5945 2.6930 2.6976 3.6436 3.6488 3.8352 3.8497 3.8515 3.8567 5.3208 5.4034 5.6027 5.6064 5.6416 5.6890 5.8183 5.8565 6.1555 6.2030 6.7272 6.7680 6.8723 6.8979 7.6241 7.6354 7.6860 7.7237 8.3324 8.3343 10.0067 10.0075 12.7317 12.7367 k = 0.0000 0.0000 0.2936 ( 4355 PWs) bands (ev): -23.2038 -23.2038 -23.0886 -23.0886 -11.9489 -11.9488 -11.4697 -11.4689 -11.3889 -11.3865 -11.3212 -11.3183 -7.0230 -7.0037 -6.8633 -6.8525 -6.7657 -6.7310 -6.6212 -6.6206 -6.4629 -6.4376 -6.3985 -6.3983 0.7735 0.7773 1.1922 1.1949 1.4681 1.4725 1.5143 1.5211 1.8440 1.8490 2.1413 2.1427 2.3645 2.3837 2.6048 2.6082 2.6962 2.7014 3.6298 3.6355 3.8124 3.8273 3.8292 3.8346 5.3186 5.4022 5.6158 5.6282 5.6576 5.6923 5.8483 5.8876 6.1907 6.2378 6.7391 6.7802 6.8681 6.8943 7.6070 7.6186 7.6686 7.7083 8.3054 8.3077 10.0869 10.0874 12.7455 12.7508 k = 0.0000 0.0000 0.3109 ( 4361 PWs) bands (ev): -23.2019 -23.2019 -23.0905 -23.0905 -11.9434 -11.9432 -11.4772 -11.4765 -11.3872 -11.3847 -11.3246 -11.3217 -7.0206 -7.0020 -6.8684 -6.8573 -6.7616 -6.7279 -6.6159 -6.6153 -6.4616 -6.4362 -6.3991 -6.3988 0.7803 0.7843 1.1966 1.1994 1.4517 1.4563 1.5069 1.5136 1.8556 1.8602 2.1230 2.1242 2.3761 2.3950 2.6189 2.6215 2.6991 2.7049 3.6136 3.6198 3.7905 3.8053 3.8076 3.8132 5.3172 5.4016 5.6166 5.6525 5.6810 5.6943 5.8824 5.9211 6.2260 6.2727 6.7494 6.7876 6.8690 6.8928 7.5899 7.6018 7.6505 7.6921 8.2769 8.2796 10.1695 10.1696 12.7574 12.7628 k = 0.0000 0.0000 0.3282 ( 4375 PWs) bands (ev): -23.1998 -23.1998 -23.0925 -23.0925 -11.9374 -11.9372 -11.4852 -11.4846 -11.3856 -11.3830 -11.3279 -11.3251 -7.0181 -7.0003 -6.8734 -6.8621 -6.7571 -6.7246 -6.6110 -6.6103 -6.4602 -6.4349 -6.3999 -6.3994 0.7875 0.7918 1.2011 1.2041 1.4348 1.4397 1.4995 1.5060 1.8669 1.8712 2.1053 2.1064 2.3890 2.4076 2.6324 2.6341 2.7017 2.7081 3.5948 3.6013 3.7699 3.7843 3.7868 3.7931 5.3166 5.4018 5.6136 5.6699 5.7017 5.7072 5.9192 5.9564 6.2615 6.3077 6.7572 6.7881 6.8772 6.8945 7.5725 7.5848 7.6316 7.6751 8.2469 8.2502 10.2541 10.2543 12.7674 12.7726 k = 0.0000 0.0000 0.3454 ( 4373 PWs) bands (ev): -23.1977 -23.1977 -23.0946 -23.0946 -11.9309 -11.9307 -11.4937 -11.4933 -11.3839 -11.3813 -11.3312 -11.3284 -7.0154 -6.9986 -6.8783 -6.8667 -6.7521 -6.7211 -6.6065 -6.6056 -6.4587 -6.4337 -6.4008 -6.4001 0.7954 0.7998 1.2059 1.2089 1.4176 1.4226 1.4921 1.4985 1.8779 1.8818 2.0883 2.0894 2.4033 2.4215 2.6453 2.6460 2.7041 2.7110 3.5731 3.5797 3.7507 3.7646 3.7665 3.7748 5.3169 5.4027 5.6088 5.6738 5.7218 5.7346 5.9579 5.9932 6.2970 6.3427 6.7616 6.7827 6.8919 6.9004 7.5551 7.5678 7.6121 7.6575 8.2156 8.2195 10.3405 10.3411 12.7754 12.7803 k = 0.0000 0.0000 0.3627 ( 4367 PWs) bands (ev): -23.1954 -23.1954 -23.0968 -23.0968 -11.9240 -11.9237 -11.5027 -11.5024 -11.3823 -11.3797 -11.3344 -11.3317 -7.0126 -6.9968 -6.8831 -6.8713 -6.7467 -6.7174 -6.6024 -6.6013 -6.4571 -6.4325 -6.4017 -6.4008 0.8037 0.8083 1.2107 1.2138 1.4002 1.4053 1.4847 1.4909 1.8884 1.8919 2.0723 2.0732 2.4188 2.4366 2.6572 2.6574 2.7061 2.7137 3.5486 3.5552 3.7325 3.7468 3.7469 3.7587 5.3179 5.4043 5.6029 5.6710 5.7479 5.7626 5.9978 6.0309 6.3324 6.3777 6.7623 6.7734 6.9108 6.9109 7.5375 7.5507 7.5920 7.6391 8.1829 8.1875 10.4288 10.4297 12.7818 12.7862 k = 0.0000 0.0000 0.3800 ( 4363 PWs) bands (ev): -23.1931 -23.1931 -23.0990 -23.0990 -11.9167 -11.9164 -11.5122 -11.5121 -11.3808 -11.3781 -11.3374 -11.3348 -7.0096 -6.9950 -6.8878 -6.8759 -6.7409 -6.7134 -6.5988 -6.5973 -6.4554 -6.4314 -6.4027 -6.4016 0.8126 0.8174 1.2156 1.2187 1.3826 1.3878 1.4772 1.4834 1.8984 1.9015 2.0572 2.0580 2.4355 2.4529 2.6676 2.6687 2.7079 2.7160 3.5214 3.5278 3.7150 3.7281 3.7316 3.7447 5.3197 5.4066 5.5960 5.6660 5.7756 5.7910 6.0385 6.0690 6.3678 6.4125 6.7598 6.7619 6.9254 6.9327 7.5197 7.5335 7.5714 7.6201 8.1490 8.1543 10.5186 10.5199 12.7868 12.7901 k = 0.0000 0.0000 0.3973 ( 4371 PWs) bands (ev): -23.1907 -23.1907 -23.1014 -23.1014 -11.9089 -11.9085 -11.5223 -11.5222 -11.3794 -11.3766 -11.3403 -11.3377 -7.0065 -6.9932 -6.8924 -6.8804 -6.7347 -6.7092 -6.5957 -6.5938 -6.4536 -6.4304 -6.4038 -6.4025 0.8220 0.8270 1.2204 1.2235 1.3650 1.3702 1.4698 1.4758 1.9078 1.9106 2.0431 2.0438 2.4536 2.4704 2.6771 2.6791 2.7093 2.7179 3.4919 3.4981 3.6981 3.7105 3.7186 3.7324 5.3222 5.4096 5.5884 5.6599 5.8040 5.8195 6.0794 6.1071 6.4029 6.4469 6.7493 6.7550 6.9433 6.9562 7.5016 7.5161 7.5502 7.6005 8.1138 8.1199 10.6098 10.6115 12.7905 12.7913 k = 0.0000 0.0000 0.4145 ( 4371 PWs) bands (ev): -23.1883 -23.1883 -23.1038 -23.1038 -11.9006 -11.9002 -11.5329 -11.5328 -11.3780 -11.3752 -11.3431 -11.3405 -7.0032 -6.9913 -6.8969 -6.8848 -6.7282 -6.7048 -6.5931 -6.5907 -6.4519 -6.4295 -6.4049 -6.4034 0.8320 0.8372 1.2250 1.2279 1.3477 1.3528 1.4623 1.4682 1.9166 1.9190 2.0301 2.0307 2.4728 2.4891 2.6857 2.6886 2.7106 2.7196 3.4604 3.4663 3.6822 3.6941 3.7075 3.7216 5.3255 5.4132 5.5803 5.6531 5.8328 5.8481 6.1200 6.1446 6.4377 6.4811 6.7363 6.7489 6.9640 6.9812 7.4832 7.4986 7.5287 7.5805 8.0775 8.0845 10.7023 10.7043 12.7819 12.7875 k = 0.0000 0.0000 0.4318 ( 4383 PWs) bands (ev): -23.1857 -23.1857 -23.1063 -23.1063 -11.8918 -11.8914 -11.5441 -11.5438 -11.3767 -11.3739 -11.3456 -11.3431 -6.9999 -6.9893 -6.9014 -6.8892 -6.7215 -6.7002 -6.5911 -6.5882 -6.4500 -6.4287 -6.4061 -6.4044 0.8426 0.8479 1.2290 1.2316 1.3311 1.3358 1.4548 1.4605 1.9246 1.9266 2.0182 2.0187 2.4931 2.5090 2.6935 2.6972 2.7115 2.7210 3.4273 3.4330 3.6675 3.6792 3.6977 3.7120 5.3293 5.4173 5.5717 5.6457 5.8617 5.8768 6.1599 6.1809 6.4722 6.5148 6.7232 6.7424 6.9867 7.0072 7.4644 7.4808 7.5068 7.5600 8.0401 8.0481 10.7958 10.7982 12.7546 12.7597 k = 0.0000 0.0000 0.4491 ( 4382 PWs) bands (ev): -23.1832 -23.1832 -23.1088 -23.1088 -11.8826 -11.8822 -11.5556 -11.5552 -11.3755 -11.3727 -11.3480 -11.3456 -6.9965 -6.9873 -6.9057 -6.8936 -6.7144 -6.6953 -6.5896 -6.5862 -6.4481 -6.4279 -6.4073 -6.4054 0.8536 0.8591 1.2319 1.2338 1.3160 1.3201 1.4472 1.4529 1.9318 1.9336 2.0075 2.0080 2.5146 2.5299 2.7003 2.7050 2.7123 2.7221 3.3929 3.3984 3.6542 3.6658 3.6890 3.7032 5.3338 5.4221 5.5628 5.6380 5.8908 5.9054 6.1983 6.2152 6.5061 6.5479 6.7109 6.7364 7.0112 7.0340 7.4452 7.4629 7.4849 7.5393 8.0017 8.0109 10.8901 10.8928 12.7212 12.7251 k = 0.0000 0.0000 0.4663 ( 4384 PWs) bands (ev): -23.1805 -23.1805 -23.1114 -23.1114 -11.8730 -11.8725 -11.5676 -11.5671 -11.3744 -11.3716 -11.3502 -11.3478 -6.9930 -6.9853 -6.9099 -6.8979 -6.7071 -6.6901 -6.5888 -6.5848 -6.4462 -6.4272 -6.4084 -6.4065 0.8653 0.8709 1.2327 1.2332 1.3038 1.3066 1.4397 1.4452 1.9382 1.9397 1.9980 1.9983 2.5371 2.5519 2.7063 2.7120 2.7130 2.7228 3.3575 3.3629 3.6424 3.6540 3.6811 3.6952 5.3389 5.4273 5.5536 5.6299 5.9198 5.9339 6.2345 6.2469 6.5395 6.5803 6.6998 6.7318 7.0371 7.0616 7.4257 7.4448 7.4630 7.5184 7.9626 7.9729 10.9851 10.9880 12.6858 12.6890 k = 0.0000 0.0000 0.4836 ( 4392 PWs) bands (ev): -23.1778 -23.1778 -23.1141 -23.1141 -11.8629 -11.8624 -11.5799 -11.5793 -11.3733 -11.3705 -11.3522 -11.3498 -6.9894 -6.9832 -6.9141 -6.9022 -6.6996 -6.6848 -6.5885 -6.5839 -6.4442 -6.4265 -6.4096 -6.4076 0.8775 0.8832 1.2282 1.2296 1.2960 1.2969 1.4321 1.4376 1.9438 1.9450 1.9896 1.9899 2.5605 2.5747 2.7105 2.7145 2.7184 2.7235 3.3214 3.3267 3.6323 3.6439 3.6737 3.6878 5.3445 5.4330 5.5440 5.6214 5.9488 5.9623 6.2673 6.2748 6.5721 6.6119 6.6909 6.7293 7.0641 7.0895 7.4058 7.4266 7.4414 7.4976 7.9226 7.9342 11.0803 11.0836 12.6490 12.6516 k = 0.0000 0.0000 0.5009 ( 4386 PWs) bands (ev): -23.1750 -23.1750 -23.1168 -23.1168 -11.8524 -11.8518 -11.5926 -11.5919 -11.3724 -11.3696 -11.3541 -11.3517 -6.9858 -6.9810 -6.9182 -6.9064 -6.6920 -6.6793 -6.5888 -6.5837 -6.4423 -6.4259 -6.4107 -6.4087 0.8902 0.8961 1.2181 1.2215 1.2924 1.2935 1.4245 1.4299 1.9486 1.9495 1.9825 1.9827 2.5845 2.5981 2.7118 2.7186 2.7230 2.7253 3.2847 3.2900 3.6238 3.6355 3.6668 3.6807 5.3507 5.4393 5.5343 5.6127 5.9778 5.9905 6.2955 6.2981 6.6039 6.6424 6.6853 6.7299 7.0920 7.1177 7.3857 7.4084 7.4206 7.4769 7.8821 7.8951 11.1757 11.1792 12.6106 12.6130 k = 0.0000 0.0000 0.5182 ( 4386 PWs) bands (ev): -23.1722 -23.1722 -23.1195 -23.1195 -11.8415 -11.8409 -11.6056 -11.6048 -11.3715 -11.3687 -11.3558 -11.3534 -6.9821 -6.9787 -6.9222 -6.9106 -6.6842 -6.6736 -6.5898 -6.5842 -6.4403 -6.4254 -6.4119 -6.4099 0.9035 0.9095 1.2042 1.2089 1.2925 1.2950 1.4169 1.4222 1.9525 1.9531 1.9764 1.9766 2.6087 2.6218 2.7119 2.7235 2.7238 2.7310 3.2476 3.2530 3.6169 3.6287 3.6602 3.6740 5.3573 5.4460 5.5245 5.6039 6.0066 6.0184 6.3159 6.3180 6.6344 6.6716 6.6838 6.7343 7.1206 7.1455 7.3653 7.3902 7.4010 7.4569 7.8411 7.8554 11.2710 11.2747 12.5705 12.5728 k = 0.0000 0.0000 0.5354 ( 4386 PWs) bands (ev): -23.1694 -23.1694 -23.1223 -23.1223 -11.8302 -11.8295 -11.6188 -11.6180 -11.3706 -11.3679 -11.3573 -11.3549 -6.9784 -6.9763 -6.9261 -6.9148 -6.6763 -6.6678 -6.5913 -6.5854 -6.4383 -6.4248 -6.4129 -6.4112 0.9172 0.9234 1.1880 1.1936 1.2955 1.2988 1.4093 1.4145 1.9555 1.9560 1.9715 1.9716 2.6325 2.6450 2.7117 2.7235 2.7301 2.7380 3.2103 3.2158 3.6115 3.6234 3.6539 3.6676 5.3644 5.4531 5.5144 5.5948 6.0352 6.0461 6.3275 6.3335 6.6636 6.6874 6.6992 6.7427 7.1495 7.1721 7.3448 7.3723 7.3838 7.4378 7.7997 7.8155 11.3658 11.3697 12.5284 12.5306 k = 0.0000 0.0000 0.5527 ( 4386 PWs) bands (ev): -23.1665 -23.1665 -23.1252 -23.1252 -11.8185 -11.8178 -11.6322 -11.6314 -11.3699 -11.3671 -11.3587 -11.3563 -6.9746 -6.9739 -6.9299 -6.9190 -6.6685 -6.6619 -6.5934 -6.5872 -6.4362 -6.4243 -6.4139 -6.4125 0.9315 0.9378 1.1707 1.1767 1.3003 1.3040 1.4017 1.4068 1.9578 1.9581 1.9676 1.9676 2.6545 2.6664 2.7113 2.7233 2.7387 2.7472 3.1729 3.1786 3.6077 3.6197 3.6479 3.6615 5.3719 5.4605 5.5043 5.5856 6.0636 6.0735 6.3330 6.3414 6.6902 6.6971 6.7248 6.7551 7.1784 7.1963 7.3246 7.3548 7.3706 7.4203 7.7580 7.7754 11.4599 11.4639 12.4836 12.4859 k = 0.0000 0.0000 0.5700 ( 4378 PWs) bands (ev): -23.1636 -23.1636 -23.1280 -23.1280 -11.8064 -11.8057 -11.6458 -11.6449 -11.3691 -11.3664 -11.3599 -11.3575 -6.9713 -6.9708 -6.9336 -6.9231 -6.6607 -6.6559 -6.5960 -6.5897 -6.4342 -6.4237 -6.4149 -6.4138 0.9463 0.9527 1.1527 1.1590 1.3060 1.3101 1.3940 1.3991 1.9594 1.9594 1.9646 1.9647 2.6728 2.6843 2.7109 2.7229 2.7515 2.7605 3.1355 3.1414 3.6053 3.6174 3.6421 3.6556 5.3799 5.4683 5.4942 5.5763 6.0917 6.1004 6.3326 6.3420 6.7083 6.7179 6.7483 6.7704 7.2065 7.2154 7.3048 7.3382 7.3642 7.4057 7.7164 7.7354 11.5528 11.5569 12.4359 12.4383 k = 0.0000 0.0000 0.5872 ( 4370 PWs) bands (ev): -23.1607 -23.1607 -23.1309 -23.1309 -11.7941 -11.7933 -11.6595 -11.6586 -11.3684 -11.3658 -11.3610 -11.3586 -6.9686 -6.9670 -6.9372 -6.9272 -6.6529 -6.6499 -6.5991 -6.5929 -6.4323 -6.4232 -6.4158 -6.4152 0.9616 0.9680 1.1345 1.1410 1.3124 1.3167 1.3864 1.3914 1.9599 1.9601 1.9627 1.9629 2.6860 2.6972 2.7103 2.7224 2.7701 2.7793 3.0984 3.1045 3.6041 3.6163 3.6365 3.6499 5.3882 5.4764 5.4840 5.5670 6.1194 6.1269 6.3270 6.3362 6.7251 6.7405 6.7696 6.7870 7.2267 7.2321 7.2858 7.3227 7.3681 7.3956 7.6750 7.6954 11.6443 11.6484 12.3846 12.3872 k = 0.0000 0.0000 0.6045 ( 4366 PWs) bands (ev): -23.1577 -23.1577 -23.1339 -23.1339 -11.7814 -11.7806 -11.6733 -11.6724 -11.3678 -11.3651 -11.3620 -11.3596 -6.9659 -6.9631 -6.9408 -6.9313 -6.6454 -6.6440 -6.6027 -6.5967 -6.4303 -6.4226 -6.4167 -6.4166 0.9773 0.9838 1.1162 1.1228 1.3192 1.3236 1.3788 1.3837 1.9597 1.9600 1.9618 1.9620 2.6943 2.7055 2.7097 2.7218 2.7942 2.8034 3.0614 3.0679 3.6041 3.6164 3.6311 3.6444 5.3968 5.4739 5.4847 5.5577 6.1467 6.1527 6.3170 6.3251 6.7429 6.7601 6.7887 6.8030 7.2297 7.2530 7.2682 7.3088 7.3831 7.3930 7.6339 7.6558 11.7338 11.7380 12.3292 12.3321 k = 0.0000 0.0000 0.6218 ( 4366 PWs) bands (ev): -23.1547 -23.1547 -23.1368 -23.1368 -11.7685 -11.7676 -11.6871 -11.6862 -11.3672 -11.3645 -11.3629 -11.3605 -6.9631 -6.9592 -6.9442 -6.9353 -6.6381 -6.6380 -6.6068 -6.6011 -6.4284 -6.4220 -6.4181 -6.4175 0.9935 1.0001 1.0980 1.1046 1.3262 1.3308 1.3711 1.3760 1.9593 1.9596 1.9614 1.9615 2.6994 2.7090 2.7107 2.7211 2.8222 2.8312 3.0249 3.0317 3.6051 3.6175 3.6261 3.6392 5.4057 5.4638 5.4933 5.5483 6.1733 6.1779 6.3034 6.3099 6.7601 6.7758 6.8052 6.8165 7.2276 7.2525 7.2666 7.2971 7.4010 7.4068 7.5936 7.6166 11.8210 11.8251 12.2696 12.2727 k = 0.0000 0.0000 0.6391 ( 4370 PWs) bands (ev): -23.1517 -23.1517 -23.1398 -23.1398 -11.7553 -11.7544 -11.7009 -11.7000 -11.3665 -11.3640 -11.3636 -11.3613 -6.9602 -6.9553 -6.9476 -6.9394 -6.6323 -6.6309 -6.6113 -6.6061 -6.4266 -6.4213 -6.4197 -6.4184 1.0101 1.0167 1.0799 1.0865 1.3335 1.3381 1.3635 1.3683 1.9592 1.9594 1.9610 1.9610 2.7026 2.7082 2.7141 2.7202 2.8528 2.8614 2.9888 2.9960 3.6070 3.6195 3.6213 3.6343 5.4149 5.4537 5.5021 5.5388 6.1993 6.2022 6.2870 6.2916 6.7749 6.7867 6.8186 6.8265 7.2243 7.2396 7.2729 7.2879 7.4201 7.4361 7.5541 7.5780 11.9053 11.9093 12.2054 12.2087 k = 0.0000 0.0000 0.6563 ( 4374 PWs) bands (ev): -23.1488 -23.1488 -23.1428 -23.1428 -11.7419 -11.7410 -11.7147 -11.7138 -11.3659 -11.3645 -11.3633 -11.3620 -6.9572 -6.9514 -6.9509 -6.9434 -6.6267 -6.6241 -6.6161 -6.6117 -6.4248 -6.4213 -6.4206 -6.4192 1.0270 1.0337 1.0620 1.0687 1.3409 1.3455 1.3559 1.3607 1.9594 1.9596 1.9605 1.9605 2.7047 2.7073 2.7163 2.7192 2.8851 2.8934 2.9534 2.9609 3.6097 3.6169 3.6223 3.6298 5.4243 5.4437 5.5111 5.5294 6.2244 6.2255 6.2682 6.2708 6.7859 6.7922 6.8279 6.8319 7.2228 7.2301 7.2754 7.2814 7.4475 7.4689 7.5161 7.5403 11.9863 11.9902 12.1367 12.1402 k = 0.0000 0.0000 0.6736 ( 4380 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7284 -11.7284 -11.7274 -11.7274 -11.3652 -11.3652 -11.3627 -11.3627 -6.9541 -6.9541 -6.9474 -6.9474 -6.6213 -6.6213 -6.6177 -6.6177 -6.4230 -6.4230 -6.4199 -6.4199 1.0444 1.0444 1.0510 1.0510 1.3483 1.3483 1.3531 1.3531 1.9598 1.9598 1.9601 1.9601 2.7062 2.7062 2.7180 2.7180 2.9188 2.9188 2.9266 2.9266 3.6130 3.6130 3.6258 3.6258 5.4339 5.4339 5.5202 5.5202 6.2476 6.2476 6.2483 6.2483 6.7919 6.7919 6.8324 6.8324 7.2244 7.2244 7.2775 7.2775 7.4802 7.4802 7.5038 7.5038 12.0635 12.0635 12.0673 12.0673 k = 0.0000 0.0000 0.6736 ( 4380 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7284 -11.7284 -11.7274 -11.7274 -11.3652 -11.3652 -11.3627 -11.3627 -6.9541 -6.9541 -6.9474 -6.9474 -6.6213 -6.6213 -6.6177 -6.6177 -6.4230 -6.4230 -6.4199 -6.4199 1.0444 1.0444 1.0510 1.0510 1.3483 1.3483 1.3531 1.3531 1.9598 1.9598 1.9601 1.9601 2.7062 2.7062 2.7180 2.7180 2.9188 2.9188 2.9266 2.9266 3.6130 3.6130 3.6258 3.6258 5.4339 5.4339 5.5202 5.5202 6.2476 6.2476 6.2483 6.2483 6.7919 6.7919 6.8324 6.8324 7.2244 7.2244 7.2775 7.2775 7.4802 7.4802 7.5038 7.5038 12.0635 12.0635 12.0673 12.0673 k =-0.0128 0.0115 0.6736 ( 4378 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7284 -11.7284 -11.7274 -11.7274 -11.3653 -11.3653 -11.3627 -11.3627 -6.9542 -6.9542 -6.9470 -6.9470 -6.6242 -6.6242 -6.6149 -6.6149 -6.4251 -6.4251 -6.4179 -6.4179 1.0432 1.0432 1.0499 1.0499 1.3492 1.3492 1.3540 1.3540 1.9598 1.9599 1.9602 1.9603 2.7059 2.7059 2.7178 2.7178 2.9193 2.9193 2.9274 2.9274 3.6126 3.6126 3.6254 3.6254 5.4347 5.4347 5.5209 5.5209 6.2457 6.2457 6.2485 6.2485 6.7918 6.7918 6.8323 6.8323 7.2241 7.2241 7.2769 7.2769 7.4807 7.4807 7.5047 7.5047 12.0639 12.0639 12.0677 12.0677 k =-0.0256 0.0231 0.6736 ( 4378 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7284 -11.7283 -11.7274 -11.7273 -11.3655 -11.3655 -11.3629 -11.3629 -6.9545 -6.9545 -6.9459 -6.9459 -6.6286 -6.6286 -6.6109 -6.6109 -6.4281 -6.4281 -6.4148 -6.4148 1.0397 1.0397 1.0464 1.0464 1.3518 1.3518 1.3566 1.3566 1.9601 1.9602 1.9608 1.9609 2.7051 2.7051 2.7173 2.7174 2.9208 2.9209 2.9297 2.9298 3.6114 3.6114 3.6242 3.6242 5.4369 5.4369 5.5231 5.5231 6.2419 6.2419 6.2472 6.2472 6.7917 6.7917 6.8319 6.8319 7.2228 7.2228 7.2751 7.2751 7.4822 7.4822 7.5074 7.5074 12.0652 12.0652 12.0690 12.0690 k =-0.0383 0.0346 0.6736 ( 4368 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7283 -11.7283 -11.7272 -11.7271 -11.3658 -11.3658 -11.3632 -11.3631 -6.9547 -6.9547 -6.9443 -6.9443 -6.6331 -6.6331 -6.6070 -6.6070 -6.4311 -6.4311 -6.4116 -6.4116 1.0341 1.0342 1.0408 1.0408 1.3560 1.3561 1.3608 1.3609 1.9606 1.9607 1.9616 1.9617 2.7038 2.7039 2.7165 2.7166 2.9235 2.9236 2.9335 2.9335 3.6094 3.6094 3.6223 3.6223 5.4406 5.4406 5.5268 5.5268 6.2365 6.2365 6.2443 6.2443 6.7914 6.7914 6.8313 6.8313 7.2209 7.2209 7.2722 7.2722 7.4847 7.4847 7.5117 7.5117 12.0672 12.0672 12.0710 12.0710 k =-0.0511 0.0462 0.6736 ( 4368 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7282 -11.7281 -11.7270 -11.7269 -11.3663 -11.3662 -11.3636 -11.3635 -6.9548 -6.9548 -6.9422 -6.9422 -6.6377 -6.6376 -6.6033 -6.6033 -6.4341 -6.4341 -6.4085 -6.4085 1.0266 1.0266 1.0332 1.0333 1.3616 1.3616 1.3664 1.3665 1.9614 1.9615 1.9627 1.9628 2.7021 2.7022 2.7154 2.7155 2.9273 2.9274 2.9385 2.9386 3.6067 3.6067 3.6196 3.6196 5.4457 5.4457 5.5319 5.5319 6.2295 6.2296 6.2397 6.2397 6.7910 6.7910 6.8303 6.8303 7.2183 7.2183 7.2684 7.2684 7.4882 7.4882 7.5172 7.5173 12.0700 12.0700 12.0739 12.0739 k =-0.0639 0.0577 0.6736 ( 4370 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7281 -11.7280 -11.7268 -11.7267 -11.3668 -11.3668 -11.3641 -11.3641 -6.9547 -6.9547 -6.9399 -6.9398 -6.6423 -6.6423 -6.5997 -6.5997 -6.4370 -6.4370 -6.4054 -6.4053 1.0174 1.0174 1.0240 1.0240 1.3683 1.3684 1.3732 1.3732 1.9624 1.9625 1.9640 1.9641 2.7001 2.7001 2.7139 2.7140 2.9322 2.9323 2.9446 2.9447 3.6033 3.6034 3.6163 3.6163 5.4522 5.4522 5.5383 5.5383 6.2212 6.2212 6.2334 6.2335 6.7903 6.7903 6.8287 6.8287 7.2154 7.2154 7.2639 7.2639 7.4927 7.4927 7.5239 7.5239 12.0736 12.0736 12.0775 12.0775 k =-0.0767 0.0692 0.6736 ( 4370 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7279 -11.7277 -11.7264 -11.7263 -11.3676 -11.3675 -11.3648 -11.3647 -6.9544 -6.9544 -6.9372 -6.9372 -6.6469 -6.6469 -6.5964 -6.5964 -6.4397 -6.4397 -6.4023 -6.4023 1.0068 1.0068 1.0133 1.0133 1.3759 1.3760 1.3808 1.3809 1.9635 1.9637 1.9655 1.9656 2.6977 2.6978 2.7123 2.7124 2.9381 2.9382 2.9518 2.9519 3.5994 3.5995 3.6125 3.6125 5.4600 5.4600 5.5460 5.5460 6.2115 6.2116 6.2257 6.2257 6.7893 6.7893 6.8264 6.8264 7.2122 7.2122 7.2589 7.2589 7.4980 7.4980 7.5314 7.5314 12.0779 12.0779 12.0818 12.0818 k =-0.0895 0.0808 0.6736 ( 4370 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7276 -11.7274 -11.7260 -11.7259 -11.3685 -11.3684 -11.3656 -11.3655 -6.9539 -6.9539 -6.9342 -6.9342 -6.6516 -6.6516 -6.5933 -6.5933 -6.4423 -6.4423 -6.3993 -6.3993 0.9950 0.9950 1.0014 1.0015 1.3843 1.3844 1.3891 1.3892 1.9649 1.9650 1.9672 1.9673 2.6952 2.6953 2.7104 2.7105 2.9450 2.9451 2.9599 2.9600 3.5950 3.5951 3.6082 3.6082 5.4690 5.4690 5.5549 5.5549 6.2007 6.2007 6.2165 6.2165 6.7880 6.7880 6.8234 6.8234 7.2089 7.2089 7.2536 7.2536 7.5040 7.5040 7.5396 7.5397 12.0828 12.0828 12.0867 12.0867 k =-0.1023 0.0923 0.6736 ( 4358 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7272 -11.7270 -11.7255 -11.7254 -11.3695 -11.3695 -11.3666 -11.3665 -6.9532 -6.9532 -6.9311 -6.9311 -6.6561 -6.6561 -6.5904 -6.5904 -6.4447 -6.4447 -6.3965 -6.3965 0.9823 0.9824 0.9886 0.9887 1.3931 1.3932 1.3979 1.3979 1.9664 1.9665 1.9690 1.9691 2.6926 2.6927 2.7083 2.7085 2.9527 2.9527 2.9687 2.9688 3.5903 3.5904 3.6036 3.6036 5.4791 5.4791 5.5649 5.5649 6.1888 6.1888 6.2059 6.2060 6.7861 6.7861 6.8196 6.8196 7.2057 7.2057 7.2485 7.2485 7.5107 7.5107 7.5484 7.5484 12.0884 12.0884 12.0922 12.0922 k =-0.1150 0.1038 0.6736 ( 4362 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7267 -11.7265 -11.7249 -11.7248 -11.3708 -11.3707 -11.3677 -11.3677 -6.9522 -6.9522 -6.9277 -6.9277 -6.6607 -6.6607 -6.5878 -6.5878 -6.4469 -6.4469 -6.3937 -6.3937 0.9689 0.9689 0.9751 0.9751 1.4023 1.4023 1.4069 1.4070 1.9680 1.9681 1.9710 1.9711 2.6898 2.6899 2.7062 2.7063 2.9611 2.9611 2.9782 2.9783 3.5854 3.5855 3.5987 3.5988 5.4902 5.4902 5.5758 5.5758 6.1760 6.1760 6.1942 6.1942 6.7836 6.7836 6.8146 6.8147 7.2027 7.2028 7.2436 7.2436 7.5177 7.5177 7.5573 7.5573 12.0944 12.0944 12.0982 12.0982 k =-0.1278 0.1154 0.6736 ( 4362 PWs) bands (ev): -23.1456 -23.1456 -23.1456 -23.1456 -11.7260 -11.7259 -11.7242 -11.7240 -11.3722 -11.3721 -11.3691 -11.3690 -6.9511 -6.9511 -6.9242 -6.9242 -6.6651 -6.6651 -6.5854 -6.5854 -6.4488 -6.4488 -6.3911 -6.3911 0.9549 0.9549 0.9609 0.9610 1.4115 1.4116 1.4161 1.4161 1.9697 1.9698 1.9730 1.9731 2.6871 2.6872 2.7040 2.7041 2.9700 2.9701 2.9881 2.9882 3.5805 3.5806 3.5939 3.5939 5.5023 5.5023 5.5877 5.5877 6.1622 6.1623 6.1813 6.1813 6.7805 6.7805 6.8088 6.8088 7.2000 7.2001 7.2392 7.2392 7.5250 7.5250 7.5664 7.5665 12.1009 12.1009 12.1046 12.1046 k =-0.1406 0.1269 0.6736 ( 4364 PWs) bands (ev): -23.1456 -23.1456 -23.1456 -23.1456 -11.7253 -11.7251 -11.7233 -11.7232 -11.3738 -11.3737 -11.3706 -11.3706 -6.9498 -6.9498 -6.9206 -6.9206 -6.6693 -6.6693 -6.5834 -6.5834 -6.4504 -6.4504 -6.3886 -6.3886 0.9405 0.9405 0.9464 0.9465 1.4208 1.4209 1.4253 1.4253 1.9714 1.9715 1.9751 1.9752 2.6844 2.6845 2.7018 2.7018 2.9793 2.9794 2.9983 2.9983 3.5757 3.5758 3.5892 3.5892 5.5151 5.5151 5.6003 5.6003 6.1478 6.1478 6.1675 6.1675 6.7766 6.7766 6.8018 6.8018 7.1977 7.1977 7.2355 7.2355 7.5326 7.5326 7.5756 7.5756 12.1077 12.1077 12.1113 12.1113 k =-0.1534 0.1385 0.6736 ( 4364 PWs) bands (ev): -23.1456 -23.1456 -23.1456 -23.1456 -11.7244 -11.7242 -11.7223 -11.7221 -11.3756 -11.3756 -11.3724 -11.3723 -6.9483 -6.9483 -6.9168 -6.9168 -6.6734 -6.6734 -6.5817 -6.5817 -6.4518 -6.4518 -6.3863 -6.3863 0.9258 0.9259 0.9316 0.9316 1.4301 1.4302 1.4344 1.4345 1.9731 1.9732 1.9772 1.9773 2.6818 2.6819 2.6996 2.6997 2.9889 2.9889 3.0086 3.0086 3.5713 3.5713 3.5847 3.5848 5.5285 5.5285 5.6135 5.6135 6.1326 6.1327 6.1528 6.1528 6.7719 6.7719 6.7938 6.7938 7.1957 7.1957 7.2326 7.2327 7.5402 7.5402 7.5848 7.5848 12.1147 12.1147 12.1182 12.1182 k =-0.1662 0.1500 0.6736 ( 4368 PWs) bands (ev): -23.1456 -23.1456 -23.1456 -23.1456 -11.7233 -11.7232 -11.7211 -11.7210 -11.3777 -11.3777 -11.3744 -11.3743 -6.9467 -6.9467 -6.9130 -6.9130 -6.6772 -6.6772 -6.5802 -6.5802 -6.4529 -6.4529 -6.3841 -6.3841 0.9110 0.9111 0.9166 0.9166 1.4393 1.4393 1.4434 1.4435 1.9747 1.9748 1.9791 1.9792 2.6794 2.6795 2.6976 2.6976 2.9985 2.9985 3.0189 3.0189 3.5673 3.5673 3.5808 3.5808 5.5425 5.5425 5.6273 5.6273 6.1170 6.1170 6.1374 6.1374 6.7663 6.7663 6.7848 6.7848 7.1940 7.1941 7.2308 