Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:45:55 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CaxCoSix2.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 69 69 19 1376 1376 210 Max 70 70 20 1378 1378 212 Sum 2497 2497 715 49565 49565 7605 bravais-lattice index = 14 lattice parameter (alat) = 10.7335 a.u. unit-cell volume = 513.2343 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.733508 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.762320 celldm(5)= -0.762320 celldm(6)= 0.524641 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.524641 0.851324 0.000000 ) a(3) = ( -0.762320 -0.425662 0.487524 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.616265 1.025591 ) b(2) = ( 0.000000 1.174641 1.025591 ) b(3) = ( 0.000000 0.000000 2.051181 ) PseudoPot. # 1 for Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 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 PseudoPot. # 2 for Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Co 17.00 58.93320 Co( 1.00) Ca 10.00 40.07800 Ca( 1.00) Si 4.00 28.08550 Si( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 366 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 2) = ( 0.0000000 0.0000000 0.0179928), wk = 0.0027322 k( 3) = ( 0.0000000 0.0000000 0.0359856), wk = 0.0027322 k( 4) = ( 0.0000000 0.0000000 0.0539785), wk = 0.0027322 k( 5) = ( 0.0000000 0.0000000 0.0719713), wk = 0.0027322 k( 6) = ( 0.0000000 0.0000000 0.0899641), wk = 0.0027322 k( 7) = ( 0.0000000 0.0000000 0.1079569), wk = 0.0027322 k( 8) = ( 0.0000000 0.0000000 0.1259497), wk = 0.0027322 k( 9) = ( 0.0000000 0.0000000 0.1439426), wk = 0.0027322 k( 10) = ( 0.0000000 0.0000000 0.1619354), wk = 0.0027322 k( 11) = ( 0.0000000 0.0000000 0.1799282), wk = 0.0027322 k( 12) = ( 0.0000000 0.0000000 0.1979210), wk = 0.0027322 k( 13) = ( 0.0000000 0.0000000 0.2159138), wk = 0.0027322 k( 14) = ( 0.0000000 0.0000000 0.2339067), wk = 0.0027322 k( 15) = ( 0.0000000 0.0000000 0.2518995), wk = 0.0027322 k( 16) = ( 0.0000000 0.0000000 0.2698923), wk = 0.0027322 k( 17) = ( 0.0000000 0.0000000 0.2878851), wk = 0.0027322 k( 18) = ( 0.0000000 0.0000000 0.3058779), wk = 0.0027322 k( 19) = ( 0.0000000 0.0000000 0.3238708), wk = 0.0027322 k( 20) = ( 0.0000000 0.0000000 0.3418636), wk = 0.0027322 k( 21) = ( 0.0000000 0.0000000 0.3598564), wk = 0.0027322 k( 22) = ( 0.0000000 0.0000000 0.3778492), wk = 0.0027322 k( 23) = ( 0.0000000 0.0000000 0.3958420), wk = 0.0027322 k( 24) = ( 0.0000000 0.0000000 0.4138349), wk = 0.0027322 k( 25) = ( 0.0000000 0.0000000 0.4318277), wk = 0.0027322 k( 26) = ( 0.0000000 0.0000000 0.4498205), wk = 0.0027322 k( 27) = ( 0.0000000 0.0000000 0.4678133), wk = 0.0027322 k( 28) = ( 0.0000000 0.0000000 0.4858061), wk = 0.0027322 k( 29) = ( 0.0000000 0.0000000 0.5037990), wk = 0.0027322 k( 30) = ( 0.0000000 0.0000000 0.5217917), wk = 0.0027322 k( 31) = ( 0.0000000 0.0000000 0.5397846), wk = 0.0027322 k( 32) = ( 0.0000000 0.0000000 0.5577774), wk = 0.0027322 k( 33) = ( 0.0000000 0.0000000 0.5757702), wk = 0.0027322 k( 34) = ( 0.0000000 0.0000000 0.5937630), wk = 0.0027322 k( 35) = ( 0.0000000 0.0000000 0.6117558), wk = 0.0027322 k( 36) = ( 0.0000000 0.0000000 0.6297487), wk = 0.0027322 k( 37) = ( 0.0000000 0.0000000 0.6477415), wk = 0.0027322 k( 38) = ( 0.0000000 0.0000000 0.6657343), wk = 0.0027322 k( 39) = ( 0.0000000 0.0000000 0.6837271), wk = 0.0027322 k( 40) = ( 0.0000000 0.0000000 0.7017199), wk = 0.0027322 k( 41) = ( 0.0000000 0.0000000 0.7197128), wk = 0.0027322 k( 42) = ( 0.0000000 0.0000000 0.7377056), wk = 0.0027322 k( 43) = ( 0.0000000 0.0000000 0.7556984), wk = 0.0027322 k( 44) = ( 0.0000000 0.0000000 0.7736912), wk = 0.0027322 k( 45) = ( 0.0000000 0.0000000 0.7916840), wk = 0.0027322 k( 46) = ( 0.0000000 0.0000000 0.8096769), wk = 0.0027322 k( 47) = ( 0.0000000 0.0000000 0.8276697), wk = 0.0027322 k( 48) = ( 0.0000000 0.0000000 0.8456625), wk = 0.0027322 k( 49) = ( 0.0000000 0.0000000 0.8636553), wk = 0.0027322 k( 50) = ( 0.0000000 0.0000000 0.8816481), wk = 0.0027322 k( 51) = ( 0.0000000 0.0000000 0.8996410), wk = 0.0027322 k( 52) = ( 0.0000000 0.0000000 0.9176338), wk = 0.0027322 k( 53) = ( 0.0000000 0.0000000 0.9356266), wk = 0.0027322 k( 54) = ( 0.0000000 0.0000000 0.9536194), wk = 0.0027322 k( 55) = ( 0.0000000 0.0000000 0.9716122), wk = 0.0027322 k( 56) = ( 0.0000000 0.0000000 0.9896051), wk = 0.0027322 k( 57) = ( 0.0000000 0.0000000 1.0075979), wk = 0.0027322 k( 58) = ( 0.0000000 0.0000000 1.0255907), wk = 0.0027322 k( 59) = ( 0.0000000 0.0000000 1.0255907), wk = 0.0027322 k( 60) = ( -0.0086607 0.0155105 1.0255907), wk = 0.0027322 k( 61) = ( -0.0173213 0.0310209 1.0255907), wk = 0.0027322 k( 62) = ( -0.0259820 0.0465314 1.0255907), wk = 0.0027322 k( 63) = ( -0.0346427 0.0620418 1.0255907), wk = 0.0027322 k( 64) = ( -0.0433034 0.0775523 1.0255907), wk = 0.0027322 k( 65) = ( -0.0519641 0.0930628 1.0255907), wk = 0.0027322 k( 66) = ( -0.0606247 0.1085732 1.0255907), wk = 0.0027322 k( 67) = ( -0.0692854 0.1240837 1.0255907), wk = 0.0027322 k( 68) = ( -0.0779461 0.1395941 1.0255907), wk = 0.0027322 k( 69) = ( -0.0779461 0.1395941 1.0255907), wk = 0.0027322 k( 70) = ( -0.0841528 0.1507097 1.0128597), wk = 0.0027322 k( 71) = ( -0.0903594 0.1618253 1.0001287), wk = 0.0027322 k( 72) = ( -0.0965661 0.1729408 0.9873976), wk = 0.0027322 k( 73) = ( -0.1027728 0.1840564 0.9746666), wk = 0.0027322 k( 74) = ( -0.1089795 0.1951720 0.9619356), wk = 0.0027322 k( 75) = ( -0.1151861 0.2062876 0.9492046), wk = 0.0027322 k( 76) = ( -0.1213928 0.2174031 0.9364736), wk = 0.0027322 k( 77) = ( -0.1275995 0.2285187 0.9237426), wk = 0.0027322 k( 78) = ( -0.1338062 0.2396343 0.9110115), wk = 0.0027322 k( 79) = ( -0.1400128 0.2507499 0.8982805), wk = 0.0027322 k( 80) = ( -0.1462195 