7.2308 7.5477 7.5477 7.5937 7.5937 12.1218 12.1219 12.1251 12.1252 k =-0.1789 0.1615 0.6736 ( 4360 PWs) bands (ev): -23.1455 -23.1455 -23.1455 -23.1455 -11.7220 -11.7219 -11.7198 -11.7196 -11.3800 -11.3799 -11.3766 -11.3766 -6.9450 -6.9450 -6.9091 -6.9091 -6.6808 -6.6808 -6.5791 -6.5791 -6.4536 -6.4536 -6.3821 -6.3821 0.8962 0.8963 0.9016 0.9016 1.4482 1.4483 1.4522 1.4523 1.9762 1.9763 1.9810 1.9810 2.6772 2.6773 2.6957 2.6958 3.0080 3.0080 3.0289 3.0289 3.5640 3.5641 3.5775 3.5775 5.5570 5.5570 5.6414 5.6414 6.1008 6.1008 6.1215 6.1215 6.7598 6.7598 6.7751 6.7751 7.1929 7.1929 7.2300 7.2300 7.5552 7.5552 7.6024 7.6024 12.1290 12.1290 12.1321 12.1321 k =-0.1917 0.1731 0.6736 ( 4358 PWs) bands (ev): -23.1455 -23.1455 -23.1455 -23.1455 -11.7206 -11.7204 -11.7182 -11.7181 -11.3825 -11.3825 -11.3791 -11.3791 -6.9431 -6.9431 -6.9053 -6.9053 -6.6841 -6.6841 -6.5783 -6.5783 -6.4540 -6.4540 -6.3802 -6.3802 0.8814 0.8815 0.8866 0.8866 1.4569 1.4570 1.4608 1.4609 1.9776 1.9777 1.9826 1.9827 2.6753 2.6753 2.6940 2.6941 3.0170 3.0170 3.0384 3.0384 3.5616 3.5617 3.5750 3.5751 5.5717 5.5717 5.6558 5.6558 6.0843 6.0843 6.1051 6.1051 6.7522 6.7522 6.7647 6.7647 7.1922 7.1923 7.2303 7.2303 7.5624 7.5624 7.6108 7.6108 12.1360 12.1360 12.1389 12.1389 k =-0.2045 0.1846 0.6736 ( 4362 PWs) bands (ev): -23.1455 -23.1455 -23.1455 -23.1455 -11.7189 -11.7188 -11.7165 -11.7164 -11.3853 -11.3853 -11.3819 -11.3818 -6.9411 -6.9411 -6.9016 -6.9016 -6.6870 -6.6870 -6.5778 -6.5778 -6.4540 -6.4540 -6.3785 -6.3785 0.8667 0.8668 0.8717 0.8717 1.4654 1.4655 1.4691 1.4692 1.9787 1.9788 1.9841 1.9842 2.6736 2.6737 2.6927 2.6927 3.0255 3.0256 3.0472 3.0472 3.5603 3.5604 3.5736 3.5736 5.5865 5.5865 5.6703 5.6703 6.0674 6.0674 6.0884 6.0884 6.7434 6.7434 6.7539 6.7539 7.1922 7.1922 7.2316 7.2316 7.5693 7.5694 7.6187 7.6187 12.1428 12.1428 12.1454 12.1454 k =-0.2173 0.1962 0.6736 ( 4362 PWs) bands (ev): -23.1454 -23.1454 -23.1454 -23.1454 -11.7171 -11.7169 -11.7146 -11.7144 -11.3883 -11.3883 -11.3848 -11.3848 -6.9391 -6.9391 -6.8980 -6.8980 -6.6895 -6.6895 -6.5776 -6.5776 -6.4537 -6.4537 -6.3770 -6.3770 0.8522 0.8523 0.8569 0.8570 1.4736 1.4737 1.4772 1.4773 1.9796 1.9797 1.9853 1.9854 2.6724 2.6724 2.6916 2.6916 3.0333 3.0333 3.0551 3.0551 3.5603 3.5603 3.5733 3.5734 5.6013 5.6013 5.6847 5.6847 6.0504 6.0504 6.0716 6.0716 6.7331 6.7331 6.7431 6.7431 7.1928 7.1928 7.2339 7.2339 7.5759 7.5759 7.6261 7.6261 12.1492 12.1492 12.1516 12.1516 k =-0.2301 0.2077 0.6736 ( 4362 PWs) bands (ev): -23.1454 -23.1454 -23.1454 -23.1454 -11.7150 -11.7149 -11.7124 -11.7123 -11.3916 -11.3915 -11.3881 -11.3880 -6.9369 -6.9369 -6.8946 -6.8946 -6.6916 -6.6916 -6.5777 -6.5777 -6.4531 -6.4531 -6.3758 -6.3757 0.8380 0.8380 0.8425 0.8425 1.4815 1.4815 1.4850 1.4851 1.9803 1.9804 1.9862 1.9863 2.6715 2.6715 2.6908 2.6909 3.0401 3.0401 3.0620 3.0620 3.5617 3.5617 3.5744 3.5745 5.6160 5.6160 5.6988 5.6988 6.0333 6.0333 6.0549 6.0549 6.7216 6.7216 6.7323 6.7323 7.1941 7.1941 7.2370 7.2370 7.5820 7.5820 7.6330 7.6330 12.1552 12.1552 12.1573 12.1573 k =-0.2428 0.2192 0.6736 ( 4358 PWs) bands (ev): -23.1454 -23.1454 -23.1454 -23.1454 -11.7127 -11.7126 -11.7101 -11.7100 -11.3951 -11.3951 -11.3916 -11.3915 -6.9347 -6.9347 -6.8914 -6.8914 -6.6932 -6.6932 -6.5781 -6.5781 -6.4521 -6.4521 -6.3746 -6.3746 0.8240 0.8241 0.8283 0.8284 1.4891 1.4891 1.4925 1.4926 1.9806 1.9807 1.9867 1.9868 2.6711 2.6711 2.6905 2.6905 3.0458 3.0459 3.0677 3.0677 3.5645 3.5645 3.5770 3.5770 5.6303 5.6304 5.7124 5.7124 6.0163 6.0163 6.0385 6.0385 6.7091 6.7091 6.7216 6.7216 7.1961 7.1961 7.2409 7.2409 7.5876 7.5876 7.6392 7.6392 12.1606 12.1606 12.1625 12.1625 k =-0.2556 0.2308 0.6736 ( 4352 PWs) bands (ev): -23.1453 -23.1453 -23.1453 -23.1453 -11.7102 -11.7100 -11.7075 -11.7074 -11.3989 -11.3988 -11.3953 -11.3953 -6.9325 -6.9325 -6.8885 -6.8885 -6.6944 -6.6943 -6.5788 -6.5788 -6.4508 -6.4508 -6.3737 -6.3737 0.8104 0.8105 0.8145 0.8146 1.4964 1.4964 1.4997 1.4998 1.9807 1.9808 1.9870 1.9871 2.6711 2.6712 2.6905 2.6905 3.0504 3.0504 3.0720 3.0720 3.5690 3.5690 3.5811 3.5811 5.6442 5.6442 5.7253 5.7253 5.9997 5.9997 6.0225 6.0225 6.6959 6.6959 6.7106 6.7106 7.1990 7.1990 7.2456 7.2456 7.5926 7.5927 7.6447 7.6447 12.1654 12.1654 12.1672 12.1672 k =-0.2684 0.2423 0.6736 ( 4356 PWs) bands (ev): -23.1453 -23.1453 -23.1453 -23.1453 -11.7074 -11.7073 -11.7048 -11.7046 -11.4028 -11.4028 -11.3993 -11.3992 -6.9303 -6.9303 -6.8859 -6.8859 -6.6949 -6.6949 -6.5798 -6.5798 -6.4492 -6.4492 -6.3730 -6.3730 0.7973 0.7973 0.8011 0.8011 1.5033 1.5034 1.5067 1.5067 1.9804 1.9805 1.9868 1.9869 2.6717 2.6717 2.6910 2.6910 3.0536 3.0536 3.0749 3.0749 3.5750 3.5750 3.5866 3.5866 5.6572 5.6572 5.7371 5.7371 5.9837 5.9837 6.0072 6.0073 6.6824 6.6824 6.6993 6.6993 7.2027 7.2027 7.2508 7.2508 7.5971 7.5971 7.6494 7.6494 12.1695 12.1696 12.1712 12.1713 k =-0.2812 0.2538 0.6736 ( 4360 PWs) bands (ev): -23.1453 -23.1453 -23.1453 -23.1453 -11.7045 -11.7044 -11.7018 -11.7017 -11.4070 -11.4070 -11.4035 -11.4034 -6.9281 -6.9281 -6.8837 -6.8837 -6.6950 -6.6950 -6.5810 -6.5810 -6.4474 -6.4474 -6.3725 -6.3725 0.7845 0.7846 0.7881 0.7882 1.5100 1.5100 1.5133 1.5134 1.9798 1.9799 1.9863 1.9864 2.6727 2.6727 2.6919 2.6919 3.0555 3.0555 3.0764 3.0764 3.5825 3.5825 3.5937 3.5937 5.6692 5.6692 5.7473 5.7473 5.9688 5.9688 5.9931 5.9931 6.6687 6.6687 6.6877 6.6877 7.2071 7.2071 7.2566 7.2566 7.6008 7.6008 7.6533 7.6533 12.1730 12.1730 12.1747 12.1747 k =-0.2940 0.2654 0.6736 ( 4360 PWs) bands (ev): -23.1453 -23.1453 -23.1453 -23.1453 -11.7013 -11.7012 -11.6986 -11.6985 -11.4114 -11.4113 -11.4079 -11.4078 -6.9258 -6.9258 -6.8818 -6.8818 -6.6944 -6.6944 -6.5825 -6.5825 -6.4452 -6.4452 -6.3722 -6.3722 0.7723 0.7724 0.7757 0.7757 1.5164 1.5164 1.5196 1.5197 1.9789 1.9789 1.9854 1.9855 2.6743 2.6743 2.6933 2.6933 3.0561 3.0562 3.0765 3.0766 3.5914 3.5915 3.6021 3.6021 5.6799 5.6799 5.7556 5.7556 5.9553 5.9553 5.9803 5.9803 6.6550 6.6550 6.6759 6.6759 7.2124 7.2124 7.2629 7.2630 7.6040 7.6040 7.6564 7.6564 12.1759 12.1759 12.1776 12.1776 k =-0.3068 0.2769 0.6736 ( 4360 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6980 -11.6979 -11.6953 -11.6952 -11.4159 -11.4159 -11.4125 -11.4124 -6.9236 -6.9236 -6.8804 -6.8804 -6.6933 -6.6933 -6.5843 -6.5843 -6.4429 -6.4429 -6.3721 -6.3721 0.7606 0.7607 0.7638 0.7638 1.5224 1.5225 1.5257 1.5257 1.9776 1.9777 1.9841 1.9842 2.6763 2.6764 2.6951 2.6951 3.0556 3.0556 3.0753 3.0754 3.6016 3.6017 3.6118 3.6118 5.6889 5.6889 5.7613 5.7613 5.9440 5.9440 5.9693 5.9694 6.6414 6.6414 6.6639 6.6639 7.2184 7.2184 7.2697 7.2697 7.6065 7.6065 7.6587 7.6587 12.1781 12.1781 12.1800 12.1800 k =-0.3068 0.2769 0.6736 ( 4360 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6980 -11.6979 -11.6953 -11.6952 -11.4159 -11.4159 -11.4125 -11.4124 -6.9236 -6.9236 -6.8804 -6.8804 -6.6933 -6.6933 -6.5843 -6.5843 -6.4429 -6.4429 -6.3721 -6.3721 0.7606 0.7607 0.7638 0.7638 1.5224 1.5225 1.5257 1.5257 1.9776 1.9777 1.9841 1.9842 2.6763 2.6764 2.6951 2.6951 3.0556 3.0556 3.0753 3.0754 3.6016 3.6017 3.6118 3.6118 5.6889 5.6889 5.7613 5.7613 5.9440 5.9440 5.9693 5.9694 6.6414 6.6414 6.6639 6.6639 7.2184 7.2184 7.2697 7.2697 7.6065 7.6065 7.6587 7.6587 12.1781 12.1781 12.1800 12.1800 k =-0.3155 0.2849 0.6618 ( 4362 PWs) bands (ev): -23.1463 -23.1463 -23.1441 -23.1441 -11.7017 -11.7007 -11.6877 -11.6867 -11.4205 -11.4187 -11.4158 -11.4142 -6.9239 -6.9204 -6.8807 -6.8784 -6.6937 -6.6911 -6.5859 -6.5850 -6.4415 -6.4408 -6.3734 -6.3708 0.7475 0.7502 0.7589 0.7619 1.5237 1.5265 1.5295 1.5323 1.9699 1.9735 1.9865 1.9903 2.6618 2.6793 2.6948 2.7131 3.0460 3.0605 3.0687 3.0822 3.5931 3.5983 3.6300 3.6344 5.6869 5.7006 5.7572 5.7689 5.9241 5.9404 5.9619 5.9767 6.6195 6.6336 6.6552 6.6677 7.2071 7.2377 7.2587 7.2906 7.5929 7.6218 7.6465 7.6737 12.1616 12.1633 12.1969 12.1989 k =-0.3243 0.2928 0.6499 ( 4360 PWs) bands (ev): -23.1473 -23.1473 -23.1430 -23.1430 -11.7058 -11.7048 -11.6789 -11.6778 -11.4254 -11.4232 -11.4176 -11.4157 -6.9242 -6.9174 -6.8810 -6.8766 -6.6943 -6.6889 -6.5875 -6.5856 -6.4401 -6.4389 -6.3748 -6.3697 0.7354 0.7379 0.7572 0.7601 1.5248 1.5277 1.5355 1.5384 1.9618 1.9655 1.9931 1.9971 2.6477 2.6648 2.7126 2.7311 3.0351 3.0526 3.0740 3.0897 3.5829 3.5885 3.6544 3.6584 5.6831 5.7110 5.7504 5.7744 5.9069 5.9273 5.9678 5.9854 6.5971 6.6148 6.6579 6.6729 7.1962 7.2441 7.2607 7.3108 7.5796 7.6274 7.6430 7.6880 12.1466 12.1482 12.2134 12.2157 k =-0.3331 0.3007 0.6381 ( 4357 PWs) bands (ev): -23.1482 -23.1482 -23.1421 -23.1421 -11.7095 -11.7085 -11.6704 -11.6692 -11.4303 -11.4279 -11.4189 -11.4170 -6.9245 -6.9147 -6.8813 -6.8750 -6.6948 -6.6868 -6.5889 -6.5860 -6.4386 -6.4372 -6.3763 -6.3688 0.7245 0.7267 0.7557 0.7585 1.5260 1.5288 1.5410 1.5439 1.9542 1.9578 1.9996 2.0038 2.6342 2.6509 2.7304 2.7489 3.0234 3.0412 3.0823 3.0976 3.5729 3.5788 3.6780 3.6816 5.6776 5.7200 5.7407 5.7775 5.8945 5.9171 5.9754 5.9937 6.5759 6.5955 6.6619 6.6781 7.1860 7.2346 7.2786 7.3302 7.5666 7.6169 7.6544 7.7010 12.1331 12.1347 12.2280 12.2305 k =-0.3419 0.3086 0.6263 ( 4355 PWs) bands (ev): -23.1490 -23.1490 -23.1413 -23.1413 -11.7127 -11.7119 -11.6624 -11.6612 -11.4352 -11.4326 -11.4199 -11.4181 -6.9248 -6.9123 -6.8815 -6.8736 -6.6955 -6.6848 -6.5902 -6.5863 -6.4371 -6.4356 -6.3779 -6.3679 0.7149 0.7168 0.7542 0.7570 1.5270 1.5298 1.5459 1.5487 1.9472 1.9507 2.0058 2.0102 2.6217 2.6381 2.7480 2.7663 3.0112 3.0289 3.0906 3.1053 3.5634 3.5696 3.7001 3.7034 5.6705 5.7246 5.7315 5.7782 5.8870 5.9113 5.9828 6.0012 6.5561 6.5774 6.6658 6.6831 7.1765 7.2249 7.2969 7.3486 7.5543 7.6045 7.6663 7.7128 12.1211 12.1226 12.2410 12.2435 k =-0.3507 0.3166 0.6144 ( 4355 PWs) bands (ev): -23.1497 -23.1497 -23.1405 -23.1405 -11.7156 -11.7148 -11.6551 -11.6538 -11.4398 -11.4371 -11.4208 -11.4191 -6.9251 -6.9102 -6.8816 -6.8724 -6.6961 -6.6830 -6.5914 -6.5865 -6.4357 -6.4342 -6.3794 -6.3672 0.7064 0.7081 0.7530 0.7558 1.5280 1.5307 1.5501 1.5529 1.9410 1.9444 2.0116 2.0161 2.6103 2.6264 2.7653 2.7832 2.9987 3.0161 3.0985 3.1128 3.5545 3.5610 3.7203 3.7233 5.6624 5.7133 5.7356 5.7772 5.8834 5.9093 5.9898 6.0079 6.5382 6.5609 6.6693 6.6876 7.1679 7.2160 7.3144 7.3656 7.5426 7.5919 7.6771 7.7231 12.1106 12.1121 12.2523 12.2549 k =-0.3595 0.3245 0.6026 ( 4351 PWs) bands (ev): -23.1503 -23.1503 -23.1399 -23.1399 -11.7180 -11.7173 -11.6485 -11.6471 -11.4441 -11.4412 -11.4216 -11.4199 -6.9254 -6.9084 -6.8817 -6.8715 -6.6966 -6.6814 -6.5924 -6.5867 -6.4344 -6.4329 -6.3808 -6.3666 0.6993 0.7008 0.7519 0.7547 1.5289 1.5315 1.5537 1.5565 1.9357 1.9389 2.0167 2.0214 2.6004 2.6163 2.7820 2.7993 2.9863 3.0031 3.1058 3.1196 3.5466 3.5532 3.7382 3.7410 5.6538 5.6996 5.7409 5.7754 5.8825 5.9099 5.9961 6.0135 6.5224 6.5465 6.6723 6.6916 7.1605 7.2082 7.3312 7.3809 7.5321 7.5794 7.6863 7.7320 12.1018 12.1032 12.2620 12.2647 k =-0.3682 0.3324 0.5908 ( 4359 PWs) bands (ev): -23.1508 -23.1508 -23.1394 -23.1394 -11.7201 -11.7193 -11.6428 -11.6414 -11.4479 -11.4449 -11.4222 -11.4206 -6.9256 -6.9070 -6.8817 -6.8708 -6.6972 -6.6801 -6.5933 -6.5867 -6.4331 -6.4319 -6.3821 -6.3661 0.6934 0.6946 0.7510 0.7537 1.5297 1.5322 1.5566 1.5594 1.9312 1.9343 2.0211 2.0259 2.5919 2.6077 2.7979 2.8140 2.9744 2.9901 3.1122 3.1256 3.5397 3.5465 3.7533 3.7561 5.6454 5.6869 5.7453 5.7732 5.8831 5.9119 6.0017 6.0180 6.5090 6.5342 6.6748 6.6950 7.1542 7.2016 7.3468 7.3939 7.5232 7.5670 7.6940 7.7393 12.0945 12.0959 12.2701 12.2729 k =-0.3770 0.3404 0.5789 ( 4357 PWs) bands (ev): -23.1512 -23.1512 -23.1390 -23.1390 -11.7216 -11.7209 -11.6382 -11.6367 -11.4510 -11.4479 -11.4227 -11.4211 -6.9258 -6.9059 -6.8816 -6.8702 -6.6976 -6.6790 -6.5940 -6.5868 -6.4321 -6.4311 -6.3832 -6.3658 0.6889 0.6899 0.7503 0.7530 1.5303 1.5328 1.5589 1.5617 1.9277 1.9306 2.0247 2.0296 2.5852 2.6008 2.8126 2.8269 2.9638 2.9777 3.1175 3.1306 3.5341 3.5411 3.7655 3.7681 5.6380 5.6762 5.7488 5.7711 5.8845 5.9142 6.0065 6.0214 6.4983 6.5244 6.6768 6.6978 7.1492 7.1964 7.3610 7.4039 7.5168 7.5550 7.6999 7.7450 12.0888 12.0902 12.2765 12.2794 k =-0.3858 0.3483 0.5671 ( 4363 PWs) bands (ev): -23.1515 -23.1515 -23.1387 -23.1387 -11.7227 -11.7220 -11.6348 -11.6332 -11.4534 -11.4502 -11.4230 -11.4215 -6.9260 -6.9052 -6.8815 -6.8698 -6.6979 -6.6782 -6.5945 -6.5868 -6.4313 -6.4306 -6.3840 -6.3655 0.6856 0.6864 0.7498 0.7525 1.5307 1.5332 1.5605 1.5633 1.9252 1.9279 2.0273 2.0323 2.5803 2.5958 2.8256 2.8366 2.9556 2.9664 3.1214 3.1343 3.5300 3.5370 3.7743 3.7770 5.6323 5.6680 5.7514 5.7694 5.8860 5.9163 6.0101 6.0236 6.4904 6.5172 6.6782 6.6998 7.1455 7.1925 7.3733 7.4099 7.5138 7.5438 7.7042 7.7491 12.0847 12.0862 12.2812 12.2841 k =-0.3946 0.3562 0.5553 ( 4365 PWs) bands (ev): -23.1517 -23.1517 -23.1386 -23.1386 -11.7234 -11.7227 -11.6327 -11.6311 -11.4549 -11.4517 -11.4232 -11.4218 -6.9261 -6.9047 -6.8815 -6.8696 -6.6981 -6.6777 -6.5948 -6.5868 -6.4308 -6.4302 -6.3846 -6.3654 0.6837 0.6843 0.7494 0.7521 1.5310 1.5335 1.5615 1.5643 1.9237 1.9263 2.0289 2.0340 2.5773 2.5928 2.8357 2.8419 2.9512 2.9574 3.1238 3.1365 3.5275 3.5346 3.7797 3.7823 5.6287 5.6630 5.7532 5.7682 5.8870 5.9177 6.0124 6.0249 6.4856 6.5128 6.6790 6.7011 7.1433 7.1902 7.3823 7.4121 7.5145 7.5344 7.7068 7.7516 12.0823 12.0837 12.2841 12.2869 k =-0.4034 0.3642 0.5434 ( 4364 PWs) bands (ev): -23.1517 -23.1517 -23.1385 -23.1385 -11.7236 -11.7229 -11.6320 -11.6304 -11.4554 -11.4521 -11.4233 -11.4218 -6.9261 -6.9046 -6.8814 -6.8695 -6.6982 -6.6775 -6.5949 -6.5868 -6.4306 -6.4301 -6.3848 -6.3653 0.6830 0.6836 0.7493 0.7520 1.5311 1.5335 1.5618 1.5646 1.9232 1.9258 2.0295 2.0345 2.5762 2.5917 2.8414 2.8417 2.9516 2.9521 3.1246 3.1373 3.5266 3.5337 3.7816 3.7842 5.6275 5.6614 5.7538 5.7678 5.8874 5.9182 6.0132 6.0252 6.4840 6.5113 6.6793 6.7015 7.1426 7.1894 7.3858 7.4124 7.5161 7.5298 7.7077 7.7524 12.0815 12.0829 12.2850 12.2879 k =-0.4034 0.3642 0.5434 ( 4364 PWs) bands (ev): -23.1517 -23.1517 -23.1385 -23.1385 -11.7236 -11.7229 -11.6320 -11.6304 -11.4554 -11.4521 -11.4233 -11.4218 -6.9261 -6.9046 -6.8814 -6.8695 -6.6982 -6.6775 -6.5949 -6.5868 -6.4306 -6.4301 -6.3848 -6.3653 0.6830 0.6836 0.7493 0.7520 1.5311 1.5335 1.5618 1.5646 1.9232 1.9258 2.0295 2.0345 2.5762 2.5917 2.8414 2.8417 2.9516 2.9521 3.1246 3.1373 3.5266 3.5337 3.7816 3.7842 5.6275 5.6614 5.7538 5.7678 5.8874 5.9182 6.0132 6.0252 6.4840 6.5113 6.6793 6.7015 7.1426 7.1894 7.3858 7.4124 7.5161 7.5298 7.7077 7.7524 12.0815 12.0829 12.2850 12.2879 k =-0.3944 0.3561 0.5314 ( 4370 PWs) bands (ev): -23.1530 -23.1530 -23.1373 -23.1373 -11.7339 -11.7331 -11.6280 -11.6262 -11.4527 -11.4492 -11.4176 -11.4160 -6.9301 -6.9058 -6.8813 -6.8671 -6.7043 -6.6818 -6.5908 -6.5833 -6.4347 -6.4328 -6.3852 -6.3636 0.6855 0.6861 0.7645 0.7674 1.5233 1.5259 1.5606 1.5634 1.9187 1.9216 2.0426 2.0479 2.5552 2.5709 2.8610 2.8619 2.9423 2.9434 3.1418 3.1545 3.4915 3.4990 3.7873 3.7901 5.6223 5.6586 5.7500 5.7690 5.8762 5.9085 6.0378 6.0459 6.4772 6.5066 6.7057 6.7286 7.1167 7.1634 7.3940 7.4239 7.4979 7.5151 7.7239 7.7682 12.0588 12.0600 12.3047 12.3077 k =-0.3854 0.3480 0.5193 ( 4358 PWs) bands (ev): -23.1543 -23.1543 -23.1360 -23.1360 -11.7442 -11.7434 -11.6236 -11.6218 -11.4498 -11.4460 -11.4122 -11.4104 -6.9341 -6.9072 -6.8811 -6.8646 -6.7103 -6.6862 -6.5866 -6.5798 -6.4388 -6.4353 -6.3858 -6.3621 0.6880 0.6888 0.7807 0.7839 1.5149 1.5176 1.5595 1.5623 1.9144 1.9175 2.0564 2.0619 2.5338 2.5497 2.8809 2.8831 2.9329 2.9354 3.1594 3.1719 3.4553 3.4632 3.7932 3.7961 5.6167 5.6553 5.7427 5.7664 5.8654 5.8987 6.0664 6.0707 6.4699 6.5011 6.7334 6.7568 7.0902 7.1364 7.4005 7.4344 7.4799 7.5014 7.7408 7.7843 12.0322 12.0332 12.3261 12.3293 k =-0.3765 0.3399 0.5072 ( 4362 PWs) bands (ev): -23.1558 -23.1558 -23.1346 -23.1346 -11.7547 -11.7539 -11.6190 -11.6171 -11.4467 -11.4427 -11.4069 -11.4050 -6.9383 -6.9088 -6.8810 -6.8622 -6.7163 -6.6905 -6.5823 -6.5766 -6.4430 -6.4377 -6.3866 -6.3608 0.6907 0.6915 0.7981 0.8015 1.5059 1.5087 1.5585 1.5613 1.9103 1.9136 2.0707 2.0763 2.5120 2.5280 2.8978 2.9040 2.9247 2.9313 3.1773 3.1896 3.4183 3.4265 3.7991 3.8021 5.6106 5.6512 5.7326 5.7605 5.8549 5.8891 6.0981 6.0987 6.4619 6.4948 6.7620 6.7858 7.0630 7.1084 7.4028 7.4373 7.4684 7.4910 7.7581 7.8007 12.0010 12.0019 12.3491 12.3525 k =-0.3675 0.3318 0.4951 ( 4356 PWs) bands (ev): -23.1573 -23.1573 -23.1331 -23.1331 -11.7651 -11.7643 -11.6141 -11.6120 -11.4434 -11.4392 -11.4019 -11.3999 -6.9425 -6.9105 -6.8809 -6.8598 -6.7221 -6.6948 -6.5780 -6.5736 -6.4471 -6.4400 -6.3876 -6.3598 0.6935 0.6943 0.8165 0.8202 1.4963 1.4993 1.5577 1.5605 1.9063 1.9099 2.0854 2.0912 2.4901 2.5061 2.9018 2.9087 2.9336 2.9410 3.1955 3.2075 3.3808 3.3892 3.8051 3.8082 5.6042 5.6464 5.7203 5.7519 5.8449 5.8796 6.1291 6.1319 6.4534 6.4877 6.7915 6.8156 7.0354 7.0795 7.3980 7.4226 7.4735 7.4871 7.7760 7.8172 11.9647 11.9654 12.3738 12.3773 k =-0.3586 0.3237 0.4831 ( 4358 PWs) bands (ev): -23.1589 -23.1589 -23.1316 -23.1316 -11.7756 -11.7747 -11.6090 -11.6068 -11.4400 -11.4356 -11.3971 -11.3950 -6.9468 -6.9126 -6.8807 -6.8576 -6.7278 -6.6990 -6.5737 -6.5707 -6.4513 -6.4420 -6.3888 -6.3591 0.6963 0.6972 0.8359 0.8399 1.4862 1.4893 1.5570 1.5598 1.9027 1.9066 2.1004 2.1063 2.4679 2.4841 2.8952 2.8996 2.9572 2.9622 3.2140 3.2255 3.3431 3.3516 3.8111 3.8143 5.5973 5.6408 5.7064 5.7413 5.8356 5.8703 6.1611 6.1673 6.4441 6.4798 6.8216 6.8459 7.0074 7.0500 7.3851 7.3998 7.4855 7.4905 7.7944 7.8341 11.9229 11.9234 12.4000 12.4037 k =-0.3496 0.3156 0.4710 ( 4354 PWs) bands (ev): -23.1606 -23.1606 -23.1299 -23.1299 -11.7860 -11.7851 -11.6036 -11.6013 -11.4364 -11.4318 -11.3927 -11.3905 -6.9511 -6.9148 -6.8805 -6.8555 -6.7334 -6.7031 -6.5694 -6.5681 -6.4553 -6.4439 -6.3901 -6.3586 0.6992 0.7002 0.8563 0.8605 1.4757 1.4788 1.5566 1.5593 1.8995 1.9036 2.1155 2.1215 2.4457 2.4619 2.8858 2.8892 2.9830 2.9870 3.2326 3.2433 3.3058 3.3139 3.8171 3.8203 5.5900 5.6343 5.6915 5.7291 5.8269 5.8614 6.1940 6.2035 6.4341 6.4709 6.8521 6.8766 6.9793 7.0199 7.3662 7.3744 7.4990 7.4991 7.8134 7.8514 11.8752 11.8755 12.4278 12.4317 k =-0.3406 0.3075 0.4589 ( 4358 PWs) bands (ev): -23.1624 -23.1624 -23.1283 -23.1283 -11.7962 -11.7954 -11.5980 -11.5955 -11.4326 -11.4279 -11.3885 -11.3862 -6.9555 -6.9173 -6.8803 -6.8535 -6.7388 -6.7072 -6.5657 -6.5653 -6.4593 -6.4457 -6.3916 -6.3583 0.7022 0.7033 0.8775 0.8819 1.4646 1.4679 1.5563 1.5589 1.8967 1.9010 2.1307 2.1368 2.4235 2.4396 2.8756 2.8785 3.0098 3.0134 3.2514 3.2561 3.2738 3.2764 3.8230 3.8262 5.5821 5.6268 5.6760 5.7158 5.8188 5.8527 6.2272 6.2402 6.4234 6.4610 6.8824 6.9072 6.9517 6.9896 7.3434 7.3473 7.5106 7.5133 7.8330 7.8690 11.8216 11.8217 12.4571 12.4610 k =-0.3317 0.2994 0.4468 ( 4358 PWs) bands (ev): -23.1642 -23.1642 -23.1265 -23.1265 -11.8063 -11.8055 -11.5921 -11.5896 -11.4288 -11.4239 -11.3847 -11.3823 -6.9598 -6.9201 -6.8800 -6.8517 -6.7440 -6.7110 -6.5636 -6.5615 -6.4629 -6.4472 -6.3931 -6.3583 0.7052 0.7064 0.8996 0.9042 1.4531 1.4564 1.5562 1.5587 1.8943 1.8989 2.1457 2.1519 2.4014 2.4175 2.8650 2.8676 3.0375 3.0409 3.2281 3.2391 3.2706 3.2832 3.8289 3.8322 5.5739 5.6180 5.6605 5.7017 5.8114 5.8444 6.2601 6.2768 6.4119 6.4500 6.9059 6.9314 6.9339 6.9630 7.3181 7.3189 7.5239 7.5278 7.8531 7.8871 11.7622 11.7623 12.4878 12.4918 k =-0.3227 0.2913 0.4347 ( 4352 PWs) bands (ev): -23.1661 -23.1661 -23.1247 -23.1247 -11.8163 -11.8155 -11.5861 -11.5835 -11.4248 -11.4199 -11.3812 -11.3787 -6.9642 -6.9231 -6.8796 -6.8501 -6.7491 -6.7147 -6.5618 -6.5579 -6.4663 -6.4486 -6.3947 -6.3586 0.7082 0.7095 0.9224 0.9273 1.4412 1.4446 1.5564 1.5587 1.8924 1.8973 2.1605 2.1668 2.3794 2.3955 2.8542 2.8566 3.0659 3.0693 3.1921 3.2025 3.2898 3.3015 3.8349 3.8381 5.5651 5.6076 5.6454 5.6872 5.8047 5.8364 6.2923 6.3128 6.3998 6.4378 6.8897 6.9211 6.9512 6.9758 7.2894 7.2912 7.5381 7.5424 7.8739 7.9056 11.6975 11.6975 12.5199 12.5239 k =-0.3137 0.2832 0.4227 ( 4342 PWs) bands (ev): -23.1680 -23.1680 -23.1228 -23.1228 -11.8261 -11.8252 -11.5799 -11.5772 -11.4208 -11.4158 -11.3779 -11.3754 -6.9685 -6.9263 -6.8791 -6.8486 -6.7538 -6.7182 -6.5604 -6.5547 -6.4693 -6.4498 -6.3964 -6.3590 0.7113 0.7126 0.9458 0.9510 1.4290 1.4324 1.5567 1.5590 1.8911 1.8962 2.1749 2.1814 2.3577 2.3737 2.8433 2.8456 3.0947 3.0983 3.1566 3.1667 3.3093 3.3204 3.8408 3.8440 5.5559 5.5954 5.6315 5.6725 5.7986 5.8288 6.3231 6.3469 6.3880 6.4245 6.8634 6.8903 6.9820 7.0063 7.2591 7.2631 7.5529 7.5569 7.8953 7.9247 11.6277 11.6278 12.5532 12.5572 k =-0.3048 0.2751 0.4106 ( 4354 PWs) bands (ev): -23.1701 -23.1701 -23.1209 -23.1209 -11.8356 -11.8348 -11.5735 -11.5708 -11.4168 -11.4118 -11.3749 -11.3725 -6.9728 -6.9297 -6.8786 -6.8474 -6.7584 -6.7216 -6.5593 -6.5522 -6.4717 -6.4509 -6.3981 -6.3597 0.7142 0.7156 0.9699 0.9753 1.4164 1.4199 1.5573 1.5594 1.8901 1.8955 2.1889 2.1955 2.3362 2.3523 2.8322 2.8345 3.1156 3.1235 3.1304 3.1361 3.3289 3.3396 3.8467 3.8499 5.5462 5.5812 5.6187 5.6576 5.7930 5.8214 6.3520 6.3638 6.3914 6.4097 6.8370 6.8583 7.0137 7.0378 7.2281 7.2340 7.5678 7.5712 7.9172 7.9444 11.5535 11.5536 12.5875 12.5915 k =-0.2958 0.2670 0.3985 ( 4358 PWs) bands (ev): -23.1721 -23.1721 -23.1190 -23.1190 -11.8449 -11.8441 -11.5670 -11.5642 -11.4128 -11.4078 -11.3721 -11.3697 -6.9771 -6.9333 -6.8780 -6.8463 -6.7627 -6.7247 -6.5587 -6.5505 -6.4735 -6.4518 -6.3997 -6.3607 0.7172 0.7187 0.9945 1.0001 1.4036 1.4071 1.5580 1.5600 1.8896 1.8954 2.2022 2.2090 2.3153 2.3314 2.8210 2.8233 3.0858 3.0961 3.1565 3.1598 3.3487 3.3591 3.8528 3.8558 5.5360 5.5656 5.6071 5.6430 5.7879 5.8144 6.3519 6.3777 6.3941 6.4211 6.8120 6.8260 7.0453 7.0693 7.1968 7.2045 7.5828 7.5854 7.9398 7.9646 11.4755 11.4755 12.6228 12.6267 k =-0.2868 0.2590 0.3864 ( 4358 PWs) bands (ev): -23.1742 -23.1742 -23.1170 -23.1170 -11.8540 -11.8532 -11.5604 -11.5575 -11.4088 -11.4039 -11.3694 -11.3672 -6.9812 -6.9371 -6.8772 -6.8454 -6.7668 -6.7275 -6.5585 -6.5495 -6.4746 -6.4526 -6.4012 -6.3618 0.7201 0.7217 1.0195 1.0253 1.3905 1.3941 1.5589 1.5608 1.8896 1.8956 2.2148 2.2218 2.2949 2.3110 2.8096 2.8119 3.0532 3.0633 3.1870 3.1904 3.3687 3.3788 3.8589 3.8619 5.5255 5.5490 5.5963 5.6287 5.7832 5.8078 6.3355 6.3749 6.4019 6.4524 6.7892 6.7940 7.0762 7.0998 7.1661 7.1754 7.5977 7.5993 7.9629 7.9854 11.3941 11.3941 12.6588 12.6626 k =-0.2779 0.2509 0.3744 ( 4362 PWs) bands (ev): -23.1763 -23.1763 -23.1150 -23.1150 -11.8628 -11.8620 -11.5537 -11.5508 -11.4049 -11.4002 -11.3669 -11.3649 -6.9853 -6.9410 -6.8764 -6.8446 -6.7705 -6.7302 -6.5588 -6.5496 -6.4748 -6.4533 -6.4027 -6.3632 0.7230 0.7247 1.0449 1.0510 1.3774 1.3809 1.5601 1.5618 1.8899 1.8962 2.2266 2.2337 2.2753 2.2915 2.7980 2.8003 3.0217 3.0316 3.2180 3.2216 3.3889 3.3986 3.8653 3.8681 5.5145 5.5320 5.5860 5.6148 5.7790 5.8015 6.3173 6.3557 6.4198 6.4820 6.7629 6.7697 7.1031 7.1188 7.1466 7.1500 7.6123 7.6128 7.9866 8.0068 11.3098 11.3099 12.6954 12.6990 k =-0.2689 0.2428 0.3623 ( 4362 PWs) bands (ev): -23.1784 -23.1784 -23.1129 -23.1129 -11.8713 -11.8706 -11.5469 -11.5440 -11.4012 -11.3968 -11.3644 -11.3627 -6.9894 -6.9449 -6.8754 -6.8439 -6.7740 -6.7326 -6.5597 -6.5507 -6.4742 -6.4539 -6.4039 -6.3647 0.7257 0.7275 1.0706 1.0769 1.3641 1.3677 1.5614 1.5630 1.8905 1.8970 2.2374 2.2446 2.2567 2.2730 2.7860 2.7885 2.9917 3.0014 3.2494 3.2532 3.4092 3.4187 3.8718 3.8745 5.5033 5.5149 5.5759 5.6015 5.7751 5.7956 6.2976 6.3346 6.4323 6.5083 6.7336 6.7545 7.0957 7.1025 7.1521 7.1691 7.6261 7.6266 8.0107 8.0287 11.2232 11.2234 12.7322 12.7356 k =-0.2600 0.2347 0.3502 ( 4360 PWs) bands (ev): -23.1805 -23.1805 -23.1109 -23.1109 -11.8796 -11.8789 -11.5401 -11.5371 -11.3977 -11.3938 -11.3618 -11.3605 -6.9932 -6.9489 -6.8743 -6.8433 -6.7773 -6.7348 -6.5610 -6.5526 -6.4729 -6.4545 -6.4049 -6.3664 0.7284 0.7303 1.0965 1.1030 1.3508 1.3543 1.5629 1.5643 1.8912 1.8979 2.2388 2.2476 2.2511 2.2592 2.7738 2.7763 2.9632 2.9726 3.2810 3.2849 3.4297 3.4390 3.8787 3.8811 5.4919 5.4980 5.5661 5.5888 5.7715 5.7899 6.2763 6.3116 6.4379 6.5292 6.7083 6.7448 7.0648 7.0767 7.1793 7.1993 7.6390 7.6406 8.0353 8.0512 11.1349 11.1351 12.7695 12.7921 k =-0.2510 0.2266 0.3381 ( 4360 PWs) bands (ev): -23.1826 -23.1826 -23.1088 -23.1088 -11.8875 -11.8868 -11.5332 -11.5303 -11.3945 -11.3912 -11.3590 -11.3583 -6.9970 -6.9530 -6.8731 -6.8428 -6.7802 -6.7367 -6.5628 -6.5554 -6.4709 -6.4552 -6.4057 -6.3682 0.7309 0.7329 1.1225 1.1293 1.3375 1.3410 1.5646 1.5659 1.8918 1.8987 2.2228 2.2378 2.2564 2.2654 2.7610 2.7637 2.9365 2.9455 3.3126 3.3168 3.4504 3.4595 3.8858 3.8881 5.4804 5.4815 5.5564 5.5767 5.7681 5.7846 6.2534 6.2867 6.4360 6.5409 6.6907 6.7412 7.0335 7.0480 7.2096 7.2299 7.6515 7.6540 8.0602 8.0742 11.0451 11.0455 12.8056 12.8083 k =-0.2420 0.2185 0.3261 ( 4360 PWs) bands (ev): -23.1848 -23.1848 -23.1068 -23.1068 -11.8951 -11.8945 -11.5264 -11.5234 -11.3917 -11.3891 -11.3561 -11.3560 -7.0007 -6.9571 -6.8717 -6.8423 -6.7829 -6.7385 -6.5652 -6.5590 -6.4686 -6.4558 -6.4062 -6.3701 0.7333 0.7354 1.1486 1.1555 1.3243 1.3278 1.5664 1.5676 1.8922 1.8992 2.2082 2.2234 2.2642 2.2734 2.7477 2.7505 2.9116 2.9202 3.3442 3.3486 3.4714 3.4803 3.8932 3.8953 5.4656 5.4689 5.5468 5.5652 5.7650 5.7795 6.2288 6.2598 6.4270 6.5390 6.6854 6.7434 7.0026 7.0192 7.2404 7.2605 7.6636 7.6670 8.0855 8.0976 10.9545 10.9550 12.8417 12.8438 k =-0.2331 0.2104 0.3140 ( 4358 PWs) bands (ev): -23.1869 -23.1869 -23.1048 -23.1048 -11.9024 -11.9018 -11.5195 -11.5166 -11.3895 -11.3876 -11.3535 -11.3528 -7.0042 -6.9612 -6.8702 -6.8417 -6.7853 -6.7402 -6.5681 -6.5631 -6.4660 -6.4566 -6.4065 -6.3722 0.7355 0.7376 1.1746 1.1818 1.3114 1.3148 1.5685 1.5695 1.8922 1.8990 2.1956 2.2106 2.2710 2.2806 2.7338 2.7368 2.8885 2.8967 3.3755 3.3802 3.4926 3.5014 3.9011 3.9029 5.4503 5.4576 5.5374 5.5543 5.7621 5.7748 6.2026 6.2311 6.4116 6.5231 6.6923 6.7503 6.9725 6.9908 7.2711 7.2908 7.6754 7.6796 8.1109 8.1214 10.8633 10.8640 12.8765 12.8794 k =-0.2241 0.2023 0.3019 ( 4342 PWs) bands (ev): -23.1890 -23.1890 -23.1027 -23.1027 -11.9094 -11.9089 -11.5127 -11.5098 -11.3877 -11.3866 -11.3507 -11.3494 -7.0075 -6.9653 -6.8685 -6.8411 -6.7874 -6.7416 -6.5714 -6.5676 -6.4632 -6.4574 -6.4065 -6.3743 0.7375 0.7397 1.2005 1.2079 1.2987 1.3020 1.5706 1.5715 1.8914 1.8980 2.1853 2.1998 2.2768 2.2869 2.7193 2.7225 2.8673 2.8749 3.4063 3.4113 3.5142 3.5229 3.9092 3.9108 5.4358 5.4467 5.5282 5.5441 5.7595 5.7704 6.1747 6.2005 6.3914 6.4983 6.7068 6.7608 6.9432 6.9634 7.3016 7.3207 7.6867 7.6916 8.1365 8.1455 10.7720 10.7728 12.9113 12.9118 k =-0.2151 0.1942 0.2898 ( 4342 PWs) bands (ev): -23.1911 -23.1911 -23.1007 -23.1007 -11.9161 -11.9156 -11.5060 -11.5030 -11.3865 -11.3860 -11.3476 -11.3457 -7.0107 -6.9693 -6.8666 -6.8404 -6.7893 -6.7429 -6.5753 -6.5726 -6.4604 -6.4583 -6.4062 -6.3764 0.7393 0.7416 1.2261 1.2338 1.2862 1.2895 1.5729 1.5737 1.8895 1.8958 2.1775 2.1915 2.2816 2.2922 2.7041 2.7075 2.8478 2.8550 3.4365 3.4417 3.5363 3.5450 3.9178 3.9191 5.4222 5.4361 5.5191 5.5344 5.7569 5.7662 6.1453 6.1681 6.3675 6.4687 6.7246 6.7734 6.9150 6.9368 7.3317 7.3501 7.6977 7.7031 8.1620 8.1697 10.6809 10.6818 12.9364 12.9389 k =-0.2062 0.1861 0.2778 ( 4352 PWs) bands (ev): -23.1932 -23.1932 -23.0987 -23.0987 -11.9225 -11.9220 -11.4993 -11.4964 -11.3859 -11.3858 -11.3443 -11.3419 -7.0137 -6.9732 -6.8646 -6.8397 -6.7909 -6.7441 -6.5796 -6.5779 -6.4593 -6.4577 -6.4058 -6.3786 0.7408 0.7431 1.2513 1.2592 1.2743 1.2774 1.5753 1.5760 1.8865 1.8922 2.1726 2.1858 2.2854 2.2967 2.6884 2.6921 2.8300 2.8366 3.4656 3.4710 3.5592 3.5678 3.9267 3.9277 5.4095 5.4261 5.5101 5.5252 5.7544 5.7623 6.1142 6.1339 6.3409 6.4365 6.7434 6.7872 6.8879 6.9112 7.3614 7.3791 7.7083 7.7140 8.1874 8.1939 10.5903 10.5914 12.9207 12.9235 k =-0.1972 0.1780 0.2657 ( 4350 PWs) bands (ev): -23.1953 -23.1953 -23.0967 -23.0967 -11.9285 -11.9281 -11.4928 -11.4899 -11.3862 -11.3856 -11.3408 -11.3380 -7.0165 -6.9771 -6.8623 -6.8387 -6.7923 -6.7452 -6.5844 -6.5835 -6.4603 -6.4551 -6.4051 -6.3807 0.7420 0.7445 1.2618 1.2652 1.2772 1.2849 1.5778 1.5784 1.8821 1.8870 2.1705 2.1829 2.2885 2.3004 2.6722 2.6763 2.8136 2.8197 3.4933 3.4989 3.5832 3.5915 3.9359 3.9366 5.3980 5.4169 5.5014 5.5167 5.7521 5.7586 6.0818 6.0984 6.3124 6.4031 6.7623 6.8014 6.8622 6.8869 7.3908 7.4076 7.7184 7.7244 8.2127 8.2182 10.5005 10.5017 12.9008 12.9039 k =-0.1882 0.1699 0.2536 ( 4344 PWs) bands (ev): -23.1973 -23.1973 -23.0948 -23.0948 -11.9342 -11.9338 -11.4863 -11.4835 -11.3868 -11.3858 -11.3371 -11.3340 -7.0191 -6.9808 -6.8599 -6.8376 -6.7934 -6.7462 -6.5895 -6.5893 -6.4614 -6.4528 -6.4044 -6.3827 0.7430 0.7455 1.2510 1.2541 1.3014 1.3095 1.5804 1.5809 1.8763 1.8804 2.1714 2.1827 2.2908 2.3034 2.6558 2.6603 2.7986 2.8042 3.5194 3.5249 3.6084 3.6164 3.9454 3.9458 5.3876 5.4085 5.4928 5.5087 5.7498 5.7553 6.0481 6.0615 6.2826 6.3690 6.7805 6.8156 6.8378 6.8638 7.4197 7.4357 7.7283 7.7343 8.2377 8.2422 10.4118 10.4132 12.8788 12.8820 k =-0.1793 0.1618 0.2415 ( 4348 PWs) bands (ev): -23.1992 -23.1992 -23.0929 -23.0929 -11.9397 -11.9393 -11.4800 -11.4773 -11.3876 -11.3863 -11.3334 -11.3300 -7.0216 -6.9845 -6.8573 -6.8363 -6.7942 -6.7472 -6.5954 -6.5951 -6.4624 -6.4507 -6.4036 -6.3847 0.7436 0.7462 1.2405 1.2434 1.3254 1.3337 1.5831 1.5835 1.8691 1.8722 2.1750 2.1853 2.2925 2.3057 2.6392 2.6441 2.7846 2.7897 3.5436 3.5489 3.6350 3.6425 3.9552 3.9552 5.3784 5.4009 5.4845 5.5012 5.7475 5.7520 6.0133 6.0235 6.2519 6.3344 6.7979 6.8147 6.8287 6.8426 7.4482 7.4632 7.7377 7.7437 8.2623 8.2661 10.3245 10.3261 12.8557 12.8590 k =-0.1703 0.1538 0.2295 ( 4346 PWs) bands (ev): -23.2011 -23.2011 -23.0911 -23.0911 -11.9448 -11.9444 -11.4739 -11.4712 -11.3887 -11.3871 -11.3295 -11.3260 -7.0238 -6.9880 -6.8544 -6.8347 -6.7949 -6.7481 -6.6016 -6.6010 -6.4635 -6.4490 -6.4027 -6.3866 0.7440 0.7466 1.2304 1.2333 1.3489 1.3574 1.5859 1.5862 1.8607 1.8628 2.1812 2.1904 2.2937 2.3076 2.6226 2.6281 2.7714 2.7761 3.5657 3.5707 3.6628 3.6699 3.9647 3.9650 5.3706 5.3943 5.4764 5.4944 5.7451 5.7490 5.9779 5.9847 6.2205 6.2998 6.7930 6.8143 6.8198 6.8440 7.4762 7.4902 7.7468 7.7526 8.2864 8.2895 10.2388 10.2406 12.8320 12.8355 k =-0.1614 0.1457 0.2174 ( 4348 PWs) bands (ev): -23.2030 -23.2030 -23.0893 -23.0893 -11.9496 -11.9493 -11.4680 -11.4654 -11.3899 -11.3882 -11.3257 -11.3221 -7.0258 -6.9914 -6.8513 -6.8329 -6.7953 -6.7489 -6.6079 -6.6072 -6.4644 -6.4477 -6.4018 -6.3883 0.7440 0.7466 1.2210 1.2237 1.3717 1.3803 1.5887 1.5889 1.8513 1.8524 2.1897 2.1977 2.2945 2.3091 2.6061 2.6122 2.7591 2.7634 3.5858 3.5905 3.6918 3.6982 3.9744 3.9750 5.3641 5.3886 5.4686 5.4882 5.7425 5.7459 5.9420 5.9455 6.1886 6.2651 6.7727 6.8004 6.8297 6.8564 7.5038 7.5167 7.7555 7.7611 8.3099 8.3125 10.1551 10.1570 12.8081 12.8116 k =-0.1524 0.1376 0.2053 ( 4360 PWs) bands (ev): -23.2048 -23.2048 -23.0876 -23.0876 -11.9540 -11.9538 -11.4622 -11.4597 -11.3912 -11.3894 -11.3219 -11.3182 -7.0276 -6.9947 -6.8480 -6.8309 -6.7955 -6.7498 -6.6144 -6.6136 -6.4654 -6.4467 -6.4010 -6.3898 0.7438 0.7463 1.2123 1.2149 1.3937 1.4026 1.5915 1.5916 1.8411 1.8413 2.2000 2.2069 2.2951 2.3104 2.5897 2.5964 2.7473 2.7513 3.6041 3.6084 3.7215 3.7274 3.9840 3.9849 5.3589 5.3839 5.4609 5.4826 5.7393 5.7425 5.9064 5.9064 6.1565 6.2306 6.7538 6.7818 6.8441 6.8682 7.5309 7.5426 7.7637 7.7690 8.3327 8.3348 10.0734 10.0756 12.7841 12.7876 k =-0.1434 0.1295 0.1932 ( 4356 PWs) bands (ev): -23.2065 -23.2065 -23.0860 -23.0860 -11.9582 -11.9580 -11.4567 -11.4543 -11.3926 -11.3907 -11.3181 -11.3145 -7.0293 -6.9978 -6.8445 -6.8286 -6.7955 -6.7506 -6.6210 -6.6204 -6.4663 -6.4461 -6.4001 -6.3911 0.7432 0.7457 1.2043 1.2067 1.4150 1.4240 1.5943 1.5944 1.8296 1.8304 2.2119 2.2178 2.2957 2.3115 2.5736 2.5810 2.7361 2.7397 3.6206 3.6246 3.7516 3.7570 3.9935 3.9947 5.3552 5.3802 5.4536 5.4777 5.7350 5.7385 5.8682 5.8718 6.1243 6.1962 6.7362 6.7643 6.8574 6.8794 7.5574 7.5680 7.7716 7.7765 8.3548 8.3564 9.9942 9.9965 12.7603 12.7637 k =-0.1345 0.1214 0.1811 ( 4366 PWs) bands (ev): -23.2082 -23.2082 -23.0844 -23.0844 -11.9621 -11.9619 -11.4515 -11.4492 -11.3941 -11.3922 -11.3145 -11.3110 -7.0307 -7.0008 -6.8407 -6.8261 -6.7953 -6.7514 -6.6277 -6.6273 -6.4671 -6.4460 -6.3994 -6.3922 0.7423 0.7448 1.1969 1.1992 1.4355 1.4446 1.5971 1.5972 1.8177 1.8192 2.2250 2.2300 2.2962 2.3127 2.5577 2.5658 2.7254 2.7288 3.6355 3.6392 3.7818 3.7868 4.0029 4.0043 5.3529 5.3774 5.4465 5.4737 5.7286 5.7325 5.8324 5.8396 6.0921 6.1622 6.7198 6.7477 6.8696 6.8896 7.5834 7.5928 7.7792 7.7835 8.3760 8.3773 9.9176 9.9200 12.7368 12.7400 k =-0.1255 0.1133 0.1691 ( 4358 PWs) bands (ev): -23.2097 -23.2097 -23.0829 -23.0829 -11.9657 -11.9656 -11.4465 -11.4443 -11.3955 -11.3937 -11.3110 -11.3075 -7.0319 -7.0037 -6.8367 -6.8233 -6.7949 -6.7522 -6.6345 -6.6344 -6.4677 -6.4461 -6.3987 -6.3931 0.7412 0.7437 1.1903 1.1925 1.4551 1.4644 1.5999 1.6000 1.8056 1.8080 2.2390 2.2431 2.2968 2.3140 2.5421 2.5510 2.7152 2.7183 3.6490 3.6525 3.8118 3.8166 4.0120 4.0137 5.3521 5.3755 5.4396 5.4705 5.7185 5.7222 5.8017 5.8118 6.0603 6.1286 6.7047 6.7321 6.8808 6.8991 7.6089 7.6169 7.7864 7.7901 8.3963 8.3973 9.8439 9.8464 12.7137 12.7169 k =-0.1165 0.1052 0.1570 ( 4352 PWs) bands (ev): -23.2112 -23.2112 -23.0815 -23.0815 -11.9691 -11.9689 -11.4417 -11.4397 -11.3970 -11.3952 -11.3076 -11.3043 -7.0329 -7.0064 -6.8324 -6.8202 -6.7944 -6.7531 -6.6417 -6.6413 -6.4683 -6.4466 -6.3980 -6.3938 0.7399 0.7423 1.1844 1.1864 1.4738 1.4832 1.6026 1.6027 1.7936 1.7967 2.2537 2.2568 2.2978 2.3156 2.5269 2.5365 2.7055 2.7083 3.6611 3.6643 3.8415 3.8460 4.0208 4.0226 5.3525 5.3742 5.4330 5.4683 5.7024 5.7038 5.7802 5.7910 6.0287 6.0955 6.6908 6.7175 6.8911 6.9077 7.6336 7.6404 7.7932 7.7962 8.4155 8.4163 9.7733 9.7759 12.6913 12.6943 k =-0.1076 0.0971 0.1449 ( 4355 PWs) bands (ev): -23.2126 -23.2126 -23.0801 -23.0801 -11.9721 -11.9720 -11.4373 -11.4354 -11.3984 -11.3967 -11.3044 -11.3013 -7.0337 -7.0090 -6.8280 -6.8170 -6.7937 -6.7539 -6.6490 -6.6482 -6.4687 -6.4474 -6.3975 -6.3943 0.7384 0.7407 1.1791 1.1810 1.4916 1.5011 1.6052 1.6054 1.7818 1.7855 2.2686 2.2707 2.2991 2.3177 2.5120 2.5222 2.6963 2.6989 3.6718 3.6749 3.8706 3.8748 4.0292 4.0311 5.3542 5.3735 5.4266 5.4669 5.6771 5.6803 5.7686 5.7777 5.9976 6.0630 6.6781 6.7038 6.9005 6.9155 7.6576 7.6630 7.7997 7.8019 8.4336 8.4342 9.7060 9.7087 12.6697 12.6726 k =-0.0986 0.0890 0.1328 ( 4349 PWs) bands (ev): -23.2139 -23.2139 -23.0789 -23.0789 -11.9749 -11.9748 -11.4332 -11.4315 -11.3998 -11.3981 -11.3014 -11.2984 -7.0343 -7.0114 -6.8233 -6.8135 -6.7928 -6.7547 -6.6565 -6.6550 -6.4691 -6.4484 -6.3971 -6.3947 0.7368 0.7389 1.1745 1.1762 1.5084 1.5180 1.6078 1.6080 1.7702 1.7745 2.2834 2.2844 2.3010 2.3205 2.4975 2.5084 2.6876 2.6900 3.6814 3.6843 3.8988 3.9029 4.0371 4.0390 5.3569 5.3730 5.4203 5.4665 5.6465 5.6547 5.7628 5.7697 5.9673 6.0312 6.6665 6.6910 6.9090 6.9225 7.6808 7.6847 7.8058 7.8072 8.4506 8.4510 9.6425 9.6452 12.6492 12.6518 k =-0.0896 0.0809 0.1208 ( 4349 PWs) bands (ev): -23.2151 -23.2151 -23.0777 -23.0777 -11.9774 -11.9773 -11.4295 -11.4279 -11.4010 -11.3995 -11.2986 -11.2958 -7.0347 -7.0137 -6.8184 -6.8099 -6.7919 -6.7556 -6.6639 -6.6619 -6.4693 -6.4497 -6.3967 -6.3950 0.7351 0.7371 1.1705 1.1721 1.5243 1.5339 1.6102 1.6105 1.7590 1.7639 2.2972 2.2974 2.3041 2.3243 2.4833 2.4949 2.6795 2.6817 3.6897 3.6924 3.9259 3.9298 4.0445 4.0464 5.3605 5.3727 5.4141 5.4667 5.6157 5.6284 5.7599 5.7648 5.9378 6.0003 6.6561 6.6791 6.9166 6.9287 7.7029 7.7055 7.8116 7.8120 8.4663 8.4666 9.5828 9.5855 12.6298 12.6323 k =-0.0807 0.0728 0.1087 ( 4333 PWs) bands (ev): -23.2162 -23.2162 -23.0766 -23.0766 -11.9797 -11.9796 -11.4261 -11.4247 -11.4021 -11.4007 -11.2959 -11.2934 -7.0350 -7.0159 -6.8133 -6.8061 -6.7908 -6.7564 -6.6712 -6.6687 -6.4693 -6.4510 -6.3963 -6.3952 0.7333 0.7352 1.1670 1.1685 1.5392 1.5489 1.6125 1.6129 1.7483 1.7536 2.3044 2.3085 2.3140 2.3299 2.4695 2.4817 2.6721 2.6741 3.6969 3.6995 3.9517 3.9555 4.0513 4.0531 5.3647 5.3724 5.4078 5.4667 5.5874 5.6038 5.7584 5.7615 5.9094 5.9703 6.6468 6.6682 6.9234 6.9342 7.7239 7.7250 7.8165 7.8171 8.4807 8.4810 9.5274 9.5301 12.6117 12.6140 k =-0.0717 0.0647 0.0966 ( 4329 PWs) bands (ev): -23.2172 -23.2172 -23.0757 -23.0757 -11.9817 -11.9816 -11.4231 -11.4219 -11.4030 -11.4018 -11.2936 -11.2913 -7.0351 -7.0180 -6.8081 -6.8023 -6.7897 -6.7572 -6.6785 -6.6754 -6.4693 -6.4525 -6.3961 -6.3953 0.7316 0.7333 1.1641 1.1654 1.5531 1.5628 1.6146 1.6150 1.7380 1.7437 2.3082 2.3172 2.3271 2.3378 2.4561 2.4690 2.6653 2.6671 3.7031 3.7055 3.9760 3.9796 4.0575 4.0592 5.3690 5.3718 5.4014 5.4651 5.5638 5.5822 5.7574 5.7588 5.8825 5.9416 6.6387 6.6582 6.9295 6.9389 7.7431 7.7435 7.8207 7.8223 8.4938 8.4940 9.4766 9.4791 12.5952 12.5972 k =-0.0627 0.0566 0.0845 ( 4335 PWs) bands (ev): -23.2181 -23.2181 -23.0749 -23.0749 -11.9834 -11.9834 -11.4205 -11.4195 -11.4038 -11.4028 -11.2914 -11.2894 -7.0350 -7.0199 -6.8028 -6.7985 -6.7884 -6.7580 -6.6856 -6.6820 -6.4691 -6.4540 -6.3959 -6.3954 0.7299 0.7314 1.1617 1.1628 1.5660 1.5756 1.6165 1.6170 1.7283 1.7343 2.3122 2.3238 2.3396 2.3473 2.4432 2.4566 2.6592 2.6608 3.7083 3.7105 3.9984 4.0018 4.0631 4.0645 5.3709 5.3729 5.3948 5.4596 5.5476 5.5647 5.7563 5.7565 5.8574 5.9143 6.6316 6.6491 6.9347 6.9430 7.7595 7.7614 7.8245 7.8273 8.5054 8.5055 9.4306 9.4330 12.5802 12.5820 k =-0.0538 0.0486 0.0725 ( 4339 PWs) bands (ev): -23.2188 -23.2188 -23.0741 -23.0741 -11.9849 -11.9849 -11.4184 -11.4176 -11.4042 -11.4035 -11.2895 -11.2878 -7.0347 -7.0218 -6.7975 -6.7949 -6.7871 -6.7588 -6.6924 -6.6883 -6.4688 -6.4556 -6.3958 -6.3955 0.7284 0.7297 1.1596 1.1606 1.5779 1.5873 1.6182 1.6188 1.7192 1.7254 2.3167 2.3296 2.3509 2.3571 2.4308 2.4448 2.6538 2.6552 3.7127 3.7146 4.0186 4.0218 4.0680 4.0692 5.3696 5.3753 5.3887 5.4492 5.5403 5.5521 5.7536 5.7549 5.8352 5.8888 6.6256 6.6409 6.9393 6.9463 7.7740 7.7772 7.8282 7.8321 8.5156 8.5157 9.3899 9.3921 12.5670 12.5686 k =-0.0448 0.0405 0.0604 ( 4345 PWs) bands (ev): -23.2195 -23.2195 -23.0735 -23.0735 -11.9862 -11.9862 -11.4167 -11.4163 -11.4045 -11.4039 -11.2879 -11.2864 -7.0344 -7.0235 -6.7923 -6.7915 -6.7856 -6.7595 -6.6987 -6.6944 -6.4683 -6.4572 -6.3957 -6.3955 0.7270 0.7281 1.1580 1.1589 1.5887 1.5978 1.6197 1.6204 1.7108 1.7170 2.3219 2.3352 2.3608 2.3662 2.4190 2.4335 2.6492 2.6504 3.7162 3.7178 4.0363 4.0394 4.0723 4.0730 5.3677 5.3738 5.3857 5.4357 5.5400 5.5447 5.7504 5.7519 5.8168 5.8655 6.6208 6.6337 6.9432 6.9490 7.7863 7.7906 7.8319 7.8366 8.5242 8.5243 9.3547 9.3566 12.5557 12.5570 k =-0.0359 0.0324 0.0483 ( 4325 PWs) bands (ev): -23.2200 -23.2200 -23.0730 -23.0730 -11.9872 -11.9872 -11.4156 -11.4153 -11.4045 -11.4041 -11.2865 -11.2853 -7.0338 -7.0251 -6.7885 -6.7879 -6.7833 -6.7602 -6.7044 -6.7000 -6.4677 -6.4587 -6.3956 -6.3955 0.7258 0.7267 1.1568 1.1575 1.5985 1.6070 1.6210 1.6219 1.7033 1.7093 2.3277 2.3408 2.3691 2.3742 2.4080 2.4229 2.6455 2.6464 3.7190 3.7203 4.0513 4.0542 4.0760 4.0763 5.3652 5.3683 5.3862 5.4223 5.5421 5.5437 5.7466 5.7470 5.8039 5.8452 6.6171 6.6276 6.9466 6.9512 7.7964 7.8012 7.8359 7.8410 8.5314 8.5315 9.3254 9.3270 12.5464 12.5474 k =-0.0269 0.0243 0.0362 ( 4321 PWs) bands (ev): -23.2204 -23.2204 -23.0725 -23.0725 -11.9880 -11.9880 -11.4148 -11.4147 -11.4043 -11.4041 -11.2853 -11.2844 -7.0331 -7.0265 -6.7861 -6.7854 -6.7794 -6.7610 -6.7092 -6.7051 -6.4670 -6.4602 -6.3956 -6.3955 0.7249 0.7256 1.1559 1.1564 1.6069 1.6146 1.6221 1.6231 1.6969 1.7023 2.3339 2.3463 2.3754 2.3805 2.3983 2.4132 2.6426 2.6433 3.7212 3.7222 4.0631 4.0659 4.0788 4.0791 5.3620 5.3623 5.3876 5.4110 5.5431 5.5484 5.7401 5.7418 5.7967 5.8282 6.6145 6.6225 6.9492 6.9527 7.8040 7.8085 7.8401 7.8447 8.5370 8.5371 9.3023 9.3036 12.5390 12.5398 k =-0.0179 0.0162 0.0242 ( 4317 PWs) bands (ev): -23.2207 -23.2207 -23.0723 -23.0723 -11.9886 -11.9886 -11.4144 -11.4144 -11.4041 -11.4040 -11.2845 -11.2839 -7.0323 -7.0279 -6.7844 -6.7841 -6.7748 -6.7622 -6.7126 -6.7094 -6.4661 -6.4615 -6.3955 -6.3955 0.7243 0.7247 1.1553 1.1556 1.6137 1.6196 1.6234 1.6242 1.6922 1.6964 2.3404 2.3510 2.3795 2.3839 2.3916 2.4048 2.6405 2.6410 3.7227 3.7234 4.0715 4.0739 4.0810 4.0818 5.3575 5.3586 5.3890 5.4026 5.5464 5.5523 5.7336 5.7366 5.7943 5.8149 6.6131 6.6184 6.9513 6.9536 7.8095 7.8129 7.8441 7.8476 8.5411 8.5411 9.2857 9.2865 12.5338 12.5343 k =-0.0090 0.0081 0.0121 ( 4323 PWs) bands (ev): -23.2209 -23.2209 -23.0721 -23.0721 -11.9889 -11.9889 -11.4142 -11.4142 -11.4039 -11.4039 -11.2839 -11.2836 -7.0314 -7.0292 -6.7835 -6.7834 -6.7705 -6.7641 -6.7144 -6.7126 -6.4652 -6.4628 -6.3955 -6.3955 0.7239 0.7242 1.1550 1.1551 1.6183 1.6211 1.6253 1.6253 1.6895 1.6919 2.3468 2.3535 2.3811 2.3819 2.3918 2.3984 2.6393 2.6395 3.7237 3.7240 4.0762 4.0777 4.0832 4.0838 5.3547 5.3556 5.3907 5.3968 5.5503 5.5541 5.7294 5.7318 5.7951 5.8052 6.6128 6.6155 6.9527 6.9538 7.8131 7.8149 7.8473 7.8491 8.5435 8.5435 9.2757 9.2761 12.5307 12.5309 k = 0.0000 0.0000 0.0000 ( 4323 PWs) bands (ev): -23.2210 -23.2210 -23.0720 -23.0720 -11.9891 -11.9891 -11.4141 -11.4141 -11.4039 -11.4039 -11.2836 -11.2836 -7.0304 -7.0304 -6.7832 -6.7832 -6.7668 -6.7668 -6.7144 -6.7144 -6.4640 -6.4640 -6.3955 -6.3955 0.7239 0.7239 1.1549 1.1549 1.6207 1.6207 1.6260 1.6260 1.6894 1.6894 2.3518 2.3518 2.3808 2.3808 2.3945 2.3945 2.6390 2.6390 3.7241 3.7241 4.0781 4.0781 4.0845 4.0845 5.3542 5.3542 5.3931 5.3931 5.5532 5.5532 5.7290 5.7290 5.7988 5.7988 6.6136 6.6136 6.9535 6.9535 7.8149 7.8149 7.8491 7.8491 8.5443 8.5443 9.2725 9.2725 12.5297 12.5297 k = 0.0000 0.0000 0.0000 ( 4323 PWs) bands (ev): -23.2210 -23.2210 -23.0720 -23.0720 -11.9891 -11.9891 -11.4141 -11.4141 -11.4039 -11.4039 -11.2836 -11.2836 -7.0304 -7.0304 -6.7832 -6.7832 -6.7668 -6.7668 -6.7144 -6.7144 -6.4640 -6.4640 -6.3955 -6.3955 0.7239 0.7239 1.1549 1.1549 1.6207 1.6207 1.6260 1.6260 1.6894 1.6894 2.3518 2.3518 2.3808 2.3808 2.3945 2.3945 2.6390 2.6390 3.7241 3.7241 4.0781 4.0781 4.0845 4.0845 5.3542 5.3542 5.3931 5.3931 5.5532 5.5532 5.7290 5.7290 5.7988 5.7988 6.6136 6.6136 6.9535 6.9535 7.8149 7.8149 7.8491 7.8491 8.5443 8.5443 9.2725 9.2725 12.5297 12.5297 k = 0.0114 0.0126-0.0000 ( 4315 PWs) bands (ev): -23.2209 -23.2209 -23.0721 -23.0721 -11.9889 -11.9889 -11.4142 -11.4142 -11.4039 -11.4039 -11.2838 -11.2838 -7.0303 -7.0303 -6.7835 -6.7835 -6.7667 -6.7667 -6.7140 -6.7140 -6.4639 -6.4639 -6.3955 -6.3955 0.7234 0.7234 1.1545 1.1545 1.6206 1.6206 1.6260 1.6260 1.6902 1.6902 2.3522 2.3522 2.3812 2.3812 2.3949 2.3949 2.6375 2.6375 3.7242 3.7242 4.0776 4.0776 4.0840 4.0840 5.3525 5.3525 5.3948 5.3948 5.5541 5.5541 5.7298 5.7298 5.7996 5.7996 6.6117 6.6117 6.9552 6.9552 7.8145 7.8145 7.8487 7.8487 8.5421 8.5421 9.2769 9.2769 12.5278 12.5278 k = 0.0227 0.0252-0.0000 ( 4319 PWs) bands (ev): -23.2208 -23.2208 -23.0722 -23.0722 -11.9884 -11.9884 -11.4144 -11.4144 -11.4042 -11.4042 -11.2845 -11.2845 -7.0301 -7.0301 -6.7844 -6.7844 -6.7665 -6.7665 -6.7129 -6.7129 -6.4636 -6.4636 -6.3953 -6.3953 0.7217 0.7217 1.1534 1.1534 1.6205 1.6205 1.6258 1.6258 1.6926 1.6926 2.3531 2.3531 2.3825 2.3825 2.3960 2.3960 2.6333 2.6333 3.7242 3.7242 4.0762 4.0762 4.0826 4.0826 5.3481 5.3481 5.3995 5.3995 5.5568 5.5568 5.7322 5.7322 5.8019 5.8019 6.6063 6.6063 6.9599 6.9599 7.8134 7.8134 7.8476 7.8476 8.5357 8.5357 9.2899 9.2899 12.5223 12.5223 k = 0.0341 0.0378-0.0000 ( 4347 PWs) bands (ev): -23.2206 -23.2206 -23.0725 -23.0725 -11.9875 -11.9875 -11.4148 -11.4148 -11.4046 -11.4046 -11.2855 -11.2855 -7.0297 -7.0297 -6.7857 -6.7857 -6.7661 -6.7661 -6.7113 -6.7113 -6.4631 -6.4631 -6.3951 -6.3951 0.7191 0.7191 1.1515 1.1515 1.6202 1.6202 1.6254 1.6254 1.6964 1.6964 2.3547 2.3547 2.3845 2.3845 2.3980 2.3980 2.6262 2.6262 3.7243 3.7243 4.0736 4.0736 4.0802 4.0802 5.3422 5.3422 5.4059 5.4059 5.5611 5.5611 5.7359 5.7359 5.8055 5.8055 6.5976 6.5976 6.9674 6.9674 7.8115 7.8115 7.8456 7.8456 8.5254 8.5254 9.3112 9.3112 12.5131 12.5131 k = 0.0455 0.0504-0.0000 ( 4339 PWs) bands (ev): -23.2202 -23.2202 -23.0728 -23.0728 -11.9862 -11.9862 -11.4153 -11.4153 -11.4052 -11.4052 -11.2870 -11.2870 -7.0292 -7.0292 -6.7874 -6.7874 -6.7656 -6.7656 -6.7089 -6.7089 -6.4623 -6.4623 -6.3947 -6.3947 0.7154 0.7154 1.1488 1.1488 1.6198 1.6198 1.6250 1.6250 1.7018 1.7018 2.3569 2.3569 2.3874 2.3874 2.4008 2.4008 2.6165 2.6165 3.7243 3.7243 4.0702 4.0702 4.0769 4.0769 5.3357 5.3357 5.4133 5.4133 5.5671 5.5671 5.7413 5.7413 5.8107 5.8107 6.5861 6.5861 6.9775 6.9775 7.8089 7.8089 7.8431 7.8431 8.5119 8.5119 9.3401 9.3401 12.5005 12.5005 k = 0.0568 0.0629-0.0000 ( 4347 PWs) bands (ev): -23.2198 -23.2198 -23.0732 -23.0732 -11.9847 -11.9847 -11.4160 -11.4160 -11.4059 -11.4059 -11.2889 -11.2889 -7.0285 -7.0285 -6.7895 -6.7895 -6.7651 -6.7651 -6.7061 -6.7061 -6.4613 -6.4613 -6.3943 -6.3943 0.7108 0.7108 1.1455 1.1455 1.6193 1.6193 1.6244 1.6244 1.7086 1.7086 2.3597 2.3597 2.3911 2.3911 2.4043 2.4043 2.6042 2.6042 3.7240 3.7240 4.0659 4.0659 4.0727 4.0727 5.3290 5.3290 5.4213 5.4213 5.5745 5.5745 5.7482 5.7482 5.8174 5.8174 6.5722 6.5722 6.9894 6.9894 7.8057 7.8057 7.8399 7.8399 8.4956 8.4956 9.3760 9.3760 12.4848 12.4848 k = 0.0682 0.0755-0.0000 ( 4363 PWs) bands (ev): -23.2192 -23.2192 -23.0737 -23.0737 -11.9827 -11.9827 -11.4168 -11.4168 -11.4068 -11.4068 -11.2913 -11.2913 -7.0277 -7.0277 -6.7918 -6.7918 -6.7644 -6.7644 -6.7029 -6.7029 -6.4601 -6.4601 -6.3937 -6.3937 0.7053 0.7053 1.1414 1.1414 1.6187 1.6187 1.6236 1.6236 1.7167 1.7167 2.3631 2.3631 2.3955 2.3955 2.4086 2.4086 2.5896 2.5896 3.7234 3.7234 4.0606 4.0606 4.0676 4.0676 5.3225 5.3225 5.4299 5.4299 5.5832 5.5832 5.7564 5.7564 5.8255 5.8255 6.5563 6.5563 7.0028 7.0028 7.8016 7.8016 7.8358 7.8358 8.4771 8.4771 9.4183 9.4183 12.4663 12.4663 k = 0.0795 0.0881-0.0000 ( 4355 PWs) bands (ev): -23.2186 -23.2186 -23.0743 -23.0743 -11.9804 -11.9804 -11.4177 -11.4177 -11.4078 -11.4078 -11.2940 -11.2940 -7.0267 -7.0267 -6.7942 -6.7942 -6.7636 -6.7636 -6.6993 -6.6993 -6.4587 -6.4587 -6.3931 -6.3931 0.6992 0.6992 1.1365 1.1365 1.6180 1.6180 1.6228 1.6228 1.7261 1.7261 2.3672 2.3672 2.4008 2.4008 2.4136 2.4136 2.5728 2.5728 3.7224 3.7224 4.0546 4.0546 4.0617 4.0617 5.3163 5.3163 5.4390 5.4390 5.5931 5.5931 5.7663 5.7663 5.8350 5.8350 6.5389 6.5389 7.0176 7.0176 7.7969 7.7969 7.8311 7.8311 8.4570 8.4570 9.4664 9.4664 12.4454 12.4454 k = 0.0909 0.1007-0.0000 ( 4351 PWs) bands (ev): -23.2179 -23.2179 -23.0750 -23.0750 -11.9778 -11.9778 -11.4188 -11.4188 -11.4089 -11.4089 -11.2972 -11.2972 -7.0255 -7.0255 -6.7967 -6.7967 -6.7628 -6.7628 -6.6954 -6.6953 -6.4571 -6.4571 -6.3923 -6.3923 0.6923 0.6923 1.1311 1.1311 1.6172 1.6172 1.6219 1.6219 1.7365 1.7365 2.3719 2.3719 2.4067 2.4067 2.4194 2.4194 2.5541 2.5541 3.7207 3.7207 4.0477 4.0477 4.0550 4.0550 5.3108 5.3108 5.4485 5.4485 5.6041 5.6041 5.7774 5.7774 5.8459 5.8459 6.5202 6.5202 7.0332 7.0332 7.7914 7.7914 7.8257 7.8257 8.4356 8.4356 9.5197 9.5197 12.4224 12.4224 k = 0.1023 0.1133 0.0000 ( 4351 PWs) bands (ev): -23.2170 -23.2170 -23.0757 -23.0757 -11.9747 -11.9747 -11.4199 -11.4199 -11.4102 -11.4102 -11.3008 -11.3008 -7.0242 -7.0242 -6.7993 -6.7993 -6.7618 -6.7618 -6.6912 -6.6912 -6.4553 -6.4553 -6.3916 -6.3916 0.6850 0.6850 1.1248 1.1248 1.6162 1.6162 1.6209 1.6209 1.7478 1.7478 2.3772 2.3772 2.4134 2.4134 2.4259 2.4259 2.5337 2.5337 3.7182 3.7182 4.0401 4.0401 4.0475 4.0475 5.3058 5.3058 5.4586 5.4586 5.6159 5.6159 5.7899 5.7899 5.8581 5.8581 6.5005 6.5005 7.0494 7.0494 7.7852 7.7852 7.8196 7.8196 8.4132 8.4132 9.5778 9.5778 12.3977 12.3977 k = 0.1136 0.1259-0.0000 ( 4359 PWs) bands (ev): -23.2161 -23.2161 -23.0766 -23.0766 -11.9714 -11.9714 -11.4212 -11.4212 -11.4116 -11.4116 -11.3049 -11.3049 -7.0227 -7.0227 -6.8019 -6.8019 -6.7608 -6.7608 -6.6869 -6.6869 -6.4535 -6.4535 -6.3907 -6.3907 0.6772 0.6772 1.1179 1.1179 1.6152 1.6152 1.6197 1.6197 1.7600 1.7600 2.3831 2.3831 2.4207 2.4207 2.4330 2.4330 2.5118 2.5118 3.7149 3.7149 4.0317 4.0317 4.0393 4.0394 5.3017 5.3017 5.4692 5.4692 5.6285 5.6285 5.8037 5.8037 5.8716 5.8716 6.4801 6.4801 7.0660 7.0660 7.7782 7.7782 7.8126 7.8126 8.3901 8.3901 9.6403 9.6403 12.3717 12.3717 k = 0.1250 0.1385-0.0000 ( 4359 PWs) bands (ev): -23.2151 -23.2151 -23.0776 -23.0776 -11.9676 -11.9676 -11.4226 -11.4226 -11.4132 -11.4132 -11.3093 -11.3093 -7.0211 -7.0211 -6.8045 -6.8045 -6.7596 -6.7596 -6.6825 -6.6825 -6.4515 -6.4515 -6.3899 -6.3899 0.6692 0.6692 1.1103 1.1103 1.6141 1.6141 1.6185 1.6185 1.7728 1.7728 2.3895 2.3895 2.4285 2.4285 2.4408 2.4408 2.4889 2.4889 3.7104 3.7104 4.0228 4.0228 4.0306 4.0306 5.2983 5.2983 5.4803 5.4803 5.6417 5.6417 5.8188 5.8188 5.8863 5.8863 6.4590 6.4590 7.0828 7.0828 7.7706 7.7706 7.8050 7.8050 8.3664 8.3664 9.7068 9.7068 12.3447 12.3447 k = 0.1364 0.1511-0.0000 ( 4367 PWs) bands (ev): -23.2139 -23.2139 -23.0786 -23.0786 -11.9635 -11.9635 -11.4241 -11.4241 -11.4148 -11.4148 -11.3143 -11.3142 -7.0193 -7.0193 -6.8071 -6.8071 -6.7583 -6.7583 -6.6779 -6.6779 -6.4493 -6.4493 -6.3889 -6.3889 0.6609 0.6609 1.1021 1.1021 1.6128 1.6128 1.6171 1.6171 1.7861 1.7861 2.3965 2.3965 2.4362 2.4362 2.4491 2.4491 2.4657 2.4658 3.7048 3.7048 4.0133 4.0133 4.0212 4.0212 5.2960 5.2960 5.4919 5.4919 5.6554 5.6555 5.8350 5.8350 5.9022 5.9022 6.4374 6.4374 7.0998 7.0998 7.7622 7.7622 7.7967 7.7967 8.3425 8.3425 9.7772 9.7772 12.3173 12.3173 k = 0.1477 0.1636-0.0000 ( 4383 PWs) bands (ev): -23.2127 -23.2127 -23.0798 -23.0798 -11.9590 -11.9590 -11.4257 -11.4257 -11.4166 -11.4166 -11.3196 -11.3196 -7.0174 -7.0174 -6.8097 -6.8097 -6.7568 -6.7568 -6.6733 -6.6733 -6.4472 -6.4472 -6.3880 -6.3880 0.6525 0.6525 1.0931 1.0931 1.6115 1.6115 1.6157 1.6157 1.7998 1.7998 2.4041 2.4041 2.4345 2.4345 2.4512 2.4513 2.4585 2.4586 3.6980 3.6980 4.0032 4.0032 4.0113 4.0113 5.2947 5.2947 5.5040 5.5040 5.6696 5.6696 5.8523 5.8523 5.9191 5.9191 6.4155 6.4155 7.1167 7.1168 7.7531 7.7531 7.7876 7.7876 8.3181 8.3181 9.8510 9.8510 12.2896 12.2896 k = 0.1591 0.1762-0.0000 ( 4383 PWs) bands (ev): -23.2115 -23.2115 -23.0810 -23.0810 -11.9542 -11.9542 -11.4274 -11.4274 -11.4185 -11.4184 -11.3253 -11.3253 -7.0152 -7.0152 -6.8122 -6.8122 -6.7552 -6.7552 -6.6687 -6.6687 -6.4450 -6.4450 -6.3871 -6.3871 0.6442 0.6442 1.0836 1.0836 1.6101 1.6101 1.6142 1.6142 1.8136 1.8136 2.4082 2.4083 2.4159 2.4159 2.4583 2.4583 2.4679 2.4679 3.6899 3.6899 3.9927 3.9927 4.0009 4.0009 5.2945 5.2945 5.5167 5.5167 5.6843 5.6843 5.8707 5.8707 5.9372 5.9372 6.3935 6.3935 7.1337 7.1337 7.7433 7.7433 7.7778 7.7778 8.2937 8.2937 9.9281 9.9281 12.2622 12.2622 k = 0.1705 0.1888-0.0000 ( 4383 PWs) bands (ev): -23.2101 -23.2101 -23.0822 -23.0822 -11.9489 -11.9489 -11.4292 -11.4292 -11.4204 -11.4204 -11.3315 -11.3315 -7.0129 -7.0129 -6.8146 -6.8146 -6.7534 -6.7534 -6.6641 -6.6641 -6.4427 -6.4427 -6.3862 -6.3862 0.6359 0.6359 1.0735 1.0735 1.6086 1.6086 1.6126 1.6126 1.8275 1.8275 2.3852 2.3852 2.4223 2.4223 2.4682 2.4682 2.4778 2.4778 3.6804 3.6804 3.9819 3.9819 3.9902 3.9902 5.2955 5.2955 5.5298 5.5298 5.6993 5.6993 5.8901 5.8901 5.9562 5.9563 6.3713 6.3713 7.1506 7.1506 7.7327 7.7327 7.7673 7.7673 8.2690 8.2690 10.0082 10.0082 12.2352 12.2352 k = 0.1818 0.2014-0.0000 ( 4363 PWs) bands (ev): -23.2086 -23.2086 -23.0836 -23.0836 -11.9433 -11.9433 -11.4310 -11.4310 -11.4224 -11.4224 -11.3380 -11.3380 -7.0103 -7.0103 -6.8170 -6.8170 -6.7514 -6.7514 -6.6595 -6.6595 -6.4404 -6.4404 -6.3853 -6.3853 0.6279 0.6279 1.0629 1.0629 1.6071 1.6071 1.6110 1.6110 1.8414 1.8414 2.3592 2.3592 2.4319 2.4319 2.4788 2.4788 2.4883 2.4883 3.6695 3.6695 3.9707 3.9707 3.9791 3.9791 5.2976 5.2976 5.5434 5.5434 5.7145 5.7145 5.9105 5.9105 5.9764 5.9764 6.3491 6.3491 7.1673 7.1673 7.7216 7.7216 7.7562 7.7562 8.2444 8.2444 10.0910 10.0910 12.2089 12.2089 k = 0.1932 0.2140-0.0000 ( 4363 PWs) bands (ev): -23.2071 -23.2071 -23.0850 -23.0850 -11.9374 -11.9374 -11.4329 -11.4329 -11.4245 -11.4245 -11.3450 -11.3450 -7.0076 -7.0076 -6.8193 -6.8193 -6.7492 -6.7492 -6.6550 -6.6550 -6.4381 -6.4381 -6.3844 -6.3844 0.6202 0.6202 1.0516 1.0516 1.6055 1.6055 1.6093 1.6093 1.8550 1.8550 2.3329 2.3329 2.4422 2.4423 2.4899 2.4899 2.4991 2.4991 3.6572 3.6572 3.9593 3.9593 3.9677 3.9677 5.3009 5.3009 5.5574 5.5574 5.7298 5.7298 5.9317 5.9317 5.9973 5.9973 6.3270 6.3270 7.1838 7.1838 7.7096 7.7096 7.7442 7.7442 8.2196 8.2196 10.1765 10.1765 12.1837 12.1837 k = 0.2045 0.2266-0.0000 ( 4371 PWs) bands (ev): -23.2055 -23.2055 -23.0865 -23.0865 -11.9310 -11.9310 -11.4348 -11.4348 -11.4267 -11.4267 -11.3524 -11.3524 -7.0048 -7.0048 -6.8216 -6.8216 -6.7468 -6.7468 -6.6505 -6.6505 -6.4358 -6.4358 -6.3836 -6.3836 0.6128 0.6128 1.0399 1.0399 1.6038 1.6038 1.6075 1.6075 1.8681 1.8681 2.3067 2.3067 2.4534 2.4534 2.5013 2.5013 2.5103 2.5103 3.6435 3.6435 3.9476 3.9476 3.9561 3.9561 5.3053 5.3053 5.5717 5.5717 5.7452 5.7452 5.9536 5.9536 6.0189 6.0190 6.3049 6.3049 7.2001 7.2001 7.6969 7.6969 7.7315 7.7315 8.1948 8.1948 10.2643 10.2643 12.1597 12.1597 k = 0.2159 0.2392-0.0000 ( 4367 PWs) bands (ev): -23.2038 -23.2038 -23.0881 -23.0881 -11.9243 -11.9243 -11.4368 -11.4368 -11.4289 -11.4289 -11.3603 -11.3602 -7.0017 -7.0017 -6.8238 -6.8238 -6.7442 -6.7442 -6.6462 -6.6462 -6.4336 -6.4336 -6.3828 -6.3828 0.6059 0.6059 1.0277 1.0277 1.6022 1.6022 1.6058 1.6058 1.8808 1.8808 2.2808 2.2808 2.4653 2.4653 2.5131 2.5131 2.5217 2.5218 3.6285 3.6285 3.9359 3.9359 3.9444 3.9444 5.3108 5.3108 5.5862 5.5863 5.7606 5.7606 5.9761 5.9761 6.0414 6.0414 6.2832 6.2832 7.2162 7.2162 7.6837 7.6837 7.7183 7.7183 8.1700 8.1700 10.3542 10.3542 12.1373 12.1373 k = 0.2273 0.2518-0.0000 ( 4375 PWs) bands (ev): -23.2020 -23.2020 -23.0898 -23.0898 -11.9172 -11.9172 -11.4388 -11.4388 -11.4311 -11.4311 -11.3685 -11.3685 -6.9985 -6.9985 -6.8259 -6.8259 -6.7415 -6.7415 -6.6421 -6.6421 -6.4314 -6.4314 -6.3822 -6.3822 0.5995 0.5995 1.0150 1.0150 1.6005 1.6005 1.6039 1.6039 1.8929 1.8929 2.2552 2.2552 2.4779 2.4780 2.5252 2.5252 2.5334 2.5335 3.6121 3.6121 3.9240 3.9240 3.9325 3.9325 5.3173 5.3173 5.6010 5.6010 5.7758 5.7758 5.9992 5.9992 6.0645 6.0645 6.2618 6.2618 7.2320 7.2320 7.6697 7.6697 7.7043 7.7043 8.1452 8.1452 10.4460 10.4460 12.1164 12.1164 k = 0.2386 0.2643-0.0000 ( 4379 PWs) bands (ev): -23.2002 -23.2002 -23.0915 -23.0915 -11.9097 -11.9097 -11.4408 -11.4408 -11.4334 -11.4333 -11.3771 -11.3771 -6.9951 -6.9951 -6.8281 -6.8281 -6.7385 -6.7385 -6.6381 -6.6381 -6.4293 -6.4293 -6.3815 -6.3815 0.5936 0.5936 1.0018 1.0018 1.5987 1.5987 1.6021 1.6021 1.9042 1.9042 2.2303 2.2303 2.4914 2.4915 2.5374 2.5374 2.5453 2.5454 3.5945 3.5945 3.9122 3.9122 3.9206 3.9206 5.3249 5.3249 5.6158 5.6158 5.7909 5.7909 6.0225 6.0225 6.0882 6.0883 6.2410 6.2410 7.2476 7.2476 7.6552 7.6552 7.6897 7.6897 8.1205 8.1205 10.5396 10.5396 12.0975 12.0975 k = 0.2500 0.2769-0.0000 ( 4379 PWs) bands (ev): -23.1983 -23.1983 -23.0933 -23.0933 -11.9019 -11.9019 -11.4428 -11.4428 -11.4356 -11.4356 -11.3860 -11.3860 -6.9915 -6.9915 -6.8302 -6.8302 -6.7354 -6.7354 -6.6342 -6.6342 -6.4272 -6.4272 -6.3810 -6.3810 0.5884 0.5884 0.9883 0.9883 1.5970 1.5970 1.6003 1.6003 1.9146 1.9147 2.2060 2.2060 2.5057 2.5058 2.5497 2.5497 2.5574 2.5574 3.5757 3.5757 3.9004 3.9004 3.9088 3.9088 5.3337 5.3337 5.6307 5.6307 5.8059 5.8059 6.0457 6.0457 6.1124 6.1124 6.2212 6.2212 7.2629 7.2629 7.6400 7.6400 7.6745 7.6745 8.0958 8.0958 10.6346 10.6346 12.0804 12.0804 k = 0.2614 0.2895-0.0000 ( 4379 PWs) bands (ev): -23.1963 -23.1963 -23.0952 -23.0952 -11.8937 -11.8937 -11.4449 -11.4449 -11.4379 -11.4379 -11.3954 -11.3954 -6.9878 -6.9878 -6.8323 -6.8323 -6.7320 -6.7320 -6.6306 -6.6306 -6.4252 -6.4252 -6.3806 -6.3806 0.5838 0.5838 0.9744 0.9744 1.5953 1.5953 1.5984 1.5984 1.9242 1.9243 2.1826 2.1826 2.5209 2.5209 2.5621 2.5621 2.5695 2.5695 3.5558 3.5558 3.8887 3.8887 3.8970 3.8970 5.3433 5.3433 5.6455 5.6455 5.8205 5.8205 6.0680 6.0680 6.1370 6.1370 6.2032 6.2032 7.2780 7.2780 7.6244 7.6244 7.6587 7.6587 8.0712 8.0712 10.7307 10.7307 12.0655 12.0655 k = 0.2727 0.3021-0.0000 ( 4395 PWs) bands (ev): -23.1943 -23.1943 -23.0971 -23.0971 -11.8852 -11.8852 -11.4469 -11.4469 -11.4402 -11.4402 -11.4051 -11.4051 -6.9839 -6.9839 -6.8344 -6.8344 -6.7285 -6.7285 -6.6273 -6.6273 -6.4234 -6.4234 -6.3803 -6.3803 0.5799 0.5799 0.9602 0.9602 1.5935 1.5935 1.5965 1.5965 1.9329 1.9329 2.1600 2.1600 2.5368 2.5368 2.5746 2.5746 2.5817 2.5817 3.5349 3.5349 3.8771 3.8771 3.8853 3.8853 5.3538 5.3538 5.6601 5.6601 5.8347 5.8347 6.0877 6.0877 6.1612 6.1612 6.1892 6.1892 7.2929 7.2929 7.6081 7.6081 7.6424 7.6424 8.0468 8.0468 10.8279 10.8279 12.0528 12.0528 k = 0.2841 0.3147-0.0000 ( 4395 PWs) bands (ev): -23.1922 -23.1922 -23.0991 -23.0991 -11.8762 -11.8762 -11.4489 -11.4489 -11.4424 -11.4424 -11.4152 -11.4152 -6.9799 -6.9799 -6.8365 -6.8365 -6.7247 -6.7247 -6.6241 -6.6241 -6.4216 -6.4216 -6.3800 -6.3800 0.5767 0.5767 0.9456 0.9456 1.5918 1.5918 1.5947 1.5947 1.9405 1.9405 2.1384 2.1384 2.5535 2.5536 2.5870 2.5870 2.5938 2.5939 3.5130 3.5130 3.8658 3.8658 3.8738 3.8738 5.3651 5.3651 5.6745 5.6745 5.8486 5.8486 6.1006 6.1006 6.1772 6.1772 6.1914 6.1914 7.3075 7.3076 7.5915 7.5915 7.6256 7.6256 8.0225 8.0225 10.9257 10.9257 12.0424 12.0424 k = 0.2955 0.3273-0.0000 ( 4395 PWs) bands (ev): -23.1900 -23.1900 -23.1011 -23.1011 -11.8670 -11.8670 -11.4509 -11.4509 -11.4446 -11.4446 -11.4255 -11.4255 -6.9758 -6.9758 -6.8387 -6.8387 -6.7207 -6.7207 -6.6213 -6.6213 -6.4198 -6.4198 -6.3799 -6.3799 0.5744 0.5744 0.9309 0.9309 1.5901 1.5902 1.5929 1.5929 1.9471 1.9472 2.1180 2.1180 2.5709 2.5710 2.5993 2.5993 2.6061 2.6061 3.4902 3.4902 3.8547 3.8547 3.8625 3.8625 5.3772 5.3773 5.6884 5.6884 5.8620 5.8620 6.1012 6.1012 6.1853 6.1853 6.2148 6.2148 7.3220 7.3220 7.5746 7.5746 7.6084 7.6084 7.9984 7.9984 11.0239 11.0239 12.0342 12.0342 k = 0.3068 0.3399-0.0000 ( 4379 PWs) bands (ev): -23.1878 -23.1878 -23.1032 -23.1032 -11.8574 -11.8574 -11.4530 -11.4530 -11.4468 -11.4468 -11.4361 -11.4360 -6.9714 -6.9714 -6.8408 -6.8408 -6.7165 -6.7165 -6.6188 -6.6188 -6.4182 -6.4182 -6.3799 -6.3799 0.5728 0.5728 0.9159 0.9159 1.5885 1.5885 1.5911 1.5911 1.9528 1.9528 2.0986 2.0986 2.5888 2.5889 2.6114 2.6114 2.6184 2.6185 3.4666 3.4666 3.8439 3.8439 3.8515 3.8515 5.3902 5.3902 5.7018 5.7018 5.8749 5.8749 6.0917 6.0917 6.2027 6.2027 6.2402 6.2402 7.3362 7.3362 7.5574 7.5574 7.5909 7.5909 7.9745 7.9745 11.1222 11.1222 12.0285 12.0285 k = 0.3182 0.3525-0.0000 ( 4371 PWs) bands (ev): -23.1855 -23.1855 -23.1054 -23.1054 -11.8474 -11.8474 -11.4555 -11.4555 -11.4492 -11.4490 -11.4464 -11.4462 -6.9670 -6.9670 -6.8430 -6.8430 -6.7122 -6.7122 -6.6166 -6.6166 -6.4166 -6.4166 -6.3800 -6.3800 0.5720 0.5720 0.9007 0.9007 1.5869 1.5869 1.5894 1.5894 1.9574 1.9574 2.0805 2.0805 2.6069 2.6070 2.6234 2.6234 2.6311 2.6312 3.4424 3.4424 3.8335 3.8335 3.8409 3.8409 5.4037 5.4037 5.7145 5.7145 5.8871 5.8872 6.0777 6.0777 6.2250 6.2250 6.2658 6.2658 7.3500 7.3501 7.5400 7.5400 7.5732 7.5732 7.9508 7.9509 11.2202 11.2202 12.0251 12.0251 k = 0.3295 0.3650-0.0000 ( 4387 PWs) bands (ev): -23.1832 -23.1832 -23.1076 -23.1076 -11.8371 -11.8371 -11.4612 -11.4611 -11.4542 -11.4541 -11.4509 -11.4508 -6.9625 -6.9625 -6.8453 -6.8453 -6.7078 -6.7078 -6.6148 -6.6148 -6.4152 -6.4152 -6.3803 -6.3803 0.5721 0.5721 0.8854 0.8854 1.5853 1.5854 1.5877 1.5877 1.9610 1.9610 2.0636 2.0636 2.6241 2.6242 2.6350 2.6350 2.6450 2.6451 3.4174 3.4174 3.8235 3.8235 3.8306 3.8306 5.4177 5.4177 5.7261 5.7261 5.8987 5.8987 6.0622 6.0622 6.2492 6.2492 6.2911 6.2911 7.3634 7.3634 7.5225 7.5225 7.5554 7.5554 7.9274 7.9274 11.3176 11.3176 12.0240 12.0240 k = 0.3409 0.3776-0.0000 ( 4379 PWs) bands (ev): -23.1808 -23.1808 -23.1099 -23.1099 -11.8265 -11.8265 -11.4716 -11.4716 -11.4570 -11.4570 -11.4529 -11.4529 -6.9579 -6.9579 -6.8476 -6.8476 -6.7031 -6.7031 -6.6133 -6.6133 -6.4137 -6.4137 -6.3806 -6.3806 0.5729 0.5729 0.8700 0.8700 1.5839 1.5839 1.5861 1.5861 1.9637 1.9637 2.0479 2.0480 2.6393 2.6394 2.6463 2.6463 2.6614 2.6615 3.3919 3.3919 3.8139 3.8139 3.8207 3.8207 5.4323 5.4323 5.7365 5.7365 5.9097 5.9097 6.0469 6.0469 6.2745 6.2745 6.3164 6.3164 7.3762 7.3762 7.5053 7.5053 7.5378 7.5378 7.9042 7.9042 11.4138 11.4138 12.0252 12.0252 k = 0.3523 0.3902-0.0000 ( 4383 PWs) bands (ev): -23.1785 -23.1785 -23.1122 -23.1122 -11.8156 -11.8156 -11.4833 -11.4833 -11.4588 -11.4588 -11.4548 -11.4548 -6.9533 -6.9533 -6.8500 -6.8500 -6.6984 -6.6984 -6.6122 -6.6122 -6.4124 -6.4124 -6.3811 -6.3811 0.5747 0.5747 0.8546 0.8546 1.5825 1.5825 1.5845 1.5845 1.9655 1.9655 2.0336 2.0336 2.6522 2.6522 2.6571 2.6571 2.6806 2.6806 3.3659 3.3659 3.8048 3.8048 3.8113 3.8113 5.4473 5.4473 5.7454 5.7454 5.9198 5.9198 6.0322 6.0322 6.2999 6.2999 6.3412 6.3412 7.3880 7.3880 7.4885 7.4885 7.5208 7.5208 7.8813 7.8813 11.5084 11.5084 12.0288 12.0288 k = 0.3636 0.4028-0.0000 ( 4391 PWs) bands (ev): -23.1760 -23.1760 -23.1145 -23.1145 -11.8044 -11.8044 -11.4954 -11.4954 -11.4605 -11.4605 -11.4566 -11.4566 -6.9485 -6.9485 -6.8526 -6.8526 -6.6935 -6.6935 -6.6115 -6.6115 -6.4111 -6.4111 -6.3817 -6.3817 0.5772 0.5772 0.8392 0.8392 1.5811 1.5811 1.5830 1.5830 1.9666 1.9666 2.0205 2.0205 2.6633 2.6633 2.6672 2.6672 2.7017 2.7018 3.3394 3.3394 3.7962 3.7962 3.8023 3.8023 5.4628 5.4628 5.7525 5.7525 5.9291 5.9292 6.0187 6.0187 6.3252 6.3252 6.3653 6.3653 7.3977 7.3978 7.4724 7.4724 7.5053 7.5053 7.8587 7.8587 11.6009 11.6009 12.0344 12.0344 k = 0.3750 0.4154-0.0000 ( 4383 PWs) bands (ev): -23.1735 -23.1735 -23.1169 -23.1169 -11.7930 -11.7930 -11.5077 -11.5077 -11.4619 -11.4619 -11.4583 -11.4583 -6.9437 -6.9437 -6.8552 -6.8552 -6.6885 -6.6885 -6.6112 -6.6112 -6.4098 -6.4098 -6.3824 -6.3824 0.5806 0.5806 0.8237 0.8237 1.5799 1.5799 1.5816 1.5816 1.9670 1.9670 2.0088 2.0088 2.6734 2.6734 2.6767 2.6767 2.7242 2.7242 3.3126 3.3126 3.7882 3.7882 3.7939 3.7939 5.4786 5.4786 5.7575 5.7575 5.9377 5.9377 6.0069 6.0069 6.3501 6.3501 6.3888 6.3888 7.4038 7.4038 7.4576 7.4576 7.4929 7.4929 7.8365 7.8365 11.6903 11.6903 12.0422 12.0422 k = 0.3864 0.4280-0.0000 ( 4391 PWs) bands (ev): -23.1711 -23.1711 -23.1193 -23.1193 -11.7812 -11.7812 -11.5203 -11.5203 -11.4632 -11.4632 -11.4600 -11.4600 -6.9389 -6.9389 -6.8579 -6.8579 -6.6835 -6.6835 -6.6114 -6.6114 -6.4085 -6.4085 -6.3832 -6.3832 0.5849 0.5849 0.8084 0.8084 1.5787 1.5787 1.5803 1.5803 1.9667 1.9667 1.9983 1.9983 2.6826 2.6826 2.6854 2.6855 2.7475 2.7475 3.2855 3.2855 3.7808 3.7808 3.7861 3.7861 5.4948 5.4948 5.7601 5.7601 5.9453 5.9453 5.9969 5.9969 6.3744 6.3744 6.4111 6.4111 7.4037 7.4038 7.4436 7.4436 7.4866 7.4867 7.8145 7.8145 11.7760 11.7760 12.0518 12.0518 k = 0.3977 0.4406-0.0000 ( 4391 PWs) bands (ev): -23.1685 -23.1685 -23.1218 -23.1218 -11.7692 -11.7692 -11.5331 -11.5331 -11.4644 -11.4644 -11.4615 -11.4615 -6.9341 -6.9341 -6.8608 -6.8608 -6.6784 -6.6784 -6.6120 -6.6119 -6.4073 -6.4073 -6.3841 -6.3841 0.5900 0.5900 0.7932 0.7932 1.5776 1.5776 1.5791 1.5791 1.9660 1.9660 1.9891 1.9891 2.6910 2.6910 2.6935 2.6935 2.7716 2.7716 3.2581 3.2581 3.7740 3.7740 3.7789 3.7789 5.5112 5.5112 5.7600 5.7600 5.9520 5.9520 5.9891 5.9891 6.3977 6.3977 6.4323 6.4323 7.3973 7.3974 7.4295 7.4295 7.4883 7.4883 7.7929 7.7930 11.8568 11.8568 12.0632 12.0632 k = 0.4091 0.4532-0.0000 ( 4391 PWs) bands (ev): -23.1660 -23.1660 -23.1243 -23.1243 -11.7570 -11.7570 -11.5461 -11.5461 -11.4655 -11.4655 -11.4628 -11.4628 -6.9293 -6.9293 -6.8638 -6.8638 -6.6732 -6.6732 -6.6129 -6.6129 -6.4060 -6.4060 -6.3852 -6.3852 0.5958 0.5958 0.7781 0.7781 1.5767 1.5767 1.5780 1.5780 1.9648 1.9648 1.9812 1.9812 2.6987 2.6987 2.7008 2.7008 2.7962 2.7962 3.2305 3.2305 3.7679 3.7679 3.7723 3.7723 5.5279 5.5279 5.7572 5.7572 5.9577 5.9577 5.9835 5.9835 6.4200 6.4200 6.4520 6.4520 7.3872 7.3872 7.4149 7.4149 7.4960 7.4961 7.7718 7.7718 11.9316 11.9316 12.0761 12.0761 k = 0.4205 0.4657-0.0000 ( 4383 PWs) bands (ev): -23.1634 -23.1634 -23.1268 -23.1268 -11.7445 -11.7445 -11.5592 -11.5592 -11.4664 -11.4664 -11.4641 -11.4641 -6.9245 -6.9245 -6.8669 -6.8669 -6.6681 -6.6681 -6.6143 -6.6143 -6.4047 -6.4047 -6.3862 -6.3862 0.6025 0.6025 0.7633 0.7633 1.5758 1.5759 1.5770 1.5770 1.9634 1.9634 1.9744 1.9744 2.7056 2.7056 2.7074 2.7074 2.8214 2.8214 3.2028 3.2028 3.7625 3.7625 3.7664 3.7664 5.5447 5.5447 5.7516 5.7516 5.9624 5.9624 5.9802 5.9802 6.4409 6.4409 6.4700 6.4700 7.3759 7.3759 7.4003 7.4003 7.5073 7.5074 7.7510 7.7510 11.9987 11.9987 12.0903 12.0903 k = 0.4318 0.4783-0.0000 ( 4383 PWs) bands (ev): -23.1608 -23.1608 -23.1294 -23.1294 -11.7319 -11.7319 -11.5724 -11.5724 -11.4672 -11.4672 -11.4652 -11.4652 -6.9197 -6.9197 -6.8701 -6.8701 -6.6630 -6.6630 -6.6162 -6.6162 -6.4035 -6.4035 -6.3874 -6.3874 0.6100 0.6100 0.7488 0.7488 1.5751 1.5751 1.5761 1.5761 1.9617 1.9617 1.9688 1.9688 2.7116 2.7116 2.7131 2.7131 2.8471 2.8471 3.1749 3.1749 3.7578 3.7578 3.7611 3.7611 5.5616 5.5616 5.7436 5.7436 5.9661 5.9661 5.9786 5.9787 6.4601 6.4601 6.4860 6.4860 7.3648 7.3648 7.3862 7.3862 7.5205 7.5206 7.7306 7.7306 12.0569 12.0569 12.1055 12.1055 k = 0.4432 0.4909-0.0000 ( 4383 PWs) bands (ev): -23.1582 -23.1582 -23.1319 -23.1319 -11.7191 -11.7191 -11.5857 -11.5857 -11.4679 -11.4679 -11.4662 -11.4662 -6.9150 -6.9150 -6.8736 -6.8736 -6.6580 -6.6580 -6.6184 -6.6184 -6.4022 -6.4021 -6.3886 -6.3886 0.6182 0.6182 0.7345 0.7345 1.5745 1.5745 1.5753 1.5753 1.9600 1.9600 1.9643 1.9643 2.7168 2.7168 2.7180 2.7180 2.8731 2.8731 3.1470 3.1470 3.7538 3.7538 3.7566 3.7566 5.5786 5.5786 5.7334 5.7334 5.9690 5.9690 5.9785 5.9785 6.4774 6.4774 6.4997 6.4997 7.3549 7.3549 7.3732 7.3732 7.5350 7.5350 7.7106 7.7106 12.1046 12.1046 12.1211 12.1211 k = 0.4545 0.5035-0.0000 ( 4375 PWs) bands (ev): -23.1555 -23.1555 -23.1345 -23.1345 -11.7061 -11.7061 -11.5991 -11.5991 -11.4684 -11.4684 -11.4670 -11.4670 -6.9104 -6.9104 -6.8771 -6.8771 -6.6531 -6.6531 -6.6210 -6.6210 -6.4008 -6.4008 -6.3899 -6.3899 0.6271 0.6271 0.7206 0.7206 1.5740 1.5740 1.5747 1.5747 1.9584 1.9584 1.9609 1.9609 2.7211 2.7211 2.7221 2.7221 2.8995 2.8996 3.1191 3.1191 3.7506 3.7506 3.7528 3.7528 5.5957 5.5957 5.7215 5.7215 5.9714 5.9714 5.9789 5.9789 6.4926 6.4926 6.5109 6.5109 7.3466 7.3466 7.3616 7.3616 7.5502 7.5502 7.6910 7.6910 12.1368 12.1368 12.1410 12.1410 k = 0.4659 0.5161-0.0000 ( 4383 PWs) bands (ev): -23.1529 -23.1529 -23.1371 -23.1371 -11.6930 -11.6930 -11.6126 -11.6126 -11.4687 -11.4687 -11.4677 -11.4677 -6.9058 -6.9058 -6.8808 -6.8808 -6.6483 -6.6483 -6.6240 -6.6240 -6.3995 -6.3995 -6.3912 -6.3912 0.6367 0.6367 0.7071 0.7071 1.5736 1.5736 1.5741 1.5741 1.9568 1.9568 1.9583 1.9583 2.7245 2.7245 2.7252 2.7252 2.9263 2.9263 3.0912 3.0912 3.7481 3.7481 3.7498 3.7498 5.6127 5.6127 5.7080 5.7080 5.9735 5.9735 5.9794 5.9794 6.5052 6.5052 6.5193 6.5193 7.3402 7.3402 7.3517 7.3517 7.5661 7.5661 7.6718 7.6718 12.1519 12.1519 12.1660 12.1660 k = 0.4773 0.5287-0.0000 ( 4379 PWs) bands (ev): -23.1503 -23.1503 -23.1397 -23.1397 -11.6797 -11.6797 -11.6261 -11.6261 -11.4689 -11.4689 -11.4683 -11.4683 -6.9013 -6.9013 -6.8846 -6.8846 -6.6437 -6.6437 -6.6274 -6.6274 -6.3981 -6.3981 -6.3925 -6.3925 0.6470 0.6470 0.6941 0.6941 1.5734 1.5734 1.5737 1.5737 1.9557 1.9557 1.9566 1.9566 2.7269 2.7269 2.7274 2.7274 2.9533 2.9533 3.0634 3.0634 3.7464 3.7464 3.7476 3.7476 5.6295 5.6295 5.6936 5.6936 5.9754 5.9754 5.9796 5.9796 6.5152 6.5152 6.5248 6.5248 7.3361 7.3361 7.3439 7.3439 7.5825 7.5826 7.6531 7.6531 12.1655 12.1655 12.1804 12.1804 k = 0.4886 0.5413-0.0000 ( 4384 PWs) bands (ev): -23.1476 -23.1476 -23.1424 -23.1424 -11.6664 -11.6664 -11.6395 -11.6395 -11.4690 -11.4690 -11.4687 -11.4687 -6.8970 -6.8970 -6.8886 -6.8886 -6.6392 -6.6392 -6.6311 -6.6311 -6.3967 -6.3967 -6.3939 -6.3939 0.6579 0.6579 0.6815 0.6815 1.5733 1.5733 1.5734 1.5734 1.9550 1.9550 1.9555 1.9555 2.7285 2.7285 2.7287 2.7287 2.9805 2.9805 3.0356 3.0356 3.7455 3.7455 3.7461 3.7461 5.6461 5.6461 5.6783 5.6783 5.9771 5.9771 5.9792 5.9792 6.5222 6.5222 6.5271 6.5271 7.3343 7.3343 7.3383 7.3383 7.5995 7.5995 7.6348 7.6348 12.1766 12.1766 12.1857 12.1857 k = 0.5000 0.5539-0.0000 ( 4384 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6530 -11.6530 -11.6530 -11.6530 -11.4689 -11.4689 -11.4689 -11.4689 -6.8928 -6.8928 -6.8927 -6.8927 -6.6350 -6.6350 -6.6350 -6.6350 -6.3953 -6.3953 -6.3953 -6.3953 0.6694 0.6694 0.6694 0.6694 1.5733 1.5733 1.5733 1.5733 1.9549 1.9549 1.9549 1.9549 2.7291 2.7291 2.7291 2.7291 3.0080 3.0080 3.0080 3.0080 3.7454 3.7454 3.7454 3.7454 5.6624 5.6624 5.6624 5.6624 5.9784 5.9784 5.9784 5.9784 6.5262 6.5262 6.5262 6.5262 7.3351 7.3351 7.3351 7.3351 7.6169 7.6169 7.6169 7.6169 12.1839 12.1839 12.1839 12.1839 k = 0.5000 0.5539-0.0000 ( 4384 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6530 -11.6530 -11.6530 -11.6530 -11.4689 -11.4689 -11.4689 -11.4689 -6.8928 -6.8928 -6.8927 -6.8927 -6.6350 -6.6350 -6.6350 -6.6350 -6.3953 -6.3953 -6.3953 -6.3953 0.6694 0.6694 0.6694 0.6694 1.5733 1.5733 1.5733 1.5733 1.9549 1.9549 1.9549 1.9549 2.7291 2.7291 2.7291 2.7291 3.0080 3.0080 3.0080 3.0080 3.7454 3.7454 3.7454 3.7454 5.6624 5.6624 5.6624 5.6624 5.9784 5.9784 5.9784 5.9784 6.5262 6.5262 6.5262 6.5262 7.3351 7.3351 7.3351 7.3351 7.6169 7.6169 7.6169 7.6169 12.1839 12.1839 12.1839 12.1839 k = 0.4912 0.5618 0.0118 ( 4384 PWs) bands (ev): -23.1451 -23.1451 -23.1449 -23.1449 -11.6538 -11.6538 -11.6529 -11.6527 -11.4690 -11.4687 -11.4683 -11.4682 -6.8949 -6.8942 -6.8912 -6.8908 -6.6403 -6.6385 -6.6315 -6.6299 -6.3987 -6.3976 -6.3932 -6.3920 0.6695 0.6696 0.6700 0.6702 1.5728 1.5730 1.5730 1.5734 1.9545 1.9547 1.9554 1.9560 2.7259 2.7287 2.7301 2.7301 3.0073 3.0074 3.0083 3.0108 3.7429 3.7437 3.7457 3.7459 5.6606 5.6638 5.6639 5.6646 5.9754 5.9765 5.9792 5.9802 6.5244 6.5256 6.5280 6.5296 7.3285 7.3345 7.3364 7.3382 7.6136 7.6159 7.6164 7.6228 12.1829 12.1832 12.1846 12.1848 k = 0.4824 0.5697 0.0237 ( 4386 PWs) bands (ev): -23.1452 -23.1452 -23.1448 -23.1448 -11.6562 -11.6561 -11.6524 -11.6521 -11.4687 -11.4681 -11.4667 -11.4664 -6.8973 -6.8955 -6.8895 -6.8890 -6.6457 -6.6421 -6.6280 -6.6249 -6.4020 -6.4002 -6.3913 -6.3888 0.6699 0.6700 0.6719 0.6724 1.5716 1.5721 1.5725 1.5732 1.9534 1.9538 1.9572 1.9584 2.7196 2.7250 2.7330 2.7331 3.0057 3.0059 3.0115 3.0165 3.7363 3.7378 3.7466 3.7472 5.6586 5.6652 5.6684 5.6697 5.9709 5.9741 5.9785 5.9812 6.5223 6.5266 6.5310 6.5360 7.3188 7.3350 7.3359 7.3406 7.6118 7.6144 7.6146 7.6310 12.1803 12.1809 12.1870 12.1875 k = 0.4736 0.5776 0.0355 ( 4394 PWs) bands (ev): -23.1455 -23.1455 -23.1445 -23.1445 -11.6601 -11.6598 -11.6515 -11.6511 -11.4683 -11.4673 -11.4640 -11.4636 -6.8998 -6.8967 -6.8877 -6.8875 -6.6512 -6.6458 -6.6246 -6.6201 -6.4054 -6.4029 -6.3897 -6.3856 0.6704 0.6706 0.6752 0.6760 1.5697 1.5705 1.5717 1.5728 1.9517 1.9524 1.9604 1.9622 2.7103 2.7181 2.7380 2.7381 3.0031 3.0032 3.0176 3.0246 3.7256 3.7279 3.7483 3.7492 5.6563 5.6661 5.6760 5.6779 5.9650 5.9713 5.9763 5.9817 6.5197 6.5272 6.5371 6.5454 7.3061 7.3310 7.3366 7.3445 7.6079 7.6108 7.6168 7.6411 12.1760 12.1769 12.1911 12.1919 k = 0.4649 0.5856 0.0473 ( 4394 PWs) bands (ev): -23.1459 -23.1459 -23.1441 -23.1441 -11.6652 -11.6649 -11.6503 -11.6497 -11.4675 -11.4663 -11.4604 -11.4599 -6.9025 -6.8978 -6.8861 -6.8857 -6.6568 -6.6495 -6.6211 -6.6154 -6.4087 -6.4058 -6.3883 -6.3826 0.6713 0.6715 0.6799 0.6809 1.5672 1.5682 1.5708 1.5722 1.9494 1.9504 1.9649 1.9673 2.6986 2.7083 2.7448 2.7450 2.9994 2.9996 3.0261 3.0348 3.7112 3.7142 3.7507 3.7518 5.6537 5.6668 5.6864 5.6886 5.9578 5.9685 5.9725 5.9821 6.5168 6.5271 6.5463 6.5575 7.2911 7.3222 7.3394 7.3497 7.6020 7.6056 7.6221 7.6526 12.1702 12.1714 12.1969 12.1980 k = 0.4561 0.5935 0.0592 ( 4396 PWs) bands (ev): -23.1464 -23.1464 -23.1436 -23.1436 -11.6714 -11.6711 -11.6487 -11.6480 -11.4665 -11.4650 -11.4561 -11.4554 -6.9054 -6.8988 -6.8850 -6.8837 -6.6626 -6.6533 -6.6175 -6.6109 -6.4120 -6.4089 -6.3871 -6.3796 0.6723 0.6726 0.6860 0.6872 1.5640 1.5653 1.5697 1.5714 1.9467 1.9479 1.9708 1.9737 2.6848 2.6961 2.7536 2.7538 2.9948 2.9950 3.0366 3.0466 3.6931 3.6968 3.7537 3.7550 5.6508 5.6671 5.6990 5.7012 5.9496 5.9663 5.9673 5.9826 6.5134 6.5265 6.5585 6.5721 7.2741 7.3100 7.3434 7.3559 7.5945 7.5989 7.6300 7.6652 12.1629 12.1642 12.2044 12.2058 k = 0.4473 0.6014 0.0710 ( 4388 PWs) bands (ev): -23.1470 -23.1470 -23.1430 -23.1430 -11.6786 -11.6782 -11.6468 -11.6459 -11.4653 -11.4634 -11.4512 -11.4504 -6.9085 -6.8998 -6.8840 -6.8815 -6.6684 -6.6571 -6.6139 -6.6065 -6.4153 -6.4122 -6.3861 -6.3768 0.6736 0.6739 0.6933 0.6948 1.5601 1.5616 1.5685 1.5704 1.9435 1.9449 1.9779 1.9812 2.6694 2.6819 2.7642 2.7643 2.9894 2.9896 3.0488 3.0598 3.6718 3.6762 3.7573 3.7589 5.6478 5.6672 5.7130 5.7148 5.9404 5.9609 5.9654 5.9837 6.5096 6.5254 6.5734 6.5891 7.2553 7.2950 7.3484 7.3632 7.5853 7.5907 7.6398 7.6786 12.1540 12.1555 12.2137 12.2153 k = 0.4385 0.6094 0.0828 ( 4392 PWs) bands (ev): -23.1478 -23.1478 -23.1423 -23.1423 -11.6866 -11.6861 -11.6445 -11.6435 -11.4638 -11.4616 -11.4459 -11.4450 -6.9118 -6.9007 -6.8832 -6.8792 -6.6743 -6.6611 -6.6103 -6.6023 -6.4184 -6.4156 -6.3854 -6.3742 0.6751 0.6755 0.7020 0.7037 1.5556 1.5573 1.5671 1.5694 1.9399 1.9415 1.9862 1.9900 2.6526 2.6660 2.7765 2.7767 2.9831 2.9833 3.0623 3.0740 3.6474 3.6524 3.7614 3.7632 5.6443 5.6668 5.7275 5.7280 5.9305 5.9536 5.9665 5.9860 6.5054 6.5237 6.5907 6.6082 7.2350 7.2775 7.3544 7.3715 7.5744 7.5810 7.6513 7.6927 12.1435 12.1450 12.2246 12.2265 k = 0.4297 0.6173 0.0947 ( 4384 PWs) bands (ev): -23.1486 -23.1486 -23.1415 -23.1415 -11.6952 -11.6947 -11.6419 -11.6407 -11.4620 -11.4596 -11.4404 -11.4393 -6.9151 -6.9016 -6.8826 -6.8769 -6.6802 -6.6651 -6.6066 -6.5982 -6.4215 -6.4192 -6.3849 -6.3717 0.6768 0.6773 0.7120 0.7140 1.5504 1.5523 1.5658 1.5682 1.9359 1.9378 1.9956 1.9997 2.6347 2.6489 2.7905 2.7907 2.9762 2.9763 3.0768 3.0890 3.6204 3.6260 3.7659 3.7680 5.6405 5.6661 5.7398 5.7414 5.9201 5.9454 5.9710 5.9905 6.5008 6.5215 6.6102 6.6292 7.2135 7.2579 7.3614 7.3807 7.5621 7.5699 7.6640 7.7071 12.1312 12.1328 12.2372 12.2393 k = 0.4209 0.6252 0.1065 ( 4380 PWs) bands (ev): -23.1496 -23.1496 -23.1406 -23.1406 -11.7043 -11.7037 -11.6389 -11.6376 -11.4600 -11.4573 -11.4347 -11.4335 -6.9187 -6.9025 -6.8821 -6.8745 -6.6862 -6.6692 -6.6028 -6.5943 -6.4245 -6.4229 -6.3846 -6.3693 0.6787 0.6792 0.7232 0.7254 1.5446 1.5467 1.5645 1.5670 1.9318 1.9339 2.0060 2.0105 2.6159 2.6307 2.8061 2.8062 2.9686 2.9686 3.0922 3.1047 3.5910 3.5972 3.7709 3.7731 5.6365 5.6650 5.7485 5.7534 5.9093 5.9367 5.9798 5.9980 6.4957 6.5187 6.6316 6.6519 7.1908 7.2366 7.3691 7.3906 7.5482 7.5575 7.6778 7.7220 12.1170 12.1186 12.2515 12.2539 k = 0.4122 0.6332 0.1183 ( 4364 PWs) bands (ev): -23.1506 -23.1506 -23.1396 -23.1396 -11.7138 -11.7132 -11.6356 -11.6341 -11.4578 -11.4548 -11.4290 -11.4276 -6.9223 -6.9035 -6.8817 -6.8720 -6.6922 -6.6733 -6.5989 -6.5905 -6.4274 -6.4267 -6.3846 -6.3672 0.6808 0.6814 0.7357 0.7381 1.5382 1.5405 1.5631 1.5658 1.9275 1.9299 2.0173 2.0221 2.5964 2.6116 2.8232 2.8232 2.9603 2.9605 3.1081 3.1208 3.5597 3.5663 3.7761 3.7785 5.6322 5.6635 5.7533 5.7624 5.8984 5.9276 5.9939 6.0094 6.4901 6.5154 6.6547 6.6760 7.1672 7.2137 7.3774 7.4013 7.5329 7.5441 7.6924 7.7371 12.1006 12.1021 12.2674 12.2700 k = 0.4034 0.6411 0.1302 ( 4364 PWs) bands (ev): -23.1517 -23.1517 -23.1385 -23.1385 -11.7236 -11.7229 -11.6320 -11.6304 -11.4554 -11.4521 -11.4233 -11.4218 -6.9261 -6.9046 -6.8814 -6.8695 -6.6982 -6.6775 -6.5949 -6.5868 -6.4306 -6.4301 -6.3848 -6.3653 0.6830 0.6836 0.7493 0.7520 1.5311 1.5335 1.5618 1.5646 1.9232 1.9258 2.0295 2.0345 2.5762 2.5917 2.8414 2.8417 2.9516 2.9521 3.1246 3.1373 3.5266 3.5337 3.7816 3.7842 5.6275 5.6614 5.7538 5.7678 5.8874 5.9182 6.0132 6.0252 6.4840 6.5113 6.6793 6.7015 7.1426 7.1894 7.3858 7.4124 7.5161 7.5298 7.7077 7.7524 12.0815 12.0829 12.2850 12.2879 k = 0.4034 0.6411 0.1302 ( 4364 PWs) bands (ev): -23.1517 -23.1517 -23.1385 -23.1385 -11.7236 -11.7229 -11.6320 -11.6304 -11.4554 -11.4521 -11.4233 -11.4218 -6.9261 -6.9046 -6.8814 -6.8695 -6.6982 -6.6775 -6.5949 -6.5868 -6.4306 -6.4301 -6.3848 -6.3653 0.6830 0.6836 0.7493 0.7520 1.5311 1.5335 1.5618 1.5646 1.9232 1.9258 2.0295 2.0345 2.5762 2.5917 2.8414 2.8417 2.9516 2.9521 3.1246 3.1373 3.5266 3.5337 3.7816 3.7842 5.6275 5.6614 5.7538 5.7678 5.8874 5.9182 6.0132 6.0252 6.4840 6.5113 6.6793 6.7015 7.1426 7.1894 7.3858 7.4124 7.5161 7.5298 7.7077 7.7524 12.0815 12.0829 12.2850 12.2879 k = 0.3890 0.6361 0.1376 ( 4364 PWs) bands (ev): -23.1527 -23.1527 -23.1375 -23.1375 -11.7307 -11.7299 -11.6288 -11.6271 -11.4538 -11.4503 -11.4198 -11.4182 -6.9288 -6.9056 -6.8811 -6.8677 -6.7020 -6.6803 -6.5923 -6.5846 -6.4331 -6.4318 -6.3850 -6.3642 0.6838 0.6844 0.7595 0.7623 1.5264 1.5289 1.5611 1.5639 1.9206 1.9234 2.0375 2.0427 2.5629 2.5786 2.8528 2.8535 2.9454 2.9464 3.1359 3.1484 3.5057 3.5131 3.7854 3.7881 5.6225 5.6586 5.7510 5.7717 5.8808 5.9124 6.0273 6.0373 6.4794 6.5080 6.6942 6.7170 7.1277 7.1746 7.3909 7.4193 7.5050 7.5207 7.7186 7.7627 12.0678 12.0692 12.2951 12.2981 k = 0.3746 0.6312 0.1449 ( 4361 PWs) bands (ev): -23.1541 -23.1541 -23.1362 -23.1362 -11.7389 -11.7382 -11.6243 -11.6226 -11.4519 -11.4483 -11.4162 -11.4145 -6.9322 -6.9073 -6.8802 -6.8655 -6.7062 -6.6834 -6.5896 -6.5823 -6.4357 -6.4334 -6.3853 -6.3634 0.6837 0.6843 0.7716 0.7745 1.5215 1.5241 1.5605 1.5633 1.9185 1.9215 2.0459 2.0512 2.5486 2.5643 2.8635 2.8649 2.9385 2.9403 3.1483 3.1604 3.4853 3.4929 3.7898 3.7926 5.6143 5.6536 5.7464 5.7767 5.8753 5.9067 6.0421 6.0512 6.4737 6.5036 6.7074 6.7311 7.1144 7.1611 7.3947 7.4252 7.4943 7.5125 7.7314 7.7744 12.0529 12.0542 12.3022 12.3053 k = 0.3602 0.6262 0.1523 ( 4352 PWs) bands (ev): -23.1556 -23.1556 -23.1347 -23.1347 -11.7480 -11.7472 -11.6190 -11.6172 -11.4500 -11.4462 -11.4125 -11.4106 -6.9360 -6.9096 -6.8789 -6.8630 -6.7105 -6.6868 -6.5866 -6.5801 -6.4382 -6.4351 -6.3856 -6.3627 0.6834 0.6839 0.7851 0.7880 1.5164 1.5191 1.5600 1.5628 1.9169 1.9201 2.0545 2.0600 2.5333 2.5491 2.8733 2.8756 2.9318 2.9347 3.1610 3.1725 3.4655 3.4734 3.7950 3.7978 5.6034 5.6467 5.7408 5.7801 5.8714 5.9016 6.0575 6.0671 6.4673 6.4983 6.7189 6.7435 7.1029 7.1493 7.3957 7.4278 7.4862 7.5071 7.7456 7.7870 12.0372 12.0385 12.3061 12.3093 k = 0.3458 0.6213 0.1597 ( 4354 PWs) bands (ev): -23.1573 -23.1573 -23.1331 -23.1331 -11.7574 -11.7566 -11.6133 -11.6115 -11.4478 -11.4438 -11.4089 -11.4068 -6.9402 -6.9124 -6.8772 -6.8603 -6.7150 -6.6904 -6.5836 -6.5778 -6.4408 -6.4368 -6.3861 -6.3622 0.6830 0.6836 0.7995 0.8025 1.5110 1.5139 1.5596 1.5624 1.9156 1.9192 2.0633 2.0688 2.5174 2.5331 2.8818 2.8853 2.9256 2.9299 3.1735 3.1844 3.4467 3.4548 3.8007 3.8037 5.5905 5.6378 5.7342 5.7805 5.8695 5.8970 6.0735 6.0846 6.4602 6.4923 6.7285 6.7542 7.0931 7.1390 7.3926 7.4241 7.4839 7.5058 7.7607 7.8003 12.0212 12.0224 12.3062 12.3095 k = 0.3313 0.6164 0.1671 ( 4352 PWs) bands (ev): -23.1590 -23.1590 -23.1314 -23.1314 -11.7671 -11.7662 -11.6074 -11.6055 -11.4456 -11.4414 -11.4052 -11.4029 -6.9446 -6.9156 -6.8752 -6.8575 -6.7195 -6.6941 -6.5805 -6.5756 -6.4433 -6.4386 -6.3866 -6.3619 0.6830 0.6836 0.8146 0.8176 1.5054 1.5084 1.5593 1.5621 1.9149 1.9188 2.0721 2.0777 2.5009 2.5165 2.8885 2.8938 2.9203 2.9265 3.1853 3.1956 3.4291 3.4375 3.8072 3.8101 5.5762 5.6274 5.7262 5.7776 5.8697 5.8932 6.0905 6.1034 6.4527 6.4859 6.7364 6.7630 7.0853 7.1303 7.3850 7.4135 7.4878 7.5090 7.7766 7.8142 12.0051 12.0064 12.3024 12.3057 k = 0.3169 0.6114 0.1745 ( 4354 PWs) bands (ev): -23.1607 -23.1607 -23.1298 -23.1298 -11.7767 -11.7758 -11.6014 -11.5995 -11.4432 -11.4388 -11.4015 -11.3991 -6.9492 -6.9191 -6.8731 -6.8546 -6.7241 -6.6980 -6.5774 -6.5733 -6.4459 -6.4404 -6.3872 -6.3618 0.6833 0.6840 0.8302 0.8333 1.4996 1.5026 1.5591 1.5619 1.9146 1.9189 2.0807 2.0863 2.4841 2.4995 2.8927 2.9000 2.9165 2.9249 3.1964 3.2060 3.4131 3.4216 3.8142 3.8172 5.5608 5.6157 5.7164 5.7716 5.8714 5.8904 6.1085 6.1233 6.4451 6.4792 6.7427 6.7699 7.0794 7.1232 7.3734 7.3986 7.4960 7.5155 7.7930 7.8284 11.9892 11.9906 12.2942 12.2976 k = 0.3025 0.6065 0.1818 ( 4364 PWs) bands (ev): -23.1624 -23.1624 -23.1281 -23.1281 -11.7863 -11.7854 -11.5954 -11.5934 -11.4407 -11.4361 -11.3979 -11.3953 -6.9539 -6.9230 -6.8707 -6.8517 -6.7287 -6.7021 -6.5742 -6.5711 -6.4483 -6.4424 -6.3879 -6.3620 0.6840 0.6848 0.8461 0.8493 1.4934 1.4965 1.5590 1.5617 1.9148 1.9195 2.0890 2.0946 2.4674 2.4825 2.8945 2.9024 2.9159 2.9249 3.2064 3.2155 3.3988 3.4077 3.8217 3.8247 5.5445 5.6030 5.7050 5.7630 5.8740 5.8887 6.1274 6.1439 6.4376 6.4725 6.7473 6.7749 7.0753 7.1176 7.3591 7.3814 7.5063 7.5243 7.8097 7.8429 11.9737 11.9752 12.2819 12.2852 k = 0.2881 0.6015 0.1892 ( 4360 PWs) bands (ev): -23.1641 -23.1641 -23.1265 -23.1265 -11.7956 -11.7948 -11.5895 -11.5875 -11.4380 -11.4332 -11.3944 -11.3915 -6.9586 -6.9270 -6.8682 -6.8488 -6.7332 -6.7062 -6.5711 -6.5687 -6.4508 -6.4444 -6.3886 -6.3623 0.6853 0.6861 0.8624 0.8657 1.4870 1.4902 1.5590 1.5617 1.9155 1.9206 2.0967 2.1023 2.4511 2.4658 2.8944 2.9012 2.9178 2.9258 3.2154 3.2239 3.3868 3.3958 3.8297 3.8327 5.5277 5.5896 5.6921 5.7524 5.8767 5.8881 6.1473 6.1651 6.4303 6.4659 6.7506 6.7782 7.0731 7.1134 7.3429 7.3629 7.5177 7.5343 7.8267 7.8576 11.9588 11.9604 12.2655 12.2687 k = 0.2737 0.5966 0.1966 ( 4354 PWs) bands (ev): -23.1658 -23.1658 -23.1249 -23.1249 -11.8048 -11.8039 -11.5837 -11.5818 -11.4352 -11.4303 -11.3909 -11.3878 -6.9632 -6.9312 -6.8657 -6.8459 -6.7376 -6.7105 -6.5682 -6.5660 -6.4532 -6.4466 -6.3894 -6.3629 0.6870 0.6879 0.8789 0.8823 1.4803 1.4836 1.5591 1.5617 1.9167 1.9222 2.1037 2.1093 2.4354 2.4496 2.8933 2.8989 2.9197 2.9262 3.2233 3.2312 3.3771 3.3864 3.8381 3.8411 5.5105 5.5755 5.6777 5.7403 5.8789 5.8886 6.1679 6.1866 6.4234 6.4597 6.7526 6.7801 7.0725 7.1104 7.3255 7.3436 7.5297 7.5449 7.8437 7.8724 11.9445 11.9461 12.2456 12.2488 k = 0.2593 0.5916 0.2040 ( 4352 PWs) bands (ev): -23.1674 -23.1674 -23.1234 -23.1234 -11.8136 -11.8128 -11.5782 -11.5762 -11.4324 -11.4273 -11.3875 -11.3843 -6.9678 -6.9355 -6.8630 -6.8430 -6.7419 -6.7148 -6.5655 -6.5631 -6.4555 -6.4488 -6.3902 -6.3637 0.6892 0.6901 0.8955 0.8990 1.4733 1.4767 1.5593 1.5618 1.9184 1.9243 2.1097 2.1152 2.4207 2.4343 2.8918 2.8965 2.9200 2.9255 3.2300 3.2374 3.3701 3.3795 3.8468 3.8497 5.4932 5.5611 5.6623 5.7269 5.8805 5.8901 6.1890 6.2082 6.4170 6.4539 6.7535 6.7805 7.0732 7.1085 7.3072 7.3240 7.5417 7.5557 7.8606 7.8870 11.9308 11.9326 12.2230 12.2261 k = 0.2449 0.5867 0.2113 ( 4353 PWs) bands (ev): -23.1689 -23.1689 -23.1219 -23.1219 -11.8222 -11.8213 -11.5728 -11.5709 -11.4295 -11.4243 -11.3843 -11.3809 -6.9723 -6.9400 -6.8602 -6.8402 -6.7460 -6.7193 -6.5631 -6.5599 -6.4578 -6.4513 -6.3910 -6.3647 0.6919 0.6928 0.9122 0.9158 1.4660 1.4695 1.5596 1.5620 1.9205 1.9268 2.1144 2.1199 2.4072 2.4201 2.8903 2.8944 2.9184 2.9233 3.2357 3.2427 3.3657 3.3752 3.8557 3.8586 5.4759 5.5464 5.6460 5.7126 5.8818 5.8919 6.2103 6.2297 6.4113 6.4489 6.7535 6.7799 7.0750 7.1073 7.2884 7.3042 7.5537 7.5664 7.8774 7.9016 11.9179 11.9198 12.1982 12.2012 k = 0.2305 0.5817 0.2187 ( 4356 PWs) bands (ev): -23.1704 -23.1704 -23.1205 -23.1205 -11.8303 -11.8295 -11.5678 -11.5658 -11.4265 -11.4212 -11.3812 -11.3776 -6.9766 -6.9445 -6.8574 -6.8374 -6.7500 -6.7238 -6.5607 -6.5565 -6.4601 -6.4538 -6.3918 -6.3660 0.6949 0.6959 0.9289 0.9326 1.4584 1.4620 1.5599 1.5622 1.9230 1.9297 2.1176 2.1232 2.3954 2.4074 2.8886 2.8927 2.9147 2.9194 3.2406 3.2471 3.3638 3.3733 3.8647 3.8674 5.4588 5.5316 5.6291 5.6975 5.8829 5.8939 6.2316 6.2506 6.4065 6.4448 6.7527 6.7785 7.0775 7.1066 7.2693 7.2844 7.5653 7.5768 7.8938 7.9159 11.9056 11.9077 12.1721 12.1750 k = 0.2161 0.5768 0.2261 ( 4351 PWs) bands (ev): -23.1718 -23.1718 -23.1191 -23.1191 -11.8381 -11.8373 -11.5629 -11.5611 -11.4235 -11.4181 -11.3782 -11.3745 -6.9807 -6.9490 -6.8546 -6.8346 -6.7537 -6.7285 -6.5584 -6.5531 -6.4624 -6.4565 -6.3926 -6.3673 0.6983 0.6993 0.9456 0.9494 1.4505 1.4542 1.5603 1.5625 1.9259 1.9330 2.1191 2.1249 2.3855 2.3964 2.8868 2.8913 2.9092 2.9141 3.2447 3.2508 3.3643 3.3736 3.8736 3.8763 5.4421 5.5168 5.6121 5.6820 5.8839 5.8957 6.2524 6.2707 6.4028 6.4421 6.7514 6.7765 7.0805 7.1062 7.2502 7.2649 7.5764 7.5868 7.9098 7.9299 11.8941 11.8963 12.1452 12.1480 k = 0.2017 0.5718 0.2335 ( 4355 PWs) bands (ev): -23.1731 -23.1731 -23.1178 -23.1178 -11.8455 -11.8447 -11.5584 -11.5566 -11.4204 -11.4150 -11.3754 -11.3716 -6.9845 -6.9536 -6.8517 -6.8319 -6.7573 -6.7332 -6.5561 -6.5497 -6.4647 -6.4593 -6.3933 -6.3689 0.7020 0.7030 0.9622 0.9661 1.4423 1.4460 1.5607 1.5628 1.9290 1.9366 2.1187 2.1249 2.3776 2.3874 2.8844 2.8902 2.9020 2.9079 3.2483 3.2540 3.3669 3.3758 3.8823 3.8850 5.4259 5.5021 5.5950 5.6660 5.8850 5.8973 6.2721 6.2895 6.4007 6.4411 6.7497 6.7742 7.0836 7.1058 7.2310 7.2458 7.5869 7.5963 7.9254 7.9435 11.8834 11.8857 12.1179 12.1208 k = 0.1873 0.5669 0.2409 ( 4364 PWs) bands (ev): -23.1744 -23.1744 -23.1166 -23.1166 -11.8524 -11.8517 -11.5541 -11.5524 -11.4174 -11.4119 -11.3728 -11.3690 -6.9881 -6.9581 -6.8487 -6.8292 -6.7607 -6.7380 -6.5537 -6.5462 -6.4670 -6.4622 -6.3940 -6.3705 0.7059 0.7069 0.9787 0.9826 1.4339 1.4376 1.5612 1.5632 1.9324 1.9405 2.1164 2.1232 2.3717 2.3803 2.8807 2.8892 2.8936 2.9019 3.2514 3.2566 3.3712 3.3796 3.8908 3.8935 5.4105 5.4875 5.5781 5.6498 5.8861 5.8986 6.2901 6.3063 6.4005 6.4424 6.7476 6.7717 7.0866 7.1051 7.2122 7.2275 7.5969 7.6053 7.9404 7.9566 11.8734 11.8758 12.0909 12.0937 k = 0.1729 0.5620 0.2482 ( 4371 PWs) bands (ev): -23.1756 -23.1756 -23.1155 -23.1155 -11.8589 -11.8582 -11.5501 -11.5485 -11.4144 -11.4090 -11.3704 -11.3665 -6.9913 -6.9626 -6.8457 -6.8265 -6.7640 -6.7428 -6.5512 -6.5428 -6.4694 -6.4651 -6.3946 -6.3723 0.7100 0.7110 0.9950 0.9990 1.4251 1.4289 1.5617 1.5635 1.9361 1.9446 2.1124 2.1198 2.3678 2.3752 2.8749 2.8831 2.8895 2.8972 3.2542 3.2589 3.3768 3.3847 3.8989 3.9016 5.3960 5.4732 5.5618 5.6336 5.8872 5.8996 6.3052 6.3206 6.4033 6.4465 6.7454 6.7691 7.0890 7.1038 7.1940 7.2105 7.6061 7.6137 7.9546 7.9690 11.8642 11.8667 12.0644 12.0671 k = 0.1585 0.5570 0.2556 ( 4363 PWs) bands (ev): -23.1767 -23.1767 -23.1145 -23.1145 -11.8649 -11.8643 -11.5465 -11.5449 -11.4114 -11.4061 -11.3681 -11.3642 -6.9942 -6.9669 -6.8426 -6.8238 -6.7671 -6.7477 -6.5487 -6.5393 -6.4719 -6.4680 -6.3951 -6.3742 0.7141 0.7151 1.0110 1.0150 1.4162 1.4200 1.5622 1.5639 1.9399 1.9488 2.1069 2.1152 2.3657 2.3719 2.8668 2.8728 2.8890 2.8944 3.2566 3.2608 3.3835 3.3908 3.9066 3.9092 5.3827 5.4591 5.5464 5.6175 5.8883 5.9004 6.3168 6.3318 6.4097 6.4538 6.7431 6.7666 7.0902 7.1016 7.1770 7.1952 7.6147 7.6215 7.9681 7.9809 11.8559 11.8585 12.0387 12.0414 k = 0.1441 0.5521 0.2630 ( 4362 PWs) bands (ev): -23.1777 -23.1777 -23.1135 -23.1135 -11.8704 -11.8698 -11.5431 -11.5416 -11.4085 -11.4034 -11.3661 -11.3622 -6.9968 -6.9712 -6.8394 -6.8212 -6.7700 -6.7527 -6.5461 -6.5359 -6.4746 -6.4708 -6.3956 -6.3761 0.7183 0.7193 1.0266 1.0307 1.4072 1.4110 1.5628 1.5643 1.9438 1.9530 2.1005 2.1094 2.3650 2.3702 2.8572 2.8619 2.8889 2.8928 3.2586 3.2624 3.3909 3.3976 3.9137 3.9163 5.3706 5.4454 5.5321 5.6017 5.8895 5.9010 6.3247 6.3395 6.4202 6.4640 6.7408 6.7641 7.0891 7.0983 7.1619 7.1821 7.6225 7.6286 7.9808 7.9920 11.8485 11.8512 12.0140 12.0168 k = 0.1297 0.5471 0.2704 ( 4372 PWs) bands (ev): -23.1787 -23.1787 -23.1126 -23.1126 -11.8755 -11.8749 -11.5400 -11.5387 -11.4058 -11.4008 -11.3642 -11.3605 -6.9990 -6.9753 -6.8362 -6.8186 -6.7729 -6.7576 -6.5434 -6.5326 -6.4775 -6.4735 -6.3959 -6.3780 0.7224 0.7234 1.0418 1.0458 1.3980 1.4018 1.5633 1.5647 1.9477 1.9572 2.0933 2.1029 2.3654 2.3697 2.8471 2.8510 2.8890 2.8920 3.2603 3.2637 3.3986 3.4047 3.9201 3.9228 5.3598 5.4319 5.5192 5.5862 5.8905 5.9014 6.3296 6.3438 6.4338 6.4763 6.7386 6.7617 7.0846 7.0935 7.1500 7.1716 7.6296 7.6350 7.9925 8.0023 11.8420 11.8448 11.9906 11.9934 k = 0.1153 0.5422 0.2778 ( 4369 PWs) bands (ev): -23.1795 -23.1795 -23.1118 -23.1118 -11.8800 -11.8795 -11.5373 -11.5361 -11.4031 -11.3985 -11.3625 -11.3590 -7.0008 -6.9792 -6.8328 -6.8159 -6.7756 -6.7625 -6.5407 -6.5293 -6.4806 -6.4760 -6.3961 -6.3799 0.7264 0.7273 1.0565 1.0604 1.3889 1.3926 1.5638 1.5651 1.9516 1.9612 2.0860 2.0959 2.3666 2.3701 2.8370 2.8403 2.8891 2.8915 3.2617 3.2647 3.4065 3.4120 3.9260 3.9286 5.3506 5.4188 5.5079 5.5713 5.8916 5.9016 6.3325 6.3458 6.4495 6.4899 6.7366 6.7594 7.0771 7.0861 7.1422 7.1639 7.6359 7.6408 8.0032 8.0117 11.8366 11.8394 11.9687 11.9714 k = 0.1008 0.5372 0.2851 ( 4371 PWs) bands (ev): -23.1803 -23.1803 -23.1111 -23.1111 -11.8840 -11.8836 -11.5349 -11.5337 -11.4006 -11.3963 -11.3610 -11.3577 -7.0023 -6.9829 -6.8294 -6.8133 -6.7783 -6.7674 -6.5379 -6.5261 -6.4838 -6.4785 -6.3961 -6.3818 0.7302 0.7310 1.0704 1.0742 1.3800 1.3836 1.5642 1.5654 1.9554 1.9650 2.0788 2.0888 2.3683 2.3711 2.8273 2.8302 2.8894 2.8913 3.2629 3.2655 3.4143 3.4191 3.9312 3.9337 5.3431 5.4061 5.4984 5.5570 5.8926 5.9016 6.3341 6.3463 6.4660 6.5037 6.7349 6.7572 7.0675 7.0759 7.1386 7.1586 7.6416 7.6458 8.0129 8.0201 11.8323 11.8351 11.9483 11.9510 k = 0.0864 0.5323 0.2925 ( 4367 PWs) bands (ev): -23.1809 -23.1809 -23.1105 -23.1105 -11.8875 -11.8871 -11.5327 -11.5318 -11.3984 -11.3945 -11.3597 -11.3566 -7.0033 -6.9863 -6.8259 -6.8107 -6.7810 -6.7723 -6.5350 -6.5231 -6.4869 -6.4809 -6.3961 -6.3837 0.7336 0.7343 1.0834 1.0870 1.3714 1.3748 1.5647 1.5657 1.9590 1.9683 2.0721 2.0820 2.3703 2.3725 2.8184 2.8209 2.8896 2.8912 3.2638 3.2660 3.4216 3.4257 3.9357 3.9380 5.3372 5.3940 5.4908 5.5436 5.8936 5.9015 6.3351 6.3459 6.4825 6.5169 