0.2618654 0.8855495), wk = 0.0027322 k( 81) = ( -0.1524262 0.2729810 0.8728185), wk = 0.0027322 k( 82) = ( -0.1586329 0.2840966 0.8600875), wk = 0.0027322 k( 83) = ( -0.1648395 0.2952122 0.8473565), wk = 0.0027322 k( 84) = ( -0.1710462 0.3063277 0.8346254), wk = 0.0027322 k( 85) = ( -0.1772529 0.3174433 0.8218944), wk = 0.0027322 k( 86) = ( -0.1834596 0.3285589 0.8091634), wk = 0.0027322 k( 87) = ( -0.1896662 0.3396745 0.7964324), wk = 0.0027322 k( 88) = ( -0.1958729 0.3507900 0.7837014), wk = 0.0027322 k( 89) = ( -0.2020796 0.3619056 0.7709704), wk = 0.0027322 k( 90) = ( -0.2082863 0.3730212 0.7582393), wk = 0.0027322 k( 91) = ( -0.2144929 0.3841367 0.7455083), wk = 0.0027322 k( 92) = ( -0.2206996 0.3952523 0.7327773), wk = 0.0027322 k( 93) = ( -0.2269063 0.4063679 0.7200463), wk = 0.0027322 k( 94) = ( -0.2331130 0.4174835 0.7073153), wk = 0.0027322 k( 95) = ( -0.2393196 0.4285990 0.6945843), wk = 0.0027322 k( 96) = ( -0.2455263 0.4397146 0.6818532), wk = 0.0027322 k( 97) = ( -0.2517330 0.4508302 0.6691222), wk = 0.0027322 k( 98) = ( -0.2579397 0.4619458 0.6563912), wk = 0.0027322 k( 99) = ( -0.2641463 0.4730613 0.6436602), wk = 0.0027322 k( 100) = ( -0.2703530 0.4841769 0.6309292), wk = 0.0027322 k( 101) = ( -0.2765597 0.4952925 0.6181982), wk = 0.0027322 k( 102) = ( -0.2827664 0.5064081 0.6054672), wk = 0.0027322 k( 103) = ( -0.2889730 0.5175236 0.5927361), wk = 0.0027322 k( 104) = ( -0.2889730 0.5175236 0.5927361), wk = 0.0027322 k( 105) = ( -0.2828247 0.5065125 0.5801247), wk = 0.0027322 k( 106) = ( -0.2766763 0.4955013 0.5675133), wk = 0.0027322 k( 107) = ( -0.2705280 0.4844902 0.5549019), wk = 0.0027322 k( 108) = ( -0.2643796 0.4734791 0.5422905), wk = 0.0027322 k( 109) = ( -0.2582312 0.4624679 0.5296791), wk = 0.0027322 k( 110) = ( -0.2520829 0.4514568 0.5170677), wk = 0.0027322 k( 111) = ( -0.2459345 0.4404456 0.5044563), wk = 0.0027322 k( 112) = ( -0.2397861 0.4294345 0.4918449), wk = 0.0027322 k( 113) = ( -0.2336378 0.4184234 0.4792335), wk = 0.0027322 k( 114) = ( -0.2274894 0.4074122 0.4666221), wk = 0.0027322 k( 115) = ( -0.2213411 0.3964011 0.4540106), wk = 0.0027322 k( 116) = ( -0.2151927 0.3853899 0.4413992), wk = 0.0027322 k( 117) = ( -0.2090443 0.3743788 0.4287878), wk = 0.0027322 k( 118) = ( -0.2028960 0.3633677 0.4161764), wk = 0.0027322 k( 119) = ( -0.1967476 0.3523565 0.4035650), wk = 0.0027322 k( 120) = ( -0.1905992 0.3413454 0.3909536), wk = 0.0027322 k( 121) = ( -0.1844509 0.3303342 0.3783422), wk = 0.0027322 k( 122) = ( -0.1783025 0.3193231 0.3657308), wk = 0.0027322 k( 123) = ( -0.1721542 0.3083119 0.3531194), wk = 0.0027322 k( 124) = ( -0.1660058 0.2973008 0.3405080), wk = 0.0027322 k( 125) = ( -0.1598574 0.2862897 0.3278966), wk = 0.0027322 k( 126) = ( -0.1537091 0.2752785 0.3152852), wk = 0.0027322 k( 127) = ( -0.1475607 0.2642674 0.3026738), wk = 0.0027322 k( 128) = ( -0.1414123 0.2532562 0.2900624), wk = 0.0027322 k( 129) = ( -0.1352640 0.2422451 0.2774510), wk = 0.0027322 k( 130) = ( -0.1291156 0.2312340 0.2648395), wk = 0.0027322 k( 131) = ( -0.1229673 0.2202228 0.2522281), wk = 0.0027322 k( 132) = ( -0.1168189 0.2092117 0.2396167), wk = 0.0027322 k( 133) = ( -0.1106705 0.1982005 0.2270053), wk = 0.0027322 k( 134) = ( -0.1045222 0.1871894 0.2143939), wk = 0.0027322 k( 135) = ( -0.0983738 0.1761783 0.2017825), wk = 0.0027322 k( 136) = ( -0.0922254 0.1651671 0.1891711), wk = 0.0027322 k( 137) = ( -0.0860771 0.1541560 0.1765597), wk = 0.0027322 k( 138) = ( -0.0799287 0.1431448 0.1639483), wk = 0.0027322 k( 139) = ( -0.0737803 0.1321337 0.1513369), wk = 0.0027322 k( 140) = ( -0.0676320 0.1211226 0.1387255), wk = 0.0027322 k( 141) = ( -0.0614836 0.1101114 0.1261141), wk = 0.0027322 k( 142) = ( -0.0553353 0.0991003 0.1135027), wk = 0.0027322 k( 143) = ( -0.0491869 0.0880891 0.1008913), wk = 0.0027322 k( 144) = ( -0.0430385 0.0770780 0.0882799), wk = 0.0027322 k( 145) = ( -0.0368902 0.0660669 0.0756685), wk = 0.0027322 k( 146) = ( -0.0307418 0.0550557 0.0630570), wk = 0.0027322 k( 147) = ( -0.0245934 0.0440446 0.0504456), wk = 0.0027322 k( 148) = ( -0.0184451 0.0330334 0.0378342), wk = 0.0027322 k( 149) = ( -0.0122967 0.0220223 0.0252228), wk = 0.0027322 k( 150) = ( -0.0061484 0.0110111 0.0126114), wk = 0.0027322 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 153) = ( 0.0156250 0.0087246 -0.0000000), wk = 0.0027322 k( 154) = ( 0.0312500 0.0174493 -0.0000000), wk = 0.0027322 k( 155) = ( 0.0468750 0.0261739 -0.0000000), wk = 0.0027322 k( 156) = ( 0.0625000 0.0348985 -0.0000000), wk = 0.0027322 k( 157) = ( 0.0781250 0.0436232 -0.0000000), wk = 0.0027322 k( 158) = ( 0.0937500 0.0523478 -0.0000000), wk = 0.0027322 k( 159) = ( 0.1093750 0.0610724 -0.0000000), wk = 0.0027322 k( 160) = ( 0.1250000 0.0697971 -0.0000000), wk = 0.0027322 k( 161) = ( 0.1406250 0.0785217 -0.0000000), wk = 0.0027322 k( 162) = ( 0.1562500 0.0872463 -0.0000000), wk = 0.0027322 k( 163) = ( 0.1718750 0.0959710 -0.0000000), wk = 0.0027322 k( 164) = ( 0.1875000 0.1046956 -0.0000000), wk = 0.0027322 k( 165) = ( 0.2031250 0.1134202 -0.0000000), wk = 0.0027322 k( 166) = ( 0.2187500 0.1221449 -0.0000000), wk = 0.0027322 k( 167) = ( 0.2343750 0.1308695 -0.0000000), wk = 0.0027322 k( 168) = ( 0.2500000 0.1395941 -0.0000000), wk = 0.0027322 k( 169) = ( 0.2656250 0.1483188 -0.0000000), wk = 0.0027322 k( 170) = ( 0.2812500 0.1570434 -0.0000000), wk = 0.0027322 k( 171) = ( 0.2968750 0.1657680 -0.0000000), wk = 0.0027322 k( 172) = ( 0.3125000 0.1744927 -0.0000000), wk = 0.0027322 k( 173) = ( 0.3281250 0.1832173 -0.0000000), wk = 0.0027322 k( 174) = ( 0.3437500 0.1919419 -0.0000000), wk = 0.0027322 k( 175) = ( 0.3593750 0.2006666 -0.0000000), wk = 0.0027322 k( 176) = ( 0.3750000 0.2093912 -0.0000000), wk = 0.0027322 k( 177) = ( 0.3906250 