6.7337 6.7551 7.0570 7.0643 7.1376 7.1549 7.6465 7.6502 8.0215 8.0275 11.8291 11.8319 11.9296 11.9323 k = 0.0720 0.5273 0.2999 ( 4373 PWs) bands (ev): -23.1815 -23.1815 -23.1100 -23.1100 -11.8904 -11.8901 -11.5309 -11.5301 -11.3963 -11.3929 -11.3585 -11.3559 -7.0039 -6.9895 -6.8222 -6.8082 -6.7837 -6.7770 -6.5321 -6.5204 -6.4899 -6.4833 -6.3959 -6.3854 0.7366 0.7373 1.0953 1.0986 1.3634 1.3665 1.5651 1.5659 1.9624 1.9712 2.0662 2.0755 2.3723 2.3740 2.8105 2.8126 2.8899 2.8912 3.2645 3.2664 3.4283 3.4318 3.9395 3.9416 5.3331 5.3824 5.4853 5.5310 5.8945 5.9012 6.3358 6.3450 6.4981 6.5288 6.7330 6.7528 7.0467 7.0525 7.1380 7.1523 7.6507 7.6537 8.0288 8.0337 11.8272 11.8299 11.9128 11.9155 k = 0.0576 0.5224 0.3073 ( 4373 PWs) bands (ev): -23.1819 -23.1819 -23.1095 -23.1095 -11.8929 -11.8926 -11.5294 -11.5288 -11.3945 -11.3917 -11.3575 -11.3553 -7.0041 -6.9925 -6.8185 -6.8057 -6.7865 -6.7814 -6.5291 -6.5181 -6.4925 -6.4857 -6.3955 -6.3871 0.7393 0.7398 1.1058 1.1087 1.3562 1.3589 1.5654 1.5661 1.9655 1.9733 2.0614 2.0697 2.3742 2.3755 2.8038 2.8055 2.8902 2.8912 3.2651 3.2666 3.4341 3.4369 3.9426 3.9444 5.3308 5.3716 5.4818 5.5196 5.8955 5.9009 6.3363 6.3438 6.5125 6.5386 6.7330 6.7505 7.0372 7.0417 7.1391 7.1505 7.6542 7.6566 8.0350 8.0388 11.8265 11.8291 11.8981 11.9006 k = 0.0432 0.5175 0.3147 ( 4372 PWs) bands (ev): -23.1823 -23.1823 -23.1092 -23.1092 -11.8948 -11.8946 -11.5282 -11.5277 -11.3930 -11.3908 -11.3567 -11.3549 -7.0040 -6.9951 -6.8146 -6.8033 -6.7895 -6.7854 -6.5261 -6.5165 -6.4946 -6.4881 -6.3950 -6.3887 0.7414 0.7418 1.1147 1.1170 1.3502 1.3524 1.5657 1.5662 1.9684 1.9748 2.0578 2.0647 2.3758 2.3767 2.7984 2.7997 2.8905 2.8912 3.2655 3.2666 3.4390 3.4411 3.9451 3.9465 5.3303 5.3617 5.4803 5.5094 5.8963 5.9005 6.3369 6.3426 6.5252 6.5459 6.7337 6.7480 7.0293 7.0325 7.1406 7.1489 7.6569 7.6588 8.0399 8.0428 11.8269 11.8293 11.8856 11.8879 k = 0.0288 0.5125 0.3220 ( 4374 PWs) bands (ev): -23.1825 -23.1825 -23.1090 -23.1090 -11.8961 -11.8960 -11.5274 -11.5270 -11.3917 -11.3902 -11.3560 -11.3548 -7.0034 -6.9975 -6.8107 -6.8011 -6.7928 -6.7888 -6.5232 -6.5159 -6.4956 -6.4904 -6.3944 -6.3901 0.7429 0.7432 1.1215 1.1231 1.3458 1.3473 1.5660 1.5663 1.9708 1.9754 2.0557 2.0606 2.3770 2.3776 2.7946 2.7955 2.8907 2.8912 3.2659 3.2666 3.4426 3.4440 3.9469 3.9479 5.3316 5.3529 5.4808 5.5005 5.8972 5.8999 6.3375 6.3413 6.5358 6.5502 6.7351 6.7453 7.0234 7.0254 7.1420 7.1476 7.6590 7.6603 8.0436 8.0455 11.8283 11.8303 11.8758 11.8777 k = 0.0144 0.5076 0.3294 ( 4368 PWs) bands (ev): -23.1827 -23.1827 -23.1088 -23.1088 -11.8969 -11.8968 -11.5268 -11.5266 -11.3908 -11.3901 -11.3554 -11.3548 -7.0025 -6.9995 -6.8067 -6.8004 -6.7950 -6.7916 -6.5205 -6.5165 -6.4955 -6.4926 -6.3935 -6.3914 0.7439 0.7441 1.1259 1.1267 1.3431 1.3439 1.5661 1.5663 1.9729 1.9753 2.0549 2.0575 2.3779 2.3781 2.7924 2.7928 2.8909 2.8912 3.2662 3.2665 3.4450 3.4457 3.9481 3.9486 5.3346 5.3454 5.4831 5.4931 5.8979 5.8993 6.3382 6.3402 6.5439 6.5513 6.7372 6.7425 7.0198 7.0209 7.1435 7.1463 7.6604 7.6610 8.0460 8.0469 11.8301 11.8312 11.8695 11.8707 k = 0.0000 0.5026 0.3368 ( 4364 PWs) bands (ev): -23.1827 -23.1827 -23.1088 -23.1088 -11.8971 -11.8971 -11.5266 -11.5266 -11.3903 -11.3903 -11.3550 -11.3550 -7.0011 -7.0011 -6.8029 -6.8029 -6.7940 -6.7940 -6.5182 -6.5182 -6.4944 -6.4944 -6.3925 -6.3925 0.7443 0.7443 1.1277 1.1277 1.3425 1.3425 1.5663 1.5663 1.9744 1.9744 2.0556 2.0556 2.3782 2.3782 2.7918 2.7918 2.8911 2.8911 3.2664 3.2664 3.4460 3.4460 3.9487 3.9487 5.3392 5.3392 5.4873 5.4873 5.8987 5.8987 6.3392 6.3392 6.5491 6.5491 6.7398 6.7398 7.0190 7.0190 7.1449 7.1449 7.6611 7.6611 8.0472 8.0472 11.8313 11.8313 11.8677 11.8677 k = 0.0000 0.5026 0.3368 ( 4364 PWs) bands (ev): -23.1827 -23.1827 -23.1088 -23.1088 -11.8971 -11.8971 -11.5266 -11.5266 -11.3903 -11.3903 -11.3550 -11.3550 -7.0011 -7.0011 -6.8029 -6.8029 -6.7940 -6.7940 -6.5182 -6.5182 -6.4944 -6.4944 -6.3925 -6.3925 0.7443 0.7443 1.1277 1.1277 1.3425 1.3425 1.5663 1.5663 1.9744 1.9744 2.0556 2.0556 2.3782 2.3782 2.7918 2.7918 2.8911 2.8911 3.2664 3.2664 3.4460 3.4460 3.9487 3.9487 5.3392 5.3392 5.4873 5.4873 5.8987 5.8987 6.3392 6.3392 6.5491 6.5491 6.7398 6.7398 7.0190 7.0190 7.1449 7.1449 7.6611 7.6611 8.0472 8.0472 11.8313 11.8313 11.8677 11.8677 k = 0.0089 0.4946 0.3488 ( 4372 PWs) bands (ev): -23.1827 -23.1827 -23.1088 -23.1088 -11.8969 -11.8969 -11.5271 -11.5269 -11.3902 -11.3900 -11.3551 -11.3550 -7.0014 -7.0007 -6.8063 -6.8024 -6.7944 -6.7907 -6.5185 -6.5180 -6.4952 -6.4937 -6.3925 -6.3924 0.7448 0.7451 1.1277 1.1277 1.3423 1.3424 1.5656 1.5660 1.9743 1.9746 2.0550 2.0552 2.3784 2.3794 2.7912 2.7919 2.8917 2.8920 3.2658 3.2662 3.4451 3.4457 3.9470 3.9474 5.3385 5.3410 5.4888 5.4892 5.8974 5.8987 6.3357 6.3422 6.5478 6.5521 6.7388 6.7417 7.0181 7.0204 7.1444 7.1453 7.6603 7.6610 8.0463 8.0465 11.8320 11.8321 11.8687 11.8688 k = 0.0179 0.4865 0.3609 ( 4370 PWs) bands (ev): -23.1825 -23.1825 -23.1090 -23.1090 -11.8962 -11.8962 -11.5285 -11.5282 -11.3899 -11.3894 -11.3551 -11.3549 -7.0014 -7.0001 -6.8104 -6.8053 -6.7913 -6.7868 -6.5191 -6.5180 -6.4961 -6.4930 -6.3922 -6.3922 0.7464 0.7470 1.1277 1.1279 1.3420 1.3422 1.5640 1.5649 1.9742 1.9749 2.0535 2.0538 2.3800 2.3819 2.7902 2.7917 2.8939 2.8945 3.2644 3.2652 3.4429 3.4441 3.9423 3.9432 5.3389 5.3438 5.4937 5.4945 5.8950 5.8974 6.3320 6.3448 6.5484 6.5568 6.7389 6.7446 7.0179 7.0224 7.1437 7.1456 7.6586 7.6600 8.0441 8.0444 11.8342 11.8344 11.8720 11.8722 k = 0.0268 0.4784 0.3729 ( 4370 PWs) bands (ev): -23.1822 -23.1822 -23.1093 -23.1093 -11.8950 -11.8949 -11.5307 -11.5303 -11.3893 -11.3885 -11.3551 -11.3549 -7.0012 -6.9992 -6.8146 -6.8092 -6.7873 -6.7828 -6.5198 -6.5183 -6.4970 -6.4925 -6.3918 -6.3917 0.7492 0.7501 1.1279 1.1281 1.3415 1.3418 1.5616 1.5629 1.9742 1.9752 2.0511 2.0515 2.3828 2.3857 2.7889 2.7911 2.8976 2.8986 3.2621 3.2633 3.4395 3.4412 3.9348 3.9362 5.3403 5.3476 5.5017 5.5033 5.8915 5.8949 6.3282 6.3468 6.5507 6.5630 6.7400 6.7485 7.0183 7.0250 7.1429 7.1457 7.6562 7.6582 8.0403 8.0409 11.8379 11.8381 11.8775 11.8778 k = 0.0357 0.4704 0.3849 ( 4366 PWs) bands (ev): -23.1818 -23.1818 -23.1097 -23.1097 -11.8933 -11.8933 -11.5338 -11.5332 -11.3884 -11.3873 -11.3552 -11.3549 -7.0007 -6.9981 -6.8189 -6.8133 -6.7831 -6.7787 -6.5208 -6.5188 -6.4978 -6.4920 -6.3912 -6.3912 0.7532 0.7544 1.1281 1.1284 1.3409 1.3413 1.5583 1.5600 1.9743 1.9756 2.0479 2.0484 2.3870 2.3907 2.7872 2.7902 2.9027 2.9041 3.2591 3.2606 3.4349 3.4372 3.9247 3.9265 5.3427 5.3521 5.5128 5.5154 5.8871 5.8913 6.3242 6.3483 6.5550 6.5707 6.7421 6.7532 7.0194 7.0281 7.1419 7.1456 7.6529 7.6556 8.0352 8.0360 11.8431 11.8434 11.8853 11.8856 k = 0.0446 0.4623 0.3969 ( 4368 PWs) bands (ev): -23.1813 -23.1813 -23.1102 -23.1102 -11.8911 -11.8911 -11.5376 -11.5370 -11.3873 -11.3860 -11.3552 -11.3548 -7.0001 -6.9968 -6.8232 -6.8175 -6.7788 -6.7746 -6.5220 -6.5197 -6.4986 -6.4914 -6.3905 -6.3905 0.7584 0.7599 1.1283 1.1288 1.3400 1.3406 1.5541 1.5562 1.9744 1.9760 2.0440 2.0446 2.3923 2.3969 2.7852 2.7889 2.9093 2.9110 3.2551 3.2570 3.4291 3.4321 3.9122 3.9144 5.3459 5.3572 5.5265 5.5305 5.8820 5.8866 6.3202 6.3492 6.5611 6.5796 6.7452 6.7586 7.0210 7.0316 7.1408 7.1453 7.6489 7.6521 8.0287 8.0297 11.8498 11.8501 11.8953 11.8956 k = 0.0536 0.4543 0.4090 ( 4370 PWs) bands (ev): -23.1807 -23.1807 -23.1108 -23.1108 -11.8885 -11.8885 -11.5422 -11.5414 -11.3860 -11.3845 -11.3552 -11.3548 -6.9992 -6.9953 -6.8276 -6.8218 -6.7745 -6.7704 -6.5235 -6.5210 -6.4990 -6.4908 -6.3897 -6.3897 0.7647 0.7665 1.1286 1.1292 1.3391 1.3397 1.5490 1.5516 1.9745 1.9765 2.0396 2.0403 2.3987 2.4042 2.7829 2.7873 2.9171 2.9192 3.2503 3.2525 3.4224 3.4260 3.8975 3.9002 5.3498 5.3629 5.5424 5.5484 5.8766 5.8809 6.3163 6.3494 6.5689 6.5898 6.7493 6.7648 7.0233 7.0356 7.1395 7.1448 7.6441 7.6479 8.0208 8.0220 11.8579 11.8582 11.9074 11.9078 k = 0.0625 0.4462 0.4210 ( 4366 PWs) bands (ev): -23.1799 -23.1799 -23.1116 -23.1116 -11.8854 -11.8854 -11.5474 -11.5466 -11.3846 -11.3829 -11.3553 -11.3547 -6.9981 -6.9937 -6.8319 -6.8260 -6.7701 -6.7663 -6.5254 -6.5228 -6.4992 -6.4901 -6.3889 -6.3888 0.7721 0.7742 1.1290 1.1296 1.3380 1.3387 1.5432 1.5461 1.9747 1.9769 2.0347 2.0354 2.4061 2.4124 2.7804 2.7856 2.9260 2.9286 3.2445 3.2470 3.4147 3.4191 3.8811 3.8842 5.3544 5.3690 5.5601 5.5686 5.8712 5.8746 6.3124 6.3492 6.5785 6.6011 6.7544 6.7716 7.0261 7.0399 7.1381 7.1440 7.6388 7.6431 8.0115 8.0129 11.8673 11.8677 11.9218 11.9223 k = 0.0714 0.4381 0.4330 ( 4366 PWs) bands (ev): -23.1791 -23.1791 -23.1124 -23.1124 -11.8819 -11.8818 -11.5532 -11.5523 -11.3830 -11.3812 -11.3553 -11.3547 -6.9969 -6.9918 -6.8363 -6.8304 -6.7657 -6.7622 -6.5275 -6.5250 -6.4991 -6.4892 -6.3881 -6.3879 0.7806 0.7829 1.1293 1.1301 1.3368 1.3376 1.5365 1.5397 1.9749 1.9774 2.0296 2.0302 2.4144 2.4215 2.7776 2.7836 2.9360 2.9391 3.2378 3.2405 3.4063 3.4115 3.8631 3.8667 5.3595 5.3755 5.5788 5.5906 5.8663 5.8680 6.3086 6.3483 6.5896 6.6136 6.7603 6.7790 7.0295 7.0446 7.1364 7.1429 7.6329 7.6376 8.0009 8.0026 11.8782 11.8785 11.9384 11.9389 k = 0.0804 0.4301 0.4451 ( 4364 PWs) bands (ev): -23.1781 -23.1781 -23.1134 -23.1134 -11.8779 -11.8779 -11.5595 -11.5586 -11.3814 -11.3794 -11.3553 -11.3546 -6.9954 -6.9897 -6.8407 -6.8347 -6.7614 -6.7580 -6.5299 -6.5275 -6.4987 -6.4881 -6.3873 -6.3870 0.7901 0.7927 1.1297 1.1306 1.3354 1.3363 1.5290 1.5326 1.9750 1.9778 2.0242 2.0248 2.4236 2.4315 2.7748 2.7815 2.9469 2.9504 3.2301 3.2330 3.3973 3.4034 3.8439 3.8480 5.3651 5.3823 5.5976 5.6137 5.8616 5.8625 6.3049 6.3470 6.6022 6.6270 6.7672 6.7869 7.0332 7.0494 7.1344 7.1415 7.6266 7.6316 7.9891 7.9909 11.8903 11.8906 11.9571 11.9576 k = 0.0893 0.4220 0.4571 ( 4362 PWs) bands (ev): -23.1771 -23.1771 -23.1144 -23.1144 -11.8735 -11.8734 -11.5664 -11.5655 -11.3798 -11.3776 -11.3553 -11.3546 -6.9938 -6.9875 -6.8450 -6.8391 -6.7570 -6.7539 -6.5326 -6.5305 -6.4980 -6.4868 -6.3865 -6.3861 0.8006 0.8035 1.1301 1.1311 1.3340 1.3350 1.5208 1.5247 1.9752 1.9781 2.0188 2.0193 2.4336 2.4421 2.7719 2.7794 2.9583 2.9624 3.2215 3.2245 3.3879 3.3950 3.8238 3.8285 5.3711 5.3894 5.6154 5.6369 5.8560 5.8609 6.3012 6.3453 6.6161 6.6413 6.7748 6.7953 7.0373 7.0543 7.1322 7.1396 7.6199 7.6252 7.9760 7.9781 11.9037 11.9040 11.9780 11.9785 k = 0.0982 0.4140 0.4691 ( 4362 PWs) bands (ev): -23.1759 -23.1759 -23.1156 -23.1156 -11.8686 -11.8685 -11.5737 -11.5728 -11.3782 -11.3759 -11.3554 -11.3546 -6.9919 -6.9851 -6.8494 -6.8435 -6.7526 -6.7498 -6.5355 -6.5336 -6.4970 -6.4854 -6.3857 -6.3853 0.8121 0.8152 1.1304 1.1315 1.3325 1.3336 1.5118 1.5160 1.9752 1.9784 2.0133 2.0138 2.4442 2.4535 2.7689 2.7772 2.9702 2.9749 3.2118 3.2150 3.3784 3.3865 3.8031 3.8082 5.3775 5.3967 5.6310 5.6590 5.8521 5.8623 6.2975 6.3430 6.6311 6.6565 6.7832 6.8040 7.0417 7.0591 7.1296 7.1373 7.6131 7.6184 7.9618 7.9641 11.9183 11.9185 12.0009 12.0014 k = 0.1071 0.4059 0.4811 ( 4362 PWs) bands (ev): -23.1747 -23.1747 -23.1168 -23.1168 -11.8633 -11.8633 -11.5814 -11.5805 -11.3766 -11.3741 -11.3554 -11.3545 -6.9899 -6.9825 -6.8538 -6.8479 -6.7483 -6.7458 -6.5387 -6.5371 -6.4959 -6.4838 -6.3851 -6.3846 0.8244 0.8278 1.1307 1.1319 1.3309 1.3321 1.5022 1.5066 1.9753 1.9786 2.0081 2.0084 2.4556 2.4655 2.7659 2.7750 2.9822 2.9876 3.2012 3.2045 3.3690 3.3783 3.7820 3.7876 5.3842 5.4043 5.6432 5.6783 5.8515 5.8678 6.2939 6.3404 6.6473 6.6725 6.7923 6.8131 7.0462 7.0638 7.1267 7.1346 7.6062 7.6115 7.9464 7.9491 11.9340 11.9342 12.0258 12.0264 k = 0.1161 0.3978 0.4932 ( 4358 PWs) bands (ev): -23.1733 -23.1733 -23.1182 -23.1182 -11.8576 -11.8576 -11.5895 -11.5886 -11.3750 -11.3725 -11.3554 -11.3545 -6.9878 -6.9798 -6.8582 -6.8523 -6.7440 -6.7417 -6.5420 -6.5406 -6.4946 -6.4820 -6.3845 -6.3839 0.8376 0.8412 1.1308 1.1322 1.3293 1.3306 1.4920 1.4966 1.9752 1.9787 2.0030 2.0032 2.4675 2.4781 2.7629 2.7728 2.9941 3.0002 3.1898 3.1931 3.3601 3.3706 3.7606 3.7668 5.3911 5.4121 5.6510 5.6930 5.8559 5.8781 6.2902 6.3374 6.6644 6.6892 6.8022 6.8226 7.0507 7.0681 7.1233 7.1313 7.5995 7.6046 7.9301 7.9330 11.9508 11.9510 12.0526 12.0532 k = 0.1250 0.3898 0.5052 ( 4356 PWs) bands (ev): -23.1719 -23.1719 -23.1196 -23.1196 -11.8515 -11.8515 -11.5980 -11.5971 -11.3735 -11.3708 -11.3554 -11.3545 -6.9855 -6.9769 -6.8625 -6.8567 -6.7397 -6.7377 -6.5455 -6.5443 -6.4932 -6.4802 -6.3840 -6.3834 0.8515 0.8554 1.1308 1.1323 1.3277 1.3291 1.4812 1.4859 1.9750 1.9786 1.9982 1.9983 2.4800 2.4913 2.7599 2.7706 3.0056 3.0124 3.1776 3.1809 3.3520 3.3637 3.7392 3.7459 5.3984 5.4200 5.6542 5.7014 5.8664 5.8931 6.2864 6.3340 6.6823 6.7065 6.8127 6.8324 7.0550 7.0719 7.1196 7.1275 7.5930 7.5979 7.9128 7.9160 11.9687 11.9687 12.0811 12.0817 k = 0.1339 0.3817 0.5172 ( 4362 PWs) bands (ev): -23.1704 -23.1704 -23.1211 -23.1211 -11.8450 -11.8450 -11.6067 -11.6059 -11.3721 -11.3693 -11.3555 -11.3545 -6.9830 -6.9740 -6.8669 -6.8612 -6.7356 -6.7337 -6.5490 -6.5480 -6.4917 -6.4782 -6.3836 -6.3829 0.8661 0.8702 1.1306 1.1323 1.3262 1.3276 1.4699 1.4747 1.9746 1.9784 1.9937 1.9938 2.4929 2.5049 2.7569 2.7685 3.0163 3.0238 3.1648 3.1681 3.3450 3.3581 3.7178 3.7251 5.4058 5.4281 5.6531 5.7037 5.8829 5.9123 6.2824 6.3301 6.7008 6.7243 6.8240 6.8424 7.0589 7.0749 7.1154 7.1232 7.5871 7.5916 7.8947 7.8982 11.9875 11.9875 12.1112 12.1118 k = 0.1429 0.3737 0.5293 ( 4366 PWs) bands (ev): -23.1688 -23.1688 -23.1227 -23.1227 -11.8382 -11.8382 -11.6157 -11.6149 -11.3707 -11.3678 -11.3555 -11.3545 -6.9805 -6.9709 -6.8712 -6.8656 -6.7314 -6.7299 -6.5526 -6.5518 -6.4901 -6.4762 -6.3833 -6.3826 0.8813 0.8856 1.1301 1.1319 1.3247 1.3262 1.4582 1.4631 1.9741 1.9780 1.9895 1.9897 2.5063 2.5189 2.7539 2.7663 3.0258 3.0339 3.1515 3.1548 3.3397 3.3541 3.6965 3.7044 5.4135 5.4363 5.6488 5.7009 5.9039 5.9346 6.2782 6.3257 6.7200 6.7426 6.8358 6.8528 7.0622 7.0768 7.1107 7.1184 7.5819 7.5859 7.8758 7.8797 12.0071 12.0072 12.1425 12.1432 k = 0.1518 0.3656 0.5413 ( 4370 PWs) bands (ev): -23.1672 -23.1672 -23.1243 -23.1243 -11.8310 -11.8310 -11.6250 -11.6242 -11.3694 -11.3665 -11.3556 -11.3546 -6.9778 -6.9677 -6.8755 -6.8701 -6.7274 -6.7261 -6.5562 -6.5555 -6.4885 -6.4741 -6.3831 -6.3824 0.8970 0.9015 1.1293 1.1313 1.3233 1.3248 1.4462 1.4512 1.9734 1.9775 1.9858 1.9861 2.5201 2.5333 2.7508 2.7641 3.0339 3.0425 3.1380 3.1413 3.3365 3.3521 3.6754 3.6838 5.4214 5.4446 5.6420 5.6948 5.9279 5.9589 6.2737 6.3209 6.7395 6.7613 6.8483 6.8635 7.0647 7.0774 7.1056 7.1132 7.5777 7.5811 7.8564 7.8606 12.0276 12.0278 12.1748 12.1755 k = 0.1607 0.3575 0.5533 ( 4366 PWs) bands (ev): -23.1654 -23.1654 -23.1261 -23.1261 -11.8234 -11.8234 -11.6344 -11.6337 -11.3683 -11.3652 -11.3556 -11.3546 -6.9750 -6.9644 -6.8797 -6.8745 -6.7235 -6.7224 -6.5597 -6.5592 -6.4869 -6.4720 -6.3829 -6.3823 0.9131 0.9178 1.1280 1.1303 1.3220 1.3237 1.4340 1.4390 1.9726 1.9766 1.9826 1.9831 2.5343 2.5481 2.7475 2.7618 3.0402 3.0491 3.1245 3.1277 3.3357 3.3524 3.6546 3.6635 5.4295 5.4529 5.6334 5.6865 5.9534 5.9845 6.2688 6.3154 6.7592 6.7803 6.8614 6.8746 7.0662 7.0764 7.1000 7.1078 7.5747 7.5773 7.8364 7.8410 12.0488 12.0492 12.2075 12.2083 k = 0.1696 0.3495 0.5653 ( 4376 PWs) bands (ev): -23.1637 -23.1637 -23.1279 -23.1279 -11.8156 -11.8155 -11.6440 -11.6433 -11.3672 -11.3640 -11.3557 -11.3547 -6.9722 -6.9610 -6.8838 -6.8789 -6.7198 -6.7189 -6.5632 -6.5627 -6.4853 -6.4700 -6.3829 -6.3823 0.9295 0.9344 1.1262 1.1287 1.3210 1.3227 1.4218 1.4267 1.9715 1.9755 1.9799 1.9806 2.5487 2.5631 2.7439 2.7591 3.0446 3.0534 3.1114 3.1145 3.3377 3.3551 3.6340 3.6434 5.4377 5.4613 5.6236 5.6769 5.9792 6.0105 6.2635 6.3092 6.7791 6.7994 6.8749 6.8858 7.0664 7.0734 7.0939 7.1021 7.5731 7.5749 7.8161 7.8211 12.0708 12.0713 12.2399 12.2407 k = 0.1786 0.3414 0.5774 ( 4374 PWs) bands (ev): -23.1618 -23.1618 -23.1297 -23.1297 -11.8075 -11.8074 -11.6538 -11.6531 -11.3662 -11.3629 -11.3557 -11.3548 -6.9694 -6.9576 -6.8878 -6.8832 -6.7163 -6.7155 -6.5665 -6.5661 -6.4838 -6.4680 -6.3830 -6.3824 0.9461 0.9511 1.1238 1.1266 1.3202 1.3221 1.4097 1.4145 1.9702 1.9742 1.9778 1.9787 2.5634 2.5784 2.7400 2.7560 3.0472 3.0555 3.0990 3.1018 3.3425 3.3604 3.6136 3.6234 5.4463 5.4697 5.6130 5.6666 6.0049 6.0365 6.2576 6.3024 6.7988 6.8187 6.8889 6.8974 7.0652 7.0683 7.0875 7.0964 7.5730 7.5740 7.7956 7.8010 12.0935 12.0941 12.2708 12.2717 k = 0.1875 0.3333 0.5894 ( 4366 PWs) bands (ev): -23.1599 -23.1599 -23.1316 -23.1316 -11.7990 -11.7989 -11.6637 -11.6630 -11.3653 -11.3619 -11.3558 -11.3549 -6.9665 -6.9541 -6.8917 -6.8875 -6.7130 -6.7124 -6.5697 -6.5693 -6.4823 -6.4661 -6.3830 -6.3826 0.9627 0.9678 1.1206 1.1237 1.3199 1.3218 1.3978 1.4025 1.9690 1.9729 1.9760 1.9772 2.5782 2.5937 2.7355 2.7524 3.0479 3.0553 3.0877 3.0901 3.3500 3.3683 3.5934 3.6037 5.4551 5.4781 5.6020 5.6561 6.0299 6.0619 6.2512 6.2948 6.8181 6.8380 6.9032 6.9092 7.0610 7.0625 7.0808 7.0904 7.5746 7.5748 7.7753 7.7811 12.1168 12.1175 12.2988 12.2998 k = 0.1964 0.3253 0.6014 ( 4364 PWs) bands (ev): -23.1580 -23.1580 -23.1335 -23.1335 -11.7903 -11.7902 -11.6736 -11.6730 -11.3645 -11.3610 -11.3558 -11.3550 -6.9637 -6.9506 -6.8954 -6.8916 -6.7099 -6.7095 -6.5725 -6.5723 -6.4809 -6.4643 -6.3832 -6.3828 0.9793 0.9844 1.1166 1.1199 1.3199 1.3220 1.3864 1.3909 1.9677 1.9717 1.9746 1.9759 2.5930 2.6091 2.7303 2.7480 3.0471 3.0531 3.0780 3.0796 3.3600 3.3783 3.5734 3.5841 5.4640 5.4863 5.5907 5.6457 6.0538 6.0866 6.2440 6.2863 6.8368 6.8571 6.9177 6.9211 7.0520 7.0581 7.0739 7.0840 7.5774 7.5779 7.7551 7.7613 12.1407 12.1415 12.3216 12.3228 k = 0.2054 0.3172 0.6135 ( 4368 PWs) bands (ev): -23.1560 -23.1560 -23.1355 -23.1355 -11.7814 -11.7813 -11.6837 -11.6831 -11.3638 -11.3601 -11.3559 -11.3552 -6.9611 -6.9472 -6.8988 -6.8956 -6.7073 -6.7070 -6.5751 -6.5749 -6.4797 -6.4628 -6.3833 -6.3830 0.9955 1.0007 1.1115 1.1151 1.3204 1.3227 1.3756 1.3799 1.9666 1.9707 1.9734 1.9747 2.6077 2.6243 2.7242 2.7426 3.0450 3.0493 3.0700 3.0707 3.3721 3.3904 3.5536 3.5646 5.4732 5.4942 5.5793 5.6356 6.0763 6.1101 6.2361 6.2769 6.8544 6.8760 6.9321 6.9331 7.0415 7.0521 7.0669 7.0767 7.5818 7.5829 7.7353 7.7421 12.1650 12.1660 12.3368 12.3380 k = 0.2143 0.3092 0.6255 ( 4366 PWs) bands (ev): -23.1540 -23.1540 -23.1375 -23.1375 -11.7723 -11.7721 -11.6937 -11.6932 -11.3633 -11.3594 -11.3560 -11.3554 -6.9586 -6.9439 -6.9019 -6.8994 -6.7050 -6.7048 -6.5774 -6.5771 -6.4787 -6.4614 -6.3835 -6.3833 1.0114 1.0166 1.1052 1.1093 1.3216 1.3241 1.3657 1.3696 1.9658 1.9700 1.9724 1.9736 2.6222 2.6393 2.7173 2.7361 3.0422 3.0448 3.0636 3.0638 3.3859 3.4042 3.5341 3.5453 5.4826 5.5017 5.5679 5.6263 6.0972 6.1324 6.2274 6.2665 6.8705 6.8945 6.9451 6.9462 7.0297 7.0447 7.0601 7.0689 7.5879 7.5894 7.7164 7.7237 12.1897 12.1907 12.3423 12.3436 k = 0.2232 0.3011 0.6375 ( 4368 PWs) bands (ev): -23.1519 -23.1519 -23.1395 -23.1395 -11.7629 -11.7627 -11.7038 -11.7033 -11.3628 -11.3587 -11.3560 -11.3556 -6.9565 -6.9408 -6.9045 -6.9028 -6.7031 -6.7030 -6.5792 -6.5790 -6.4779 -6.4603 -6.3836 -6.3835 1.0267 1.0317 1.0978 1.1021 1.3234 1.3262 1.3566 1.3602 1.9651 1.9696 1.9716 1.9726 2.6363 2.6538 2.7093 2.7286 3.0391 3.0404 3.0582 3.0591 3.4010 3.4194 3.5150 3.5262 5.4923 5.5084 5.5566 5.6180 6.1162 6.1532 6.2182 6.2552 6.8844 6.9125 6.9568 6.9594 7.0169 7.0364 7.0538 7.0605 7.5955 7.5971 7.6987 7.7067 12.2146 12.2157 12.3381 12.3395 k = 0.2321 0.2930 0.6496 ( 4368 PWs) bands (ev): -23.1499 -23.1499 -23.1416 -23.1416 -11.7534 -11.7532 -11.7138 -11.7133 -11.3625 -11.3582 -11.3561 -11.3559 -6.9548 -6.9383 -6.9065 -6.9056 -6.7017 -6.7017 -6.5805 -6.5803 -6.4773 -6.4595 -6.3838 -6.3837 1.0412 1.0461 1.0890 1.0938 1.3260 1.3292 1.3487 1.3518 1.9647 1.9695 1.9710 1.9717 2.6496 2.6675 2.7004 2.7200 3.0365 3.0370 3.0545 3.0557 3.4167 3.4356 3.4966 3.5073 5.5022 5.5140 5.5456 5.6114 6.1327 6.1721 6.2087 6.2430 6.8954 6.9295 6.9679 6.9710 7.0038 7.0276 7.0484 7.0525 7.6039 7.6052 7.6830 7.6919 12.2393 12.2405 12.3259 12.3273 k = 0.2411 0.2850 0.6616 ( 4374 PWs) bands (ev): -23.1478 -23.1478 -23.1437 -23.1437 -11.7438 -11.7436 -11.7237 -11.7233 -11.3623 -11.3579 -11.3561 -11.3560 -6.9537 -6.9365 -6.9078 -6.9076 -6.7009 -6.7009 -6.5813 -6.5811 -6.4769 -6.4590 -6.3838 -6.3838 1.0548 1.0591 1.0789 1.0843 1.3292 1.3332 1.3422 1.3445 1.9644 1.9697 1.9706 1.9709 2.6615 2.6794 2.6912 2.7112 3.0347 3.0348 3.0524 3.0536 3.4318 3.4527 3.4800 3.4887 5.5120 5.5177 5.5350 5.6069 6.1453 6.1883 6.2004 6.2310 6.9025 6.9442 6.9769 6.9792 6.9917 7.0199 7.0447 7.0460 7.6116 7.6121 7.6709 7.6809 12.2637 12.2649 12.3081 12.3095 k = 0.2500 0.2769 0.6736 ( 4376 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7353 -11.7353 -11.7323 -11.7316 -11.3623 -11.3577 -11.3561 -11.3561 -6.9533 -6.9358 -6.9083 -6.9083 -6.7006 -6.7006 -6.5816 -6.5814 -6.4768 -6.4589 -6.3839 -6.3839 1.0669 1.0680 1.0680 1.0767 1.3316 1.3377 1.3388 1.3388 1.9643 1.9699 1.9705 1.9705 2.6680 2.6856 2.6856 2.7060 3.0340 3.0340 3.0516 3.0529 3.4402 3.4698 3.4711 3.4711 5.5189 5.5190 5.5277 5.6054 6.1505 6.1966 6.1967 6.2240 6.9049 6.9515 6.9808 6.9809 6.9868 7.0164 7.0433 7.0434 7.6150 7.6150 7.6660 7.6766 12.2868 12.2870 12.2870 12.2894 k = 0.2500 0.2769 0.6736 ( 4376 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7353 -11.7353 -11.7323 -11.7316 -11.3623 -11.3577 -11.3561 -11.3561 -6.9533 -6.9358 -6.9083 -6.9083 -6.7006 -6.7006 -6.5816 -6.5814 -6.4768 -6.4589 -6.3839 -6.3839 1.0669 1.0680 1.0680 1.0767 1.3316 1.3377 1.3388 1.3388 1.9643 1.9699 1.9705 1.9705 2.6680 2.6856 2.6856 2.7060 3.0340 3.0340 3.0516 3.0529 3.4402 3.4698 3.4711 3.4711 5.5189 5.5190 5.5277 5.6054 6.1505 6.1966 6.1967 6.2240 6.9049 6.9515 6.9808 6.9809 6.9868 7.0164 7.0433 7.0434 7.6150 7.6150 7.6660 7.6766 12.2868 12.2870 12.2870 12.2894 k = 0.2576 0.2853 0.6611 ( 4371 PWs) bands (ev): -23.1472 -23.1472 -23.1443 -23.1443 -11.7410 -11.7408 -11.7265 -11.7261 -11.3623 -11.3578 -11.3561 -11.3561 -6.9536 -6.9362 -6.9082 -6.9080 -6.7007 -6.7006 -6.5815 -6.5813 -6.4768 -6.4589 -6.3839 -6.3839 1.0585 1.0624 1.0757 1.0814 1.3303 1.3346 1.3409 1.3426 1.9644 1.9697 1.9705 1.9709 2.6640 2.6820 2.6891 2.7093 3.0333 3.0346 3.0518 3.0530 3.4353 3.4570 3.4775 3.4846 5.5158 5.5160 5.5329 5.6061 6.1479 6.1931 6.1977 6.2282 6.9023 6.9487 6.9756 6.9831 6.9856 7.0201 7.0446 7.0470 7.6131 7.6132 7.6683 7.6785 12.2708 12.2719 12.3002 12.3014 k = 0.2652 0.2937 0.6486 ( 4365 PWs) bands (ev): -23.1487 -23.1487 -23.1428 -23.1428 -11.7476 -11.7474 -11.7197 -11.7193 -11.3625 -11.3581 -11.3561 -11.3560 -6.9543 -6.9373 -6.9077 -6.9071 -6.7007 -6.7005 -6.5811 -6.5809 -6.4768 -6.4591 -6.3839 -6.3839 1.0494 1.0537 1.0824 1.0873 1.3287 1.3320 1.3449 1.3472 1.9645 1.9695 1.9706 1.9715 2.6557 2.6739 2.6963 2.7164 3.0316 3.0346 3.0532 3.0540 3.4250 3.4436 3.4913 3.5006 5.5093 5.5115 5.5413 5.6081 6.1415 6.1847 6.2015 6.2360 6.8958 6.9418 6.9651 6.9803 6.9896 7.0268 7.0510 7.0533 7.6088 7.6088 7.6736 7.6831 12.2554 12.2563 12.3081 12.3093 k = 0.2727 0.3021 0.6360 ( 4361 PWs) bands (ev): -23.1500 -23.1500 -23.1415 -23.1415 -11.7537 -11.7536 -11.7131 -11.7127 -11.3627 -11.3585 -11.3562 -11.3560 -6.9554 -6.9390 -6.9069 -6.9058 -6.7009 -6.7004 -6.5805 -6.5803 -6.4768 -6.4594 -6.3840 -6.3839 1.0400 1.0444 1.0876 1.0918 1.3280 1.3307 1.3497 1.3523 1.9647 1.9693 1.9708 1.9722 2.6459 2.6642 2.7045 2.7247 3.0278 3.0326 3.0570 3.0572 3.4130 3.4303 3.5081 3.5180 5.5022 5.5057 5.5501 5.6112 6.1334 6.1752 6.2060 6.2439 6.8873 6.9334 6.9538 6.9723 6.9971 7.0331 7.0605 7.0614 7.6036 7.6037 7.6801 7.6888 12.2410 12.2417 12.3123 12.3135 k = 0.2803 0.3105 0.6235 ( 4358 PWs) bands (ev): -23.1512 -23.1512 -23.1403 -23.1403 -11.7595 -11.7594 -11.7068 -11.7064 -11.3630 -11.3589 -11.3563 -11.3561 -6.9569 -6.9410 -6.9059 -6.9042 -6.7010 -6.7002 -6.5797 -6.5794 -6.4768 -6.4599 -6.3840 -6.3839 1.0302 1.0348 1.0909 1.0945 1.3286 1.3306 1.3550 1.3578 1.9649 1.9691 1.9712 1.9731 2.6356 2.6539 2.7130 2.7334 3.0220 3.0283 3.0630 3.0630 3.4007 3.4171 3.5263 3.5363 5.4949 5.4989 5.5589 5.6153 6.1247 6.1656 6.2101 6.2506 6.8781 6.9242 6.9427 6.9629 7.0044 7.0382 7.0706 7.0713 7.5985 7.5987 7.6867 7.6946 12.2275 12.2281 12.3142 12.3154 k = 0.2879 0.3189 0.6110 ( 4356 PWs) bands (ev): -23.1524 -23.1524 -23.1391 -23.1391 -11.7647 -11.7647 -11.7009 -11.7005 -11.3634 -11.3595 -11.3564 -11.3562 -6.9588 -6.9433 -6.9046 -6.9025 -6.7012 -6.6999 -6.5787 -6.5785 -6.4769 -6.4604 -6.3841 -6.3839 1.0202 1.0247 1.0922 1.0953 1.3306 1.3321 1.3606 1.3635 1.9652 1.9690 1.9717 1.9741 2.6252 2.6435 2.7217 2.7423 3.0148 3.0224 3.0708 3.0709 3.3884 3.4042 3.5454 3.5552 5.4877 5.4915 5.5678 5.6201 6.1159 6.1561 6.2133 6.2559 6.8687 6.9147 6.9319 6.9529 7.0109 7.0426 7.0804 7.0825 7.5940 7.5941 7.6929 7.7000 12.2152 12.2157 12.3146 12.3158 k = 0.2955 0.3273 0.5985 ( 4361 PWs) bands (ev): -23.1535 -23.1535 -23.1380 -23.1380 -11.7695 -11.7695 -11.6953 -11.6949 -11.3639 -11.3601 -11.3567 -11.3564 -6.9608 -6.9457 -6.9031 -6.9007 -6.7014 -6.6995 -6.5776 -6.5774 -6.4769 -6.4612 -6.3841 -6.3838 1.0098 1.0143 1.0917 1.0942 1.3339 1.3349 1.3667 1.3696 1.9655 1.9689 1.9724 1.9752 2.6148 2.6330 2.7304 2.7513 3.0065 3.0153 3.0800 3.0801 3.3763 3.3916 3.5646 3.5742 5.4807 5.4839 5.5768 5.6254 6.1073 6.1468 6.2153 6.2595 6.8595 6.9052 6.9215 6.9427 7.0167 7.0465 7.0906 7.0935 7.5900 7.5902 7.6983 7.7048 12.2040 12.2044 12.3141 12.3154 k = 0.3030 0.3357 0.5859 ( 4363 PWs) bands (ev): -23.1544 -23.1544 -23.1370 -23.1370 -11.7739 -11.7738 -11.6901 -11.6896 -11.3645 -11.3609 -11.3570 -11.3567 -6.9630 -6.9480 -6.9014 -6.8990 -6.7016 -6.6990 -6.5764 -6.5762 -6.4769 -6.4620 -6.3841 -6.3837 0.9991 1.0036 1.0893 1.0912 1.3386 1.3390 1.3730 1.3760 1.9660 1.9690 1.9733 1.9765 2.6048 2.6230 2.7393 2.7604 2.9976 3.0074 3.0901 3.0905 3.3647 3.3794 3.5836 3.5930 5.4742 5.4765 5.5857 5.6311 6.0989 6.1380 6.2160 6.2615 6.8505 6.8956 6.9112 6.9323 7.0221 7.0503 7.1009 7.1042 7.5867 7.5870 7.7029 7.7088 12.1941 12.1944 12.3129 12.3143 k = 0.3106 0.3441 0.5734 ( 4362 PWs) bands (ev): -23.1553 -23.1553 -23.1361 -23.1361 -11.7777 -11.7776 -11.6853 -11.6848 -11.3652 -11.3617 -11.3575 -11.3571 -6.9652 -6.9502 -6.8996 -6.8972 -6.7018 -6.6984 -6.5752 -6.5751 -6.4768 -6.4629 -6.3840 -6.3835 0.9882 0.9926 1.0852 1.0866 1.3443 1.3444 1.3796 1.3826 1.9665 1.9692 1.9744 1.9779 2.5952 2.6133 2.7481 2.7694 2.9884 2.9991 3.1008 3.1017 3.3537 3.3677 3.6021 3.6112 5.4682 5.4693 5.5948 5.6372 6.0910 6.1295 6.2154 6.2617 6.8416 6.8861 6.9010 6.9218 7.0272 7.0545 7.1111 7.1143 7.5840 7.5845 7.7067 7.7120 12.1854 12.1855 12.3111 12.3125 k = 0.3182 0.3525 0.5609 ( 4360 PWs) bands (ev): -23.1561 -23.1561 -23.1353 -23.1353 -11.7810 -11.7808 -11.6809 -11.6804 -11.3660 -11.3627 -11.3580 -11.3576 -6.9673 -6.9523 -6.8978 -6.8956 -6.7021 -6.6977 -6.5739 -6.5739 -6.4766 -6.4638 -6.3839 -6.3832 0.9770 0.9813 1.0795 1.0805 1.3506 1.3511 1.3864 1.3894 1.9671 1.9695 1.9756 1.9794 2.5862 2.6043 2.7569 2.7783 2.9791 2.9906 3.1116 3.1132 3.3435 3.3568 3.6197 3.6286 5.4628 5.4630 5.6038 5.6436 6.0834 6.1213 6.2134 6.2603 6.8326 6.8766 6.8906 6.9113 7.0325 7.0592 7.1212 7.1240 7.5818 7.5825 7.7097 7.7144 12.1779 12.1779 12.3084 12.3100 k = 0.3258 0.3608 0.5484 ( 4360 PWs) bands (ev): -23.1568 -23.1568 -23.1346 -23.1346 -11.7838 -11.7835 -11.6769 -11.6764 -11.3669 -11.3637 -11.3586 -11.3582 -6.9693 -6.9540 -6.8960 -6.8941 -6.7024 -6.6970 -6.5727 -6.5727 -6.4763 -6.4647 -6.3837 -6.3829 0.9656 0.9698 1.0725 1.0730 1.3577 1.3586 1.3934 1.3964 1.9678 1.9698 1.9770 1.9810 2.5780 2.5961 2.7654 2.7869 2.9700 2.9821 3.1223 3.1247 3.3345 3.3470 3.6361 3.6448 5.4572 5.4588 5.6129 5.6502 6.0763 6.1136 6.2102 6.2573 6.8236 6.8673 6.8800 6.9007 7.0382 7.0646 7.1309 7.1331 7.5799 7.5809 7.7119 7.7160 12.1715 12.1716 12.3048 12.3065 k = 0.3333 0.3692 0.5359 ( 4366 PWs) bands (ev): -23.1574 -23.1574 -23.1340 -23.1340 -11.7860 -11.7857 -11.6734 -11.6729 -11.3679 -11.3649 -11.3593 -11.3589 -6.9711 -6.9555 -6.8941 -6.8927 -6.7027 -6.6963 -6.5717 -6.5716 -6.4759 -6.4656 -6.3835 -6.3826 0.9540 0.9582 1.0642 1.0644 1.3654 1.3666 1.4005 1.4034 1.9686 1.9702 1.9785 1.9827 2.5706 2.5887 2.7737 2.7950 2.9614 2.9739 3.1322 3.1358 3.3271 3.3384 3.6511 3.6596 5.4526 5.4556 5.6220 5.6570 6.0694 6.1060 6.2057 6.2527 6.8142 6.8581 6.8689 6.8901 7.0445 7.0711 7.1403 7.1416 7.5782 7.5798 7.7133 7.7168 12.1662 12.1663 12.3001 12.3018 k = 0.3409 0.3776 0.5233 ( 4370 PWs) bands (ev): -23.1579 -23.1579 -23.1336 -23.1336 -11.7877 -11.7873 -11.6704 -11.6698 -11.3691 -11.3661 -11.3601 -11.3597 -6.9726 -6.9567 -6.8923 -6.8914 -6.7030 -6.6956 -6.5708 -6.5706 -6.4753 -6.4663 -6.3832 -6.3822 0.9423 0.9463 1.0547 1.0549 1.3735 1.3750 1.4076 1.4105 1.9695 1.9707 1.9801 1.9845 2.5642 2.5822 2.7814 2.8023 2.9538 2.9664 3.1409 3.1460 3.3217 3.3316 3.6645 3.6728 5.4493 5.4538 5.6311 5.6640 6.0629 6.0988 6.2001 6.2466 6.8046 6.8490 6.8573 6.8795 7.0516 7.0786 7.1493 7.1496 7.5767 7.5789 7.7140 7.7170 12.1619 12.1621 12.2940 12.2958 k = 0.3485 0.3860 0.5108 ( 4368 PWs) bands (ev): -23.1582 -23.1582 -23.1332 -23.1332 -11.7888 -11.7883 -11.6678 -11.6672 -11.3703 -11.3675 -11.3611 -11.3607 -6.9737 -6.9574 -6.8906 -6.8903 -6.7034 -6.6948 -6.5701 -6.5697 -6.4745 -6.4669 -6.3829 -6.3817 0.9304 0.9344 1.0442 1.0447 1.3819 1.3836 1.4147 1.4176 1.9704 1.9713 1.9818 1.9864 2.5588 2.5768 2.7883 2.8083 2.9476 2.9598 3.1478 3.1547 3.3188 3.3271 3.6761 3.6841 5.4476 5.4534 5.6402 5.6710 6.0566 6.0918 6.1935 6.2392 6.7946 6.8400 6.8453 6.8690 7.0594 7.0871 7.1570 7.1580 7.5753 7.5782 7.7142 7.7165 12.1585 12.1589 12.2866 12.2884 k = 0.3561 0.3944 0.4983 ( 4366 PWs) bands (ev): -23.1585 -23.1585 -23.1328 -23.1328 -11.7893 -11.7888 -11.6656 -11.6650 -11.3717 -11.3690 -11.3621 -11.3618 -6.9744 -6.9578 -6.8894 -6.8890 -6.7037 -6.6941 -6.5695 -6.5690 -6.4735 -6.4673 -6.3825 -6.3812 0.9186 0.9224 1.0330 1.0337 1.3904 1.3924 1.4218 1.4247 1.9714 1.9719 1.9836 1.9882 2.5545 2.5725 2.7941 2.8125 2.9434 2.9545 3.1522 3.1611 3.3191 3.3255 3.6857 3.6934 5.4475 5.4546 5.6493 5.6782 6.0507 6.0850 6.1859 6.2306 6.7842 6.8313 6.8329 6.8586 7.0681 7.0965 7.1639 7.1662 7.5739 7.5777 7.7138 7.7155 12.1561 12.1566 12.2778 12.2796 k = 0.3636 0.4028 0.4858 ( 4362 PWs) bands (ev): -23.1587 -23.1587 -23.1326 -23.1326 -11.7893 -11.7887 -11.6639 -11.6633 -11.3731 -11.3705 -11.3633 -11.3630 -6.9748 -6.9577 -6.8886 -6.8874 -6.7041 -6.6935 -6.5691 -6.5686 -6.4723 -6.4676 -6.3821 -6.3807 0.9068 0.9105 1.0212 1.0220 1.3991 1.4012 1.4288 1.4317 1.9724 1.9725 1.9853 1.9900 2.5514 2.5694 2.7984 2.8146 2.9418 2.9509 3.1540 3.1650 3.3226 3.3272 3.6932 3.7007 5.4491 5.4575 5.6583 5.6855 6.0449 6.0783 6.1774 6.2208 6.7736 6.8201 6.8226 6.8482 7.0775 7.1068 7.1703 7.1739 7.5724 7.5773 7.7129 7.7139 12.1545 12.1550 12.2678 12.2697 k = 0.3712 0.4112 0.4732 ( 4361 PWs) bands (ev): -23.1587 -23.1587 -23.1325 -23.1325 -11.7887 -11.7881 -11.6627 -11.6620 -11.3747 -11.3723 -11.3647 -11.3644 -6.9747 -6.9573 -6.8879 -6.8860 -6.7044 -6.6930 -6.5689 -6.5684 -6.4710 -6.4675 -6.3816 -6.3801 0.8950 0.8986 1.0088 1.0098 1.4077 1.4100 1.4357 1.4386 1.9732 1.9734 1.9869 1.9918 2.5496 2.5675 2.8009 2.8140 2.9429 2.9495 3.1531 3.1659 3.3294 3.3324 3.6986 3.7058 5.4525 5.4621 5.6673 5.6927 6.0393 6.0718 6.1681 6.2099 6.7629 6.8072 6.8141 6.8380 7.0875 7.1177 7.1762 7.1812 7.5709 7.5770 7.7116 7.7119 12.1536 12.1542 12.2570 12.2588 k = 0.3788 0.4196 0.4607 ( 4363 PWs) bands (ev): -23.1587 -23.1587 -23.1326 -23.1326 -11.7876 -11.7869 -11.6619 -11.6612 -11.3764 -11.3741 -11.3662 -11.3660 -6.9742 -6.9564 -6.8875 -6.8847 -6.7047 -6.6925 -6.5689 -6.5683 -6.4695 -6.4673 -6.3810 -6.3795 0.8834 0.8869 0.9959 0.9971 1.4161 1.4186 1.4425 1.4453 1.9739 1.9744 1.9885 1.9933 2.5490 2.5669 2.8013 2.8110 2.9469 2.9505 3.1498 3.1641 3.3391 3.3408 3.7018 3.7087 5.4578 5.4685 5.6762 5.6999 6.0338 6.0653 6.1580 6.1980 6.7522 6.7943 6.8056 6.8278 7.0979 7.1291 7.1816 7.1881 7.5693 7.5768 7.7094 7.7100 12.1533 12.1540 12.2456 12.2474 k = 0.3864 0.4280 0.4482 ( 4361 PWs) bands (ev): -23.1585 -23.1585 -23.1327 -23.1327 -11.7858 -11.7851 -11.6616 -11.6608 -11.3782 -11.3760 -11.3678 -11.3677 -6.9732 -6.9551 -6.8872 -6.8835 -6.7050 -6.6921 -6.5691 -6.5685 -6.4678 -6.4668 -6.3805 -6.3789 0.8720 0.8754 0.9826 0.9839 1.4245 1.4271 1.4491 1.4518 1.9746 1.9755 1.9899 1.9947 2.5497 2.5676 2.7996 2.8058 2.9533 2.9538 3.1447 3.1602 3.3511 3.3519 3.7030 3.7095 5.4650 5.4766 5.6849 5.7071 6.0284 6.0590 6.1473 6.1851 6.7417 6.7814 6.7972 6.8176 7.1086 7.1406 7.1868 7.1945 7.5677 7.5767 7.7066 7.7081 12.1536 12.1544 12.2339 12.2357 k = 0.3939 0.4364 0.4357 ( 4363 PWs) bands (ev): -23.1583 -23.1583 -23.1329 -23.1329 -11.7836 -11.7828 -11.6616 -11.6609 -11.3802 -11.3780 -11.3697 -11.3696 -6.9717 -6.9534 -6.8870 -6.8825 -6.7051 -6.6919 -6.5695 -6.5689 -6.4661 -6.4661 -6.3798 -6.3783 0.8609 0.8641 0.9689 0.9703 1.4327 1.4353 1.4555 1.4582 1.9753 1.9765 1.9911 1.9959 2.5517 2.5696 2.7960 2.7990 2.9593 2.9617 3.1383 3.1545 3.3649 3.3652 3.7020 3.7082 5.4739 5.4865 5.6934 5.7141 6.0231 6.0526 6.1359 6.1713 6.7316 6.7688 6.7888 6.8075 7.1194 7.1520 7.1916 7.2005 7.5661 7.5767 7.7034 7.7059 12.1544 12.1553 12.2224 12.2242 k = 0.4015 0.4448 0.4231 ( 4363 PWs) bands (ev): -23.1580 -23.1580 -23.1332 -23.1332 -11.7807 -11.7799 -11.6621 -11.6613 -11.3822 -11.3802 -11.3717 -11.3717 -6.9699 -6.9513 -6.8870 -6.8816 -6.7052 -6.6918 -6.5701 -6.5694 -6.4652 -6.4642 -6.3792 -6.3777 0.8501 0.8532 0.9549 0.9564 1.4406 1.4434 1.4616 1.4643 1.9759 1.9775 1.9920 1.9968 2.5551 2.5729 2.7909 2.7910 2.9667 2.9715 3.1309 3.1478 3.3801 3.3801 3.6992 3.7049 5.4846 5.4979 5.7016 5.7210 6.0177 6.0463 6.1240 6.1568 6.7219 6.7566 6.7804 6.7974 7.1302 7.1630 7.1966 7.2061 7.5646 7.5771 7.7000 7.7036 12.1557 12.1567 12.2114 12.2131 k = 0.4091 0.4532 0.4106 ( 4355 PWs) bands (ev): -23.1575 -23.1575 -23.1336 -23.1336 -11.7773 -11.7764 -11.6630 -11.6621 -11.3843 -11.3824 -11.3739 -11.3739 -6.9676 -6.9489 -6.8870 -6.8808 -6.7052 -6.6917 -6.5707 -6.5702 -6.4641 -6.4624 -6.3785 -6.3771 0.8397 0.8427 0.9407 0.9422 1.4484 1.4512 1.4676 1.4703 1.9765 1.9784 1.9926 1.9974 2.5597 2.5776 2.7823 2.7846 2.9754 2.9823 3.1230 3.1402 3.3962 3.3963 3.6946 3.6999 5.4969 5.5109 5.7095 5.7277 6.0123 6.0400 6.1116 6.1415 6.7129 6.7450 6.7719 6.7872 7.1406 7.1729 7.2019 7.2114 7.5634 7.5777 7.6963 7.7010 12.1573 12.1584 12.2011 12.2027 k = 0.4167 0.4615 0.3981 ( 4360 PWs) bands (ev): -23.1570 -23.1570 -23.1341 -23.1341 -11.7733 -11.7724 -11.6642 -11.6633 -11.3866 -11.3847 -11.3764 -11.3762 -6.9649 -6.9463 -6.8871 -6.8802 -6.7051 -6.6918 -6.5715 -6.5710 -6.4628 -6.4605 -6.3778 -6.3765 0.8297 0.8326 0.9262 0.9278 1.4559 1.4587 1.4733 1.4759 1.9771 1.9793 1.9929 1.9977 2.5656 2.5834 2.7730 2.7774 2.9851 2.9937 3.1149 3.1323 3.4131 3.4133 3.6885 3.6933 5.5106 5.5252 5.7170 5.7340 6.0069 6.0336 6.0988 6.1255 6.7045 6.7339 6.7634 6.7771 7.1507 7.1811 7.2079 7.2163 7.5625 7.5787 7.6923 7.6983 12.1593 12.1604 12.1918 12.1934 k = 0.4242 0.4699 0.3856 ( 4364 PWs) bands (ev): -23.1563 -23.1563 -23.1347 -23.1347 -11.7688 -11.7679 -11.6658 -11.6649 -11.3889 -11.3872 -11.3790 -11.3788 -6.9618 -6.9435 -6.8873 -6.8798 -6.7048 -6.6919 -6.5724 -6.5720 -6.4614 -6.4586 -6.3770 -6.3758 0.8202 0.8230 0.9115 0.9131 1.4631 1.4660 1.4787 1.4814 1.9776 1.9801 1.9929 1.9976 2.5727 2.5904 2.7635 2.7696 2.9954 3.0054 3.1067 3.1242 3.4306 3.4307 3.6810 3.6853 5.5255 5.5406 5.7240 5.7400 6.0013 6.0272 6.0858 6.1090 6.6970 6.7235 6.7548 6.7669 7.1601 7.1875 7.2150 7.2210 7.5621 7.5802 7.6881 7.6954 12.1615 12.1626 12.1838 12.1853 k = 0.4318 0.4783 0.3731 ( 4367 PWs) bands (ev): -23.1556 -23.1556 -23.1353 -23.1353 -11.7638 -11.7628 -11.6677 -11.6667 -11.3913 -11.3897 -11.3818 -11.3815 -6.9585 -6.9406 -6.8875 -6.8794 -6.7044 -6.6922 -6.5734 -6.5730 -6.4598 -6.4568 -6.3763 -6.3753 0.8113 0.8139 0.8966 0.8983 1.4701 1.4730 1.4840 1.4866 1.9780 1.9808 1.9926 1.9972 2.5809 2.5985 2.7540 2.7615 3.0059 3.0169 3.0987 3.1162 3.4484 3.4484 3.6725 3.6763 5.5416 5.5570 5.7304 5.7455 5.9957 6.0206 6.0725 6.0920 6.6902 6.7139 6.7460 6.7566 7.1689 7.1921 7.2227 7.2254 7.5624 7.5822 7.6836 7.6924 12.1638 12.1650 12.1771 12.1786 k = 0.4394 0.4867 0.3605 ( 4366 PWs) bands (ev): -23.1547 -23.1547 -23.1361 -23.1361 -11.7583 -11.7573 -11.6699 -11.6689 -11.3938 -11.3922 -11.3848 -11.3845 -6.9548 -6.9376 -6.8876 -6.8792 -6.7038 -6.6924 -6.5744 -6.5742 -6.4582 -6.4551 -6.3756 -6.3747 0.8029 0.8054 0.8816 0.8833 1.4768 1.4798 1.4890 1.4916 1.9784 1.9814 1.9920 1.9965 2.5900 2.6076 2.7445 2.7532 3.0163 3.0281 3.0910 3.1085 3.4664 3.4665 3.6633 3.6666 5.5585 5.5741 5.7361 5.7505 5.9899 6.0140 6.0592 6.0748 6.6841 6.7049 6.7372 6.7463 7.1769 7.1956 7.2298 7.2304 7.5635 7.5848 7.6790 7.6891 12.1662 12.1675 12.1719 12.1734 k = 0.4470 0.4951 0.3480 ( 4363 PWs) bands (ev): -23.1538 -23.1538 -23.1370 -23.1370 -11.7522 -11.7512 -11.6724 -11.6714 -11.3963 -11.3949 -11.3880 -11.3876 -6.9510 -6.9347 -6.8876 -6.8791 -6.7030 -6.6927 -6.5755 -6.5754 -6.4565 -6.4534 -6.3749 -6.3741 0.7952 0.7976 0.8666 0.8683 1.4833 1.4863 1.4938 1.4964 1.9786 1.9819 1.9911 1.9955 2.6001 2.6175 2.7351 2.7450 3.0263 3.0386 3.0840 3.1011 3.4844 3.4847 3.6537 3.6565 5.5761 5.5917 5.7411 5.7549 5.9840 6.0073 6.0460 6.0574 6.6788 6.6966 6.7282 6.7359 7.1840 7.1984 7.2341 7.2378 7.5655 7.5881 7.6742 7.6857 12.1680 12.1682 12.1701 12.1704 k = 0.4545 0.5035 0.3355 ( 4361 PWs) bands (ev): -23.1528 -23.1528 -23.1379 -23.1379 -11.7457 -11.7446 -11.6752 -11.6742 -11.3989 -11.3976 -11.3913 -11.3908 -6.9470 -6.9319 -6.8874 -6.8791 -6.7021 -6.6930 -6.5766 -6.5766 -6.4547 -6.4518 -6.3742 -6.3736 0.7882 0.7904 0.8514 0.8531 1.4896 1.4926 1.4984 1.5010 1.9788 1.9822 1.9900 1.9943 2.6107 2.6280 2.7260 2.7368 3.0354 3.0478 3.0779 3.0944 3.5024 3.5029 3.6442 3.6463 5.5941 5.6095 5.7452 5.7585 5.9780 6.0004 6.0330 6.0403 6.6740 6.6889 6.7190 6.7254 7.1903 7.2009 7.2384 7.2444 7.5687 7.5920 7.6694 7.6821 12.1661 12.1670 12.1717 12.1725 k = 0.4621 0.5119 0.3230 ( 4359 PWs) bands (ev): -23.1517 -23.1517 -23.1390 -23.1389 -11.7387 -11.7376 -11.6783 -11.6772 -11.4016 -11.4004 -11.3948 -11.3943 -6.9428 -6.9295 -6.8870 -6.8793 -6.7010 -6.6932 -6.5778 -6.5778 -6.4528 -6.4502 -6.3736 -6.3732 0.7818 0.7839 0.8363 0.8380 1.4956 1.4986 1.5028 1.5055 1.9789 1.9823 1.9887 1.9929 2.6219 2.6389 2.7173 2.7288 3.0435 3.0550 3.0734 3.0884 3.5203 3.5210 3.6350 3.6365 5.6121 5.6272 5.7484 5.7612 5.9719 5.9931 6.0204 6.0237 6.6696 6.6817 6.7097 6.7149 7.1958 7.2032 7.2429 7.2501 7.5729 7.5963 7.6646 7.6782 12.1654 12.1664 12.1738 12.1748 k = 0.4697 0.5203 0.3104 ( 4361 PWs) bands (ev): -23.1506 -23.1506 -23.1401 -23.1401 -11.7312 -11.7301 -11.6816 -11.6805 -11.4043 -11.4032 -11.3983 -11.3978 -6.9387 -6.9274 -6.8863 -6.8794 -6.6997 -6.6934 -6.5791 -6.5790 -6.4510 -6.4487 -6.3731 -6.3728 0.7762 0.7782 0.8211 0.8228 1.5014 1.5043 1.5072 1.5098 1.9789 1.9822 1.9874 1.9912 2.6334 2.6499 2.7089 2.7210 3.0500 3.0581 3.0724 3.0834 3.5379 3.5388 3.6266 3.6276 5.6300 5.6442 5.7508 5.7629 5.9657 5.9853 6.0082 6.0084 6.6653 6.6746 6.7002 6.7043 7.2007 7.2055 7.2475 7.2550 7.5783 7.6009 7.6601 7.6742 12.1662 12.1672 12.1758 12.1768 k = 0.4773 0.5287 0.2979 ( 4359 PWs) bands (ev): -23.1493 -23.1493 -23.1413 -23.1412 -11.7233 -11.7222 -11.6851 -11.6840 -11.4071 -11.4062 -11.4020 -11.4014 -6.9346 -6.9257 -6.8852 -6.8797 -6.6983 -6.6935 -6.5804 -6.5802 -6.4490 -6.4472 -6.3727 -6.3725 0.7713 0.7732 0.8060 0.8077 1.5070 1.5096 1.5115 1.5139 1.9788 1.9817 1.9863 1.9895 2.6449 2.6609 2.7011 2.7136 3.0545 3.0573 3.0745 3.0795 3.5553 3.5564 3.6194 3.6198 5.6473 5.6601 5.7525 5.7636 5.9597 5.9762 5.9948 5.9972 6.6608 6.6674 6.6907 6.6937 7.2052 7.2081 7.2525 7.2592 7.5846 7.6051 7.6564 7.6701 12.1682 12.1691 12.1775 12.1784 k = 0.4848 0.5371 0.2854 ( 4357 PWs) bands (ev): -23.1480 -23.1480 -23.1425 -23.1425 -11.7150 -11.7139 -11.6889 -11.6878 -11.4099 -11.4092 -11.4056 -11.4051 -6.9307 -6.9246 -6.8839 -6.8800 -6.6967 -6.6935 -6.5817 -6.5815 -6.4470 -6.4458 -6.3723 -6.3722 0.7672 0.7689 0.7911 0.7927 1.5124 1.5144 1.5160 1.5179 1.9786 1.9807 1.9854 1.9877 2.6562 2.6711 2.6941 2.7067 3.0558 3.0569 3.0766 3.0770 3.5722 3.5734 3.6137 3.6139 5.6635 5.6738 5.7541 5.7634 5.9540 5.9656 5.9842 5.9868 6.6557 6.6598 6.6813 6.6834 7.2095 7.2111 7.2578 7.2629 7.5917 7.6081 7.6544 7.6659 12.1711 12.1720 12.1786 12.1795 k = 0.4924 0.5455 0.2729 ( 4358 PWs) bands (ev): -23.1467 -23.1467 -23.1438 -23.1438 -11.7063 -11.7053 -11.6928 -11.6917 -11.4128 -11.4124 -11.4091 -11.4088 -6.9270 -6.9239 -6.8822 -6.8802 -6.6950 -6.6935 -6.5830 -6.5828 -6.4450 -6.4443 -6.3721 -6.3721 0.7638 0.7654 0.7763 0.7779 1.5175 1.5186 1.5209 1.5219 1.9782 1.9793 1.9848 1.9860 2.6668 2.6781 2.6902 2.7002 3.0550 3.0572 3.0756 3.0770 3.5884 3.5897 3.6099 3.6107 5.6780 5.6841 5.7567 5.7624 5.9485 5.9543 5.9760 5.9774 6.6494 6.6512 6.6723 6.6734 7.2138 7.2145 7.2635 7.2663 7.5992 7.6087 7.6550 7.6619 12.1747 12.1755 12.1792 12.1800 k = 0.5000 0.5539 0.2603 ( 4360 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6979 -11.6979 -11.6952 -11.6952 -11.4159 -11.4159 -11.4124 -11.4124 -6.9236 -6.9236 -6.8804 -6.8804 -6.6933 -6.6933 -6.5842 -6.5842 -6.4429 -6.4429 -6.3721 -6.3721 0.7606 0.7606 0.7638 0.7638 1.5225 1.5225 1.5257 1.5257 1.9778 1.9778 1.9843 1.9843 2.6762 2.6762 2.6949 2.6949 3.0555 3.0555 3.0753 3.0753 3.6018 3.6018 3.6119 3.6119 5.6893 5.6893 5.7616 5.7616 5.9436 5.9436 5.9690 5.9690 6.6413 6.6413 6.6638 6.6638 7.2185 7.2185 7.2697 7.2697 7.6065 7.6065 7.6587 7.6587 12.1781 12.1781 12.1800 12.1800 k = 0.5000 0.5539 0.2603 ( 4360 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6979 -11.6979 -11.6952 -11.6952 -11.4159 -11.4159 -11.4124 -11.4124 -6.9236 -6.9236 -6.8804 -6.8804 -6.6933 -6.6933 -6.5842 -6.5842 -6.4429 -6.4429 -6.3721 -6.3721 0.7606 0.7606 0.7638 0.7638 1.5225 1.5225 1.5257 1.5257 1.9778 1.9778 1.9843 1.9843 2.6762 2.6762 2.6949 2.6949 3.0555 3.0555 3.0753 3.0753 3.6018 3.6018 3.6119 3.6119 5.6893 5.6893 5.7616 5.7616 5.9436 5.9436 5.9690 5.9690 6.6413 6.6413 6.6638 6.6638 7.2185 7.2185 7.2697 7.2697 7.6065 7.6065 7.6587 7.6587 12.1781 12.1781 12.1800 12.1800 k = 0.5000 0.5539 0.2441 ( 4366 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6946 -11.6946 -11.6920 -11.6920 -11.4203 -11.4203 -11.4169 -11.4169 -6.9215 -6.9215 -6.8794 -6.8794 -6.6917 -6.6917 -6.5861 -6.5861 -6.4404 -6.4404 -6.3722 -6.3722 0.7501 0.7501 0.7531 0.7531 1.5279 1.5279 1.5311 1.5311 1.9764 1.9764 1.9828 1.9828 2.6786 2.6786 2.6969 2.6969 3.0539 3.0539 3.0731 3.0731 3.6124 3.6124 3.6220 3.6220 5.6961 5.6961 5.7640 5.7640 5.9354 5.9354 5.9607 5.9607 6.6286 6.6286 6.6524 6.6524 7.2248 7.2248 7.2764 7.2764 7.6082 7.6082 7.6600 7.6600 12.1798 12.1798 12.1817 12.1817 k = 0.5000 0.5539 0.2278 ( 4368 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6912 -11.6912 -11.6886 -11.6886 -11.4248 -11.4248 -11.4215 -11.4215 -6.9195 -6.9195 -6.8787 -6.8787 -6.6897 -6.6897 -6.5881 -6.5881 -6.4378 -6.4378 -6.3724 -6.3724 0.7401 0.7401 0.7429 0.7429 1.5331 1.5331 1.5363 1.5363 1.9747 1.9747 1.9810 1.9810 2.6814 2.6814 2.6993 2.6993 3.0515 3.0515 3.0699 3.0699 3.6237 3.6237 3.6329 3.6329 5.7008 5.7008 5.7633 5.7633 5.9298 5.9298 5.9547 5.9547 6.6163 6.6163 6.6409 6.6409 7.2316 7.2316 7.2833 7.2833 7.6094 7.6094 7.6605 7.6605 12.1810 12.1810 12.1830 12.1830 k = 0.5000 0.5539 0.2115 ( 4370 PWs) bands (ev): -23.1452 -23.1452 -23.1452 -23.1452 -11.6876 -11.6876 -11.6851 -11.6851 -11.4293 -11.4293 -11.4261 -11.4261 -6.9174 -6.9174 -6.8784 -6.8784 -6.6873 -6.6873 -6.5904 -6.5904 -6.4351 -6.4351 -6.3729 -6.3729 0.7307 0.7307 0.7332 0.7332 1.5381 1.5381 1.5412 1.5412 1.9729 1.9729 1.9791 1.9791 2.6846 2.6846 2.7020 2.7020 3.0483 3.0483 3.0660 3.0660 3.6356 3.6356 3.6442 3.6442 5.7034 5.7034 5.7596 5.7596 5.9269 5.9269 5.9512 5.9512 6.6043 6.6043 6.6295 6.6295 7.2390 7.2390 7.2903 7.2903 7.6102 7.6102 7.6604 7.6604 12.1819 12.1819 12.1840 12.1840 k = 0.5000 0.5539 0.1953 ( 4364 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6840 -11.6840 -11.6815 -11.6815 -11.4339 -11.4339 -11.4308 -11.4308 -6.9154 -6.9154 -6.8783 -6.8783 -6.6844 -6.6844 -6.5928 -6.5928 -6.4322 -6.4322 -6.3736 -6.3736 0.7219 0.7219 0.7242 0.7242 1.5428 1.5428 1.5458 1.5458 1.9710 1.9710 1.9769 1.9769 2.6882 2.6882 2.7050 2.7050 3.0445 3.0445 3.0614 3.0614 3.6478 3.6478 3.6559 3.6559 5.7038 5.7038 5.7532 5.7532 5.9264 5.9264 5.9502 5.9502 6.5928 6.5928 6.6182 6.6182 7.2469 7.2469 7.2973 7.2973 7.6105 7.6105 7.6595 7.6595 12.1826 12.1826 12.1847 12.1847 k = 0.5000 0.5539 0.1790 ( 4372 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6804 -11.6804 -11.6780 -11.6780 -11.4384 -11.4384 -11.4354 -11.4354 -6.9134 -6.9134 -6.8786 -6.8786 -6.6812 -6.6812 -6.5955 -6.5955 -6.4292 -6.4292 -6.3744 -6.3744 0.7137 0.7137 0.7158 0.7158 1.5472 1.5472 1.5501 1.5501 1.9689 1.9689 1.9746 1.9746 2.6920 2.6920 2.7081 2.7081 3.0403 3.0403 3.0563 3.0563 3.6601 3.6601 3.6677 3.6677 5.7023 5.7023 5.7448 5.7448 5.9279 5.9279 5.9513 5.9513 6.5819 6.5819 6.6071 6.6071 7.2551 7.2551 7.3042 7.3042 7.6104 7.6104 7.6578 7.6578 12.1830 12.1830 12.1851 12.1851 k = 0.5000 0.5539 0.1627 ( 4376 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6767 -11.6767 -11.6744 -11.6744 -11.4429 -11.4429 -11.4400 -11.4400 -6.9114 -6.9114 -6.8791 -6.8791 -6.6777 -6.6777 -6.5983 -6.5983 -6.4261 -6.4261 -6.3755 -6.3755 0.7061 0.7061 0.7080 0.7080 1.5513 1.5513 1.5540 1.5540 1.9668 1.9668 1.9722 1.9722 2.6960 2.6960 2.7113 2.7113 3.0357 3.0357 3.0508 3.0508 3.6723 3.6723 3.6793 3.6793 5.6990 5.6990 5.7352 5.7352 5.9310 5.9310 5.9541 5.9541 6.5717 6.5717 6.5963 6.5963 7.2635 7.2635 7.3110 7.3110 7.6100 7.6100 7.6556 7.6556 12.1832 12.1832 12.1853 12.1853 k = 0.5000 0.5539 0.1464 ( 4386 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6732 -11.6732 -11.6710 -11.6710 -11.4472 -11.4472 -11.4445 -11.4445 -6.9094 -6.9094 -6.8799 -6.8799 -6.6739 -6.6739 -6.6012 -6.6012 -6.4230 -6.4230 -6.3767 -6.3767 0.6992 0.6992 0.7009 0.7009 1.5551 1.5551 1.5577 1.5577 1.9647 1.9647 1.9697 1.9697 2.7002 2.7002 2.7145 2.7145 3.0311 3.0311 3.0451 3.0451 3.6841 3.6841 3.6906 3.6906 5.6945 5.6945 5.7248 5.7248 5.9352 5.9352 5.9579 5.9579 6.5622 6.5622 6.5859 6.5859 7.2721 7.2721 7.3173 7.3173 7.6095 7.6095 7.6527 7.6527 12.1834 12.1834 12.1853 12.1853 k = 0.5000 0.5539 0.1302 ( 4386 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6697 -11.6697 -11.6676 -11.6676 -11.4513 -11.4513 -11.4488 -11.4488 -6.9075 -6.9075 -6.8809 -6.8809 -6.6699 -6.6699 -6.6044 -6.6044 -6.4198 -6.4198 -6.3781 -6.3781 0.6930 0.6930 0.6945 0.6945 1.5586 1.5586 1.5610 1.5610 1.9628 1.9628 1.9673 1.9673 2.7044 2.7044 2.7176 2.7176 3.0265 3.0265 3.0393 3.0393 3.6953 3.6953 3.7012 3.7012 5.6892 5.6892 5.7144 5.7144 5.9404 5.9404 5.9623 5.9623 6.5536 6.5536 6.5760 6.5760 7.2808 7.2808 7.3232 7.3232 7.6089 7.6089 7.6494 7.6494 12.1834 12.1834 12.1853 12.1853 k = 0.5000 0.5539 0.1139 ( 4386 PWs) bands (ev): -23.1451 -23.1451 -23.1451 -23.1451 -11.6664 -11.6664 -11.6645 -11.6645 -11.4552 -11.4552 -11.4529 -11.4529 -6.9056 -6.9056 -6.8820 -6.8820 -6.6658 -6.6658 -6.6077 -6.6077 -6.4166 -6.4166 -6.3797 -6.3797 0.6874 0.6874 0.6887 0.6887 1.5618 1.5618 1.5639 1.5639 1.9609 1.9609 1.9650 1.9650 2.7086 2.7086 2.7206 2.7206 3.0221 3.0221 3.0337 3.0337 3.7059 3.7059 3.7111 3.7111 5.6836 5.6836 5.7043 5.7043 5.9461 5.9461 5.9667 5.9667 6.5460 6.5460 6.5666 6.5666 7.2893 7.2893 7.3284 7.3284 7.6084 7.6084 7.6456 7.6456 12.1835 12.1835 12.1852 12.1852 k = 0.5000 0.5539 0.0976 ( 4378 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6633 -11.6633 -11.6616 -11.6616 -11.4587 -11.4587 -11.4566 -11.4566 -6.9037 -6.9037 -6.8832 -6.8832 -6.6615 -6.6615 -6.6112 -6.6112 -6.4134 -6.4134 -6.3814 -6.3814 0.6826 0.6826 0.6837 0.6837 1.5646 1.5646 1.5665 1.5665 1.9592 1.9592 1.9628 1.9628 2.7127 2.7127 2.7234 2.7234 3.0180 3.0180 3.0283 3.0283 3.7154 3.7154 3.7200 3.7200 5.6781 5.6781 5.6948 5.6948 5.9521 5.9521 5.9709 5.9709 6.5395 6.5395 6.5580 6.5580 7.2977 7.2977 7.3328 7.3328 7.6082 7.6082 7.6415 7.6415 12.1835 12.1835 12.1850 12.1850 k = 0.5000 0.5539 0.0814 ( 4382 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6605 -11.6605 -11.6590 -11.6590 -11.4618 -11.4618 -11.4600 -11.4600 -6.9018 -6.9018 -6.8846 -6.8846 -6.6571 -6.6571 -6.6148 -6.6148 -6.4102 -6.4102 -6.3833 -6.3833 0.6785 0.6785 0.6795 0.6795 1.5671 1.5671 1.5687 1.5687 1.9577 1.9577 1.9608 1.9608 2.7165 2.7165 2.7257 2.7257 3.0144 3.0144 3.0233 3.0233 3.7239 3.7239 3.7278 3.7278 5.6730 5.6730 5.6862 5.6862 5.9579 5.9579 5.9744 5.9744 6.5340 6.5340 6.5502 6.5502 7.3057 7.3057 7.3361 7.3361 7.6083 7.6083 7.6372 7.6372 12.1835 12.1835 12.1848 12.1848 k = 0.5000 0.5539 0.0651 ( 4392 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6580 -11.6580 -11.6568 -11.6568 -11.4644 -11.4644 -11.4629 -11.4629 -6.9000 -6.9000 -6.8861 -6.8861 -6.6527 -6.6527 -6.6186 -6.6186 -6.4071 -6.4071 -6.3854 -6.3854 0.6752 0.6752 0.6759 0.6759 1.5691 1.5691 1.5705 1.5705 1.9565 1.9565 1.9590 1.9590 2.7201 2.7201 2.7276 2.7276 3.0115 3.0115 3.0187 3.0187 3.7311 3.7311 3.7343 3.7343 5.6686 5.6686 5.6787 5.6787 5.9634 5.9634 5.9772 5.9772 6.5298 6.5298 6.5432 6.5432 7.3132 7.3132 7.3384 7.3384 7.6088 7.6088 7.6328 7.6328 12.1835 12.1835 12.1846 12.1846 k = 0.5000 0.5539 0.0488 ( 4388 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6560 -11.6560 -11.6551 -11.6551 -11.4665 -11.4665 -11.4654 -11.4654 -6.8981 -6.8981 -6.8877 -6.8877 -6.6482 -6.6482 -6.6225 -6.6225 -6.4040 -6.4040 -6.3877 -6.3877 0.6726 0.6726 0.6731 0.6731 1.5708 1.5708 1.5718 1.5718 1.9556 1.9556 1.9575 1.9575 2.7232 2.7232 2.7289 2.7289 3.0093 3.0093 3.0148 3.0148 3.7370 3.7370 3.7394 3.7394 5.6652 5.6652 5.6725 5.6725 5.9683 5.9683 5.9791 5.9791 6.5269 6.5269 6.5372 6.5372 7.3200 7.3200 7.3395 7.3395 7.6099 7.6099 7.6284 7.6284 12.1835 12.1835 12.1844 12.1844 k = 0.5000 0.5539 0.0325 ( 4384 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6545 -11.6545 -11.6538 -11.6538 -11.4679 -11.4679 -11.4672 -11.4672 -6.8963 -6.8963 -6.8893 -6.8893 -6.6438 -6.6438 -6.6266 -6.6266 -6.4010 -6.4010 -6.3901 -6.3901 0.6708 0.6708 0.6711 0.6711 1.5721 1.5721 1.5728 1.5728 1.9550 1.9550 1.9563 1.9563 2.7258 2.7258 2.7297 2.7297 3.0080 3.0080 3.0117 3.0117 3.7414 3.7414 3.7430 3.7430 5.6629 5.6629 5.6677 5.6677 5.9726 5.9726 5.9799 5.9799 6.5254 6.5254 6.5323 6.5323 7.3260 7.3260 7.3393 7.3393 7.6116 7.6116 7.6242 7.6242 12.1836 12.1836 12.1842 12.1842 k = 0.5000 0.5539 0.0163 ( 4384 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6534 -11.6534 -11.6531 -11.6531 -11.4688 -11.4688 -11.4684 -11.4684 -6.8945 -6.8945 -6.8910 -6.8910 -6.6394 -6.6394 -6.6308 -6.6308 -6.3981 -6.3981 -6.3926 -6.3926 0.6697 0.6697 0.6699 0.6699 1.5729 1.5729 1.5732 1.5732 1.9548 1.9548 1.9554 1.9554 2.7277 2.7277 2.7297 2.7297 3.0075 3.0075 3.0094 3.0094 3.7442 3.7442 3.7450 3.7450 5.6620 5.6620 5.6644 5.6644 5.9760 5.9760 5.9797 5.9797 6.5251 6.5251 6.5287 6.5287 7.3311 7.3311 7.3378 7.3378 7.6140 7.6140 7.6204 7.6204 12.1837 12.1837 12.1840 12.1840 k = 0.5000 0.5539-0.0000 ( 4384 PWs) bands (ev): -23.1450 -23.1450 -23.1450 -23.1450 -11.6530 -11.6530 -11.6530 -11.6530 -11.4689 -11.4689 -11.4689 -11.4689 -6.8928 -6.8928 -6.8927 -6.8927 -6.6350 -6.6350 -6.6350 -6.6350 -6.3953 -6.3953 -6.3953 -6.3953 0.6694 0.6694 0.6694 0.6694 1.5733 1.5733 1.5733 1.5733 1.9549 1.9549 1.9549 1.9549 2.7291 2.7291 2.7291 2.7291 3.0080 3.0080 3.0080 3.0080 3.7454 3.7454 3.7454 3.7454 5.6624 5.6624 5.6624 5.6624 5.9784 5.9784 5.9784 5.9784 6.5262 6.5262 6.5262 6.5262 7.3351 7.3351 7.3351 7.3351 7.6169 7.6169 7.6169 7.6169 12.1839 12.1839 12.1839 12.1839 k = 0.0000 0.0000 0.6736 ( 4380 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7284 -11.7284 -11.7274 -11.7274 -11.3652 -11.3652 -11.3627 -11.3627 -6.9541 -6.9541 -6.9474 -6.9474 -6.6213 -6.6213 -6.6177 -6.6177 -6.4230 -6.4230 -6.4199 -6.4199 1.0444 1.0444 1.0510 1.0510 1.3483 1.3483 1.3531 1.3531 1.9598 1.9598 1.9601 1.9601 2.7062 2.7062 2.7180 2.7180 2.9188 2.9188 2.9266 2.9266 3.6130 3.6130 3.6258 3.6258 5.4339 5.4339 5.5202 5.5202 6.2476 6.2476 6.2483 6.2483 6.7919 6.7919 6.8324 6.8324 7.2244 7.2244 7.2775 7.2775 7.4802 7.4802 7.5038 7.5038 12.0635 12.0635 12.0673 12.0673 k = 0.0114 0.0126 0.6736 ( 4382 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7286 -11.7283 -11.7276 -11.7273 -11.3654 -11.3650 -11.3627 -11.3626 -6.9553 -6.9527 -6.9480 -6.9466 -6.6253 -6.6219 -6.6175 -6.6137 -6.4264 -6.4227 -6.4198 -6.4171 1.0445 1.0445 1.0509 1.0514 1.3481 1.3485 1.3529 1.3531 1.9597 1.9600 1.9600 1.9604 2.7049 2.7070 2.7167 2.7189 2.9182 2.9205 2.9269 2.9274 3.6117 3.6129 3.6250 3.6252 5.4331 5.4354 5.5186 5.5223 6.2451 6.2460 6.2494 6.2502 6.7893 6.7953 6.8326 6.8330 7.2181 7.2287 7.2723 7.2801 7.4768 7.4861 7.5004 7.5092 12.0641 12.0642 12.0678 12.0681 k = 0.0227 0.0252 0.6736 ( 4382 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7288 -11.7283 -11.7278 -11.7273 -11.3655 -11.3647 -11.3627 -11.3624 -6.9563 -6.9510 -6.9483 -6.9456 -6.6294 -6.6263 -6.6138 -6.6099 -6.4298 -6.4255 -6.4166 -6.4144 1.0448 1.0448 1.0510 1.0519 1.3477 1.3485 1.3527 1.3529 1.9596 1.9600 1.9602 1.9608 2.7033 2.7074 2.7152 2.7195 2.9188 2.9232 2.9283 2.9292 3.6089 3.6115 3.6229 3.6232 5.4332 5.4377 5.5175 5.5250 6.2419 6.2432 6.2506 6.2516 6.7876 6.7995 6.8337 6.8344 7.2097 7.2305 7.2648 7.2796 7.4762 7.4942 7.4991 7.5163 12.0660 12.0660 12.0695 12.0700 k = 0.0341 0.0378 0.6736 ( 4374 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7290 -11.7284 -11.7280 -11.7273 -11.3656 -11.3643 -11.3626 -11.3622 -6.9571 -6.9492 -6.9484 -6.9444 -6.6337 -6.6308 -6.6104 -6.6064 -6.4332 -6.4283 -6.4136 -6.4117 1.0453 1.0453 1.0513 1.0527 1.3472 1.3484 1.3523 1.3527 1.9595 1.9602 1.9605 1.9612 2.7014 2.7074 2.7134 2.7197 2.9205 2.9270 2.9308 2.9320 3.6048 3.6086 3.6195 3.6199 5.4340 5.4407 5.5170 5.5283 6.2382 6.2401 6.2511 6.2525 6.7869 6.8046 6.8357 6.8368 7.1998 7.2299 7.2555 7.2762 7.4784 7.5001 7.5039 7.5249 12.0690 12.0691 12.0724 12.0732 k = 0.0455 0.0504 0.6736 ( 4370 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7293 -11.7286 -11.7282 -11.7274 -11.3656 -11.3639 -11.3625 -11.3619 -6.9577 -6.9483 -6.9471 -6.9429 -6.6381 -6.6355 -6.6071 -6.6031 -6.4366 -6.4311 -6.4106 -6.4091 1.0460 1.0461 1.0518 1.0536 1.3466 1.3482 1.3518 1.3523 1.9595 1.9605 1.9608 1.9618 2.6993 2.7071 2.7114 2.7197 2.9233 2.9318 2.9343 2.9358 3.5993 3.6045 3.6148 3.6153 5.4356 5.4444 5.5169 5.5320 6.2338 6.2367 6.2510 6.2529 6.7870 6.8105 6.8386 6.8399 7.1885 7.2269 7.2448 7.2701 7.4831 7.5031 7.5148 7.5346 12.0733 12.0734 12.0766 12.0776 k = 0.0568 0.0629 0.6736 ( 4382 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7297 -11.7289 -11.7284 -11.7276 -11.3655 -11.3635 -11.3623 -11.3616 -6.9581 -6.9481 -6.9449 -6.9412 -6.6426 -6.6403 -6.6041 -6.6001 -6.4401 -6.4339 -6.4078 -6.4066 1.0470 1.0470 1.0524 1.0547 1.3458 1.3478 1.3512 1.3518 1.9596 1.9609 1.9613 1.9624 2.6969 2.7064 2.7093 2.7193 2.9271 2.9375 2.9388 2.9403 3.5926 3.5991 3.6088 3.6095 5.4378 5.4487 5.5172 5.5361 6.2289 6.2330 6.2501 6.2528 6.7880 6.8171 6.8422 6.8437 7.1761 7.2218 7.2330 7.2617 7.4898 7.5080 7.5265 7.5451 12.0789 12.0790 12.0821 12.0833 k = 0.0682 0.0755 0.6736 ( 4378 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7301 -11.7293 -11.7286 -11.7278 -11.3654 -11.3630 -11.3620 -11.3612 -6.9584 -6.9476 -6.9425 -6.9394 -6.6472 -6.6451 -6.6012 -6.5973 -6.4435 -6.4365 -6.4051 -6.4041 1.0481 1.0481 1.0532 1.0560 1.3450 1.3474 1.3504 1.3511 1.9598 1.9614 1.9618 1.9631 2.6944 2.7053 2.7070 2.7187 2.9319 2.9439 2.9442 2.9457 3.5847 3.5925 3.6018 3.6027 5.4408 5.4536 5.5180 5.5408 6.2237 6.2291 6.2487 6.2522 6.7900 6.8244 6.8467 6.8484 7.1629 7.2147 7.2206 7.2515 7.4982 7.5144 7.5387 7.5561 12.0857 12.0859 12.0888 12.0902 k = 0.0795 0.0881 0.6736 ( 4358 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7305 -11.7297 -11.7288 -11.7280 -11.3653 -11.3625 -11.3617 -11.3608 -6.9584 -6.9470 -6.9399 -6.9373 -6.6518 -6.6501 -6.5986 -6.5947 -6.4469 -6.4390 -6.4026 -6.4018 1.0493 1.0493 1.0542 1.0575 1.3441 1.3469 1.3496 1.3505 1.9600 1.9619 1.9624 1.9638 2.6919 2.7041 2.7047 2.7179 2.9376 2.9505 2.9511 2.9517 3.5758 3.5849 3.5937 3.5948 5.4445 5.4591 5.5191 5.5458 6.2181 6.2253 6.2469 6.2513 6.7929 6.8324 6.8519 6.8538 7.1490 7.2061 7.2075 7.2399 7.5076 7.5220 7.5511 7.5675 12.0938 12.0940 12.0968 12.0984 k = 0.0909 0.1007 0.6736 ( 4358 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1457 -11.7309 -11.7302 -11.7291 -11.7282 -11.3651 -11.3619 -11.3614 -11.3604 -6.9583 -6.9463 -6.9373 -6.9351 -6.6565 -6.6550 -6.5961 -6.5924 -6.4502 -6.4415 -6.4002 -6.3996 1.0507 1.0507 1.0553 1.0590 1.3431 1.3463 1.3487 1.3497 1.9603 1.9625 1.9630 1.9645 2.6893 2.7024 2.7027 2.7169 2.9439 2.9575 2.9583 2.9589 3.5659 3.5765 3.5847 3.5860 5.4486 5.4649 5.5204 5.5511 6.2122 6.2213 6.2444 6.2499 6.7966 6.8410 6.8579 6.8598 7.1347 7.1941 7.1962 7.2272 7.5176 7.5305 7.5634 7.5789 12.1032 12.1034 12.1061 12.1079 k = 0.1023 0.1133 0.6736 ( 4358 PWs) bands (ev): -23.1458 -23.1457 -23.1457 -23.1457 -11.7314 -11.7307 -11.7293 -11.7285 -11.3649 -11.3614 -11.3610 -11.3599 -6.9581 -6.9454 -6.9345 -6.9327 -6.6611 -6.6600 -6.5939 -6.5904 -6.4534 -6.4438 -6.3980 -6.3975 1.0522 1.0522 1.0565 1.0607 1.3420 1.3456 1.3477 1.3488 1.9606 1.9632 1.9637 1.9652 2.6867 2.7002 2.7011 2.7158 2.9510 2.9652 2.9653 2.9671 3.5553 3.5672 3.5750 3.5764 5.4532 5.4709 5.5218 5.5565 6.2060 6.2173 6.2415 6.2482 6.8012 6.8502 6.8647 6.8666 7.1201 7.1804 7.1853 7.2138 7.5280 7.5394 7.5756 7.5902 12.1139 12.1141 12.1167 12.1186 k = 0.1136 0.1259 0.6736 ( 4348 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7319 -11.7312 -11.7296 -11.7289 -11.3646 -11.3609 -11.3606 -11.3595 -6.9578 -6.9445 -6.9316 -6.9302 -6.6658 -6.6648 -6.5919 -6.5887 -6.4565 -6.4460 -6.3959 -6.3955 1.0537 1.0538 1.0578 1.0624 1.3409 1.3449 1.3467 1.3478 1.9610 1.9639 1.9644 1.9660 2.6842 2.6980 2.6994 2.7147 2.9585 2.9727 2.9734 2.9757 3.5440 3.5575 3.5647 3.5663 5.4582 5.4772 5.5232 5.5620 6.1998 6.2134 6.2383 6.2461 6.8066 6.8600 6.8721 6.8740 7.1052 7.1665 7.1736 7.1999 7.5386 7.5487 7.5875 7.6014 12.1258 12.1261 12.1285 12.1305 k = 0.1250 0.1385 0.6736 ( 4360 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7324 -11.7317 -11.7300 -11.7292 -11.3644 -11.3605 -11.3600 -11.3590 -6.9574 -6.9435 -6.9288 -6.9277 -6.6703 -6.6696 -6.5901 -6.5872 -6.4595 -6.4481 -6.3939 -6.3937 1.0553 1.0554 1.0591 1.0642 1.3398 1.3441 1.3456 1.3468 1.9613 1.9646 1.9651 1.9667 2.6818 2.6960 2.6977 2.7135 2.9664 2.9802 2.9819 2.9846 3.5323 3.5472 3.5539 3.5558 5.4634 5.4835 5.5246 5.5675 6.1935 6.2097 6.2346 6.2438 6.8128 6.8703 6.8801 6.8819 7.0902 7.1525 7.1612 7.1855 7.5489 7.5579 7.5988 7.6121 12.1390 12.1393 12.1416 12.1436 k = 0.1364 0.1511 0.6736 ( 4356 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7328 -11.7322 -11.7303 -11.7295 -11.3641 -11.3601 -11.3595 -11.3586 -6.9570 -6.9425 -6.9259 -6.9252 -6.6747 -6.6743 -6.5885 -6.5859 -6.4623 -6.4500 -6.3922 -6.3920 1.0569 1.0570 1.0604 1.0659 1.3387 1.3433 1.3446 1.3458 1.9617 1.9653 1.9658 1.9674 2.6796 2.6941 2.6961 2.7124 2.9746 2.9879 2.9907 2.9935 3.5203 3.5368 3.5430 3.5450 5.4690 5.4898 5.5260 5.5730 6.1873 6.2063 6.2308 6.2414 6.8198 6.8811 6.8888 6.8905 7.0752 7.1385 7.1485 7.1709 7.5589 7.5669 7.6096 7.6224 12.1533 12.1537 12.1558 12.1579 k = 0.1477 0.1636 0.6736 ( 4350 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7333 -11.7327 -11.7306 -11.7299 -11.3638 -11.3597 -11.3590 -11.3581 -6.9565 -6.9414 -6.9231 -6.9226 -6.6790 -6.6787 -6.5870 -6.5848 -6.4649 -6.4516 -6.3906 -6.3905 1.0585 1.0586 1.0618 1.0677 1.3375 1.3425 1.3435 1.3448 1.9622 1.9660 1.9665 1.9680 2.6775 2.6924 2.6945 2.7113 2.9829 2.9955 2.9996 3.0025 3.5083 3.5265 3.5319 3.5342 5.4747 5.4960 5.5272 5.5784 6.1813 6.2032 6.2269 6.2389 6.8275 6.8922 6.8980 6.8995 7.0602 7.1246 7.1355 7.1562 7.5684 7.5754 7.6197 7.6320 12.1686 12.1690 12.1710 12.1731 k = 0.1591 0.1762 0.6736 ( 4354 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7337 -11.7332 -11.7309 -11.7302 -11.3635 -11.3593 -11.3584 -11.3577 -6.9559 -6.9404 -6.9204 -6.9201 -6.6830 -6.6829 -6.5858 -6.5839 -6.4673 -6.4532 -6.3892 -6.3891 1.0600 1.0602 1.0630 1.0693 1.3364 1.3418 1.3425 1.3438 1.9625 1.9668 1.9671 1.9686 2.6756 2.6908 2.6929 2.7103 2.9911 3.0029 3.0084 3.0113 3.4965 3.5163 3.5211 3.5235 5.4804 5.5018 5.5280 5.5834 6.1756 6.2004 6.2228 6.2363 6.8358 6.9037 6.9076 6.9090 7.0453 7.1106 7.1223 7.1414 7.5773 7.5834 7.6289 7.6408 12.1849 12.1853 12.1871 12.1892 k = 0.1705 0.1888 0.6736 ( 4368 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7341 -11.7336 -11.7312 -11.7305 -11.3633 -11.3590 -11.3580 -11.3573 -6.9554 -6.9395 -6.9178 -6.9177 -6.6868 -6.6867 -6.5848 -6.5832 -6.4695 -6.4545 -6.3879 -6.3879 1.0615 1.0617 1.0642 1.0709 1.3354 1.3410 1.3415 1.3429 1.9629 1.9674 1.9677 1.9691 2.6739 2.6894 2.6914 2.7093 2.9991 3.0099 3.0170 3.0197 3.4852 3.5066 3.5107 3.5133 5.4860 5.5073 5.5285 5.5881 6.1702 6.1981 6.2187 6.2338 6.8447 6.9154 6.9176 6.9189 7.0305 7.0967 7.1091 7.1266 7.5854 7.5907 7.6373 7.6488 12.2017 12.2021 12.2038 12.2059 k = 0.1818 0.2014 0.6736 ( 4376 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7344 -11.7340 -11.7315 -11.7308 -11.3630 -11.3587 -11.3575 -11.3570 -6.9550 -6.9386 -6.9155 -6.9155 -6.6903 -6.6902 -6.5839 -6.5827 -6.4714 -6.4557 -6.3869 -6.3868 1.0628 1.0631 1.0653 1.0723 1.3344 1.3403 1.3406 1.3420 1.9632 1.9680 1.9682 1.9696 2.6723 2.6882 2.6901 2.7085 3.0067 3.0163 3.0251 3.0276 3.4745 3.4976 3.5010 3.5036 5.4916 5.5123 5.5286 5.5924 6.1653 6.1962 6.2147 6.2315 6.8541 6.9274 6.9280 6.9293 7.0161 7.0830 7.0960 7.1120 7.5926 7.5972 7.6447 7.6560 12.2187 12.2192 12.2206 12.2228 k = 0.1932 0.2140 0.6736 ( 4364 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7347 -11.7344 -11.7317 -11.7310 -11.3628 -11.3584 -11.3571 -11.3567 -6.9545 -6.9378 -6.9134 -6.9134 -6.6933 -6.6932 -6.5832 -6.5822 -6.4730 -6.4567 -6.3859 -6.3859 1.0640 1.0644 1.0662 1.0736 1.3336 1.3397 1.3399 1.3412 1.9636 1.9686 1.9687 1.9700 2.6711 2.6873 2.6890 2.7077 3.0137 3.0221 3.0325 3.0347 3.4649 3.4896 3.4922 3.4949 5.4970 5.5168 5.5284 5.5962 6.1610 6.1949 6.2110 6.2294 6.8641 6.9387 6.9395 6.9400 7.0020 7.0695 7.0831 7.0976 7.5990 7.6028 7.6511 7.6622 12.2355 12.2360 12.2373 12.2394 k = 0.2045 0.2266 0.6736 ( 4358 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7350 -11.7347 -11.7319 -11.7312 -11.3626 -11.3582 -11.3568 -11.3564 -6.9541 -6.9371 -6.9117 -6.9115 -6.6959 -6.6957 -6.5826 -6.5819 -6.4743 -6.4574 -6.3852 -6.3852 1.0650 1.0655 1.0670 1.0747 1.3329 1.3390 1.3394 1.3405 1.9638 1.9691 1.9692 1.9703 2.6700 2.6866 2.6880 2.7071 3.0200 3.0269 3.0390 3.0409 3.4564 3.4828 3.4845 3.4872 5.5022 5.5207 5.5276 5.5994 6.1574 6.1941 6.2074 6.2276 6.8743 6.9494 6.9510 6.9514 6.9883 7.0563 7.0709 7.0836 7.6044 7.6074 7.6564 7.6673 12.2514 12.2519 12.2529 12.2550 k = 0.2159 0.2392 0.6736 ( 4358 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7351 -11.7349 -11.7321 -11.7314 -11.3625 -11.3580 -11.3565 -11.3563 -6.9537 -6.9365 -6.9102 -6.9101 -6.6979 -6.6978 -6.5821 -6.5817 -6.4754 -6.4581 -6.3846 -6.3846 1.0658 1.0665 1.0675 1.0756 1.3323 1.3385 1.3391 1.3399 1.9641 1.9694 1.9697 1.9705 2.6692 2.6860 2.6871 2.7067 3.0253 3.0306 3.0444 3.0460 3.4496 3.4774 3.4783 3.4808 5.5070 5.5237 5.5263 5.6020 6.1545 6.1939 6.2041 6.2261 6.8845 6.9598 6.9621 6.9626 6.9755 7.0435 7.0595 7.0704 7.6087 7.6110 7.6606 7.6713 12.2655 12.2659 12.2667 12.2688 k = 0.2273 0.2518 0.6736 ( 4358 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7353 -11.7351 -11.7322 -11.7315 -11.3624 -11.3578 -11.3563 -11.3561 -6.9535 -6.9361 -6.9092 -6.9091 -6.6994 -6.6993 -6.5818 -6.5815 -6.4762 -6.4585 -6.3842 -6.3842 1.0664 1.0672 1.0679 1.0762 1.3319 1.3381 1.3389 1.3394 1.9642 1.9697 1.9700 1.9706 2.6686 2.6857 2.6864 2.7063 3.0295 3.0331 3.0484 3.0498 3.4444 3.4735 3.4737 3.4759 5.5115 5.5244 5.5259 5.6039 6.1523 6.1942 6.2012 6.2250 6.8941 6.9640 6.9694 6.9725 6.9729 7.0314 7.0500 7.0584 7.6120 7.6135 7.6636 7.6743 12.2768 12.2771 12.2776 12.2798 k = 0.2386 0.2643 0.6736 ( 4364 PWs) bands (ev): -23.1457 -23.1457 -23.1457 -23.1457 -11.7353 -11.7353 -11.7323 -11.7316 -11.3623 -11.3578 -11.3562 -11.3561 -6.9534 -6.9359 -6.9085 -6.9085 -6.7003 -6.7003 -6.5817 -6.5814 -6.4766 -6.4588 -6.3839 -6.3839 1.0668 1.0677 1.0681 1.0766 1.3317 1.3378 1.3388 1.3391 1.9643 1.9698 1.9703 1.9706 2.6682 2.6856 2.6859 2.7061 3.0325 3.0343 3.0508 3.0521 3.4413 3.4708 3.4715 3.4726 5.5155 5.5220 5.5273 5.6050 6.1510 6.1952 6.1987 6.2243 6.9018 6.9550 6.9771 6.9792 6.9824 7.0211 7.0439 7.0487 7.6141 7.6148 7.6654 7.6760 12.2842 12.2843 12.2847 12.2870 k = 0.2500 0.2769 0.6736 ( 4376 PWs) bands (ev): -23.1458 -23.1458 -23.1458 -23.1458 -11.7353 -11.7353 -11.7323 -11.7316 -11.3623 -11.3577 -11.3561 -11.3561 -6.9533 -6.9358 -6.9083 -6.9083 -6.7006 -6.7006 -6.5816 -6.5814 -6.4768 -6.4589 -6.3839 -6.3839 1.0669 1.0680 1.0680 1.0767 1.3316 1.3377 1.3388 1.3388 1.9643 1.9699 1.9705 1.9705 2.6680 2.6856 2.6856 2.7060 3.0340 3.0340 3.0516 3.0529 3.4402 3.4698 3.4711 3.4711 5.5189 5.5190 5.5277 5.6054 6.1505 6.1966 6.1967 6.2240 6.9049 6.9515 6.9808 6.9809 6.9868 7.0164 7.0433 7.0434 7.6150 7.6150 7.6660 7.6766 12.2868 12.2870 12.2870 12.2894 Writing output data file KCoO2.save init_run : 2.70s CPU 13.63s WALL ( 1 calls) electrons : 1544.05s CPU 1555.30s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.29s CPU 1.47s WALL ( 1 calls) Called by electrons: c_bands : 1544.01s CPU 1554.94s WALL ( 1 calls) v_of_rho : 0.13s CPU 1.04s WALL ( 1 calls) v_h : 0.01s CPU 0.18s WALL ( 1 calls) v_xc : 0.11s CPU 0.63s WALL ( 1 calls) newd : 0.37s CPU 0.61s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.10s WALL ( 312 calls) cegterg : 1470.07s CPU 1478.22s WALL ( 1121 calls) Called by sum_band: Called by *egterg: h_psi : 479.12s CPU 491.77s WALL ( 20861 calls) s_psi : 68.16s CPU 68.48s WALL ( 20861 calls) g_psi : 1.10s CPU 1.10s WALL ( 19428 calls) cdiaghg : 717.15s CPU 713.39s WALL ( 19740 calls) cegterg:over : 114.54s CPU 109.17s WALL ( 19428 calls) cegterg:upda : 29.24s CPU 34.58s WALL ( 19428 calls) cegterg:last : 21.77s CPU 22.53s WALL ( 2369 calls) Called by h_psi: h_psi:vloc : 346.55s CPU 356.92s WALL ( 20861 calls) h_psi:vnl : 132.05s CPU 133.63s WALL ( 20861 calls) add_vuspsi : 47.47s CPU 54.79s WALL ( 20861 calls) General routines calbec : 84.51s CPU 78.67s WALL ( 20861 calls) fft : 0.07s CPU 1.15s WALL ( 19 calls) ffts : 0.00s CPU 0.02s WALL ( 4 calls) fftw : 326.97s CPU 334.46s WALL ( 1977904 calls) interpolate : 0.01s CPU 0.03s WALL ( 4 calls) davcio : 0.02s CPU 1.85s WALL ( 624 calls) Parallel routines fft_scatter : 222.02s CPU 221.56s WALL ( 1977927 calls) PWSCF : 26m57.00s CPU 29m26.84s WALL This run was terminated on: 5:22:32 15Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=