0.2181158 -0.0000000), wk = 0.0027322 k( 178) = ( 0.4062500 0.2268405 -0.0000000), wk = 0.0027322 k( 179) = ( 0.4218750 0.2355651 -0.0000000), wk = 0.0027322 k( 180) = ( 0.4375000 0.2442897 -0.0000000), wk = 0.0027322 k( 181) = ( 0.4531250 0.2530144 -0.0000000), wk = 0.0027322 k( 182) = ( 0.4687500 0.2617390 -0.0000000), wk = 0.0027322 k( 183) = ( 0.4843750 0.2704636 -0.0000000), wk = 0.0027322 k( 184) = ( 0.5000000 0.2791883 -0.0000000), wk = 0.0027322 k( 185) = ( 0.5000000 0.2791883 -0.0000000), wk = 0.0027322 k( 186) = ( 0.4937933 0.2903038 0.0127310), wk = 0.0027322 k( 187) = ( 0.4875867 0.3014194 0.0254620), wk = 0.0027322 k( 188) = ( 0.4813800 0.3125350 0.0381931), wk = 0.0027322 k( 189) = ( 0.4751733 0.3236506 0.0509241), wk = 0.0027322 k( 190) = ( 0.4689666 0.3347661 0.0636551), wk = 0.0027322 k( 191) = ( 0.4627599 0.3458817 0.0763861), wk = 0.0027322 k( 192) = ( 0.4565533 0.3569973 0.0891171), wk = 0.0027322 k( 193) = ( 0.4503466 0.3681128 0.1018481), wk = 0.0027322 k( 194) = ( 0.4441399 0.3792284 0.1145792), wk = 0.0027322 k( 195) = ( 0.4379332 0.3903440 0.1273102), wk = 0.0027322 k( 196) = ( 0.4317266 0.4014596 0.1400412), wk = 0.0027322 k( 197) = ( 0.4255199 0.4125751 0.1527722), wk = 0.0027322 k( 198) = ( 0.4193132 0.4236907 0.1655032), wk = 0.0027322 k( 199) = ( 0.4131066 0.4348063 0.1782342), wk = 0.0027322 k( 200) = ( 0.4068999 0.4459219 0.1909653), wk = 0.0027322 k( 201) = ( 0.4006932 0.4570374 0.2036963), wk = 0.0027322 k( 202) = ( 0.3944865 0.4681530 0.2164273), wk = 0.0027322 k( 203) = ( 0.3882798 0.4792686 0.2291583), wk = 0.0027322 k( 204) = ( 0.3820732 0.4903842 0.2418893), wk = 0.0027322 k( 205) = ( 0.3758665 0.5014997 0.2546203), wk = 0.0027322 k( 206) = ( 0.3696598 0.5126153 0.2673514), wk = 0.0027322 k( 207) = ( 0.3634532 0.5237309 0.2800824), wk = 0.0027322 k( 208) = ( 0.3572465 0.5348464 0.2928134), wk = 0.0027322 k( 209) = ( 0.3510398 0.5459620 0.3055444), wk = 0.0027322 k( 210) = ( 0.3448331 0.5570776 0.3182754), wk = 0.0027322 k( 211) = ( 0.3386264 0.5681932 0.3310064), wk = 0.0027322 k( 212) = ( 0.3324198 0.5793087 0.3437375), wk = 0.0027322 k( 213) = ( 0.3262131 0.5904243 0.3564685), wk = 0.0027322 k( 214) = ( 0.3200064 0.6015399 0.3691995), wk = 0.0027322 k( 215) = ( 0.3137997 0.6126555 0.3819305), wk = 0.0027322 k( 216) = ( 0.3075931 0.6237710 0.3946615), wk = 0.0027322 k( 217) = ( 0.3013864 0.6348866 0.4073925), wk = 0.0027322 k( 218) = ( 0.2951797 0.6460022 0.4201235), wk = 0.0027322 k( 219) = ( 0.2889730 0.6571178 0.4328546), wk = 0.0027322 k( 220) = ( 0.2889730 0.6571178 0.4328546), wk = 0.0027322 k( 221) = ( 0.2729190 0.6532401 0.4372957), wk = 0.0027322 k( 222) = ( 0.2568649 0.6493625 0.4417369), wk = 0.0027322 k( 223) = ( 0.2408109 0.6454849 0.4461780), wk = 0.0027322 k( 224) = ( 0.2247568 0.6416073 0.4506192), wk = 0.0027322 k( 225) = ( 0.2087027 0.6377297 0.4550603), wk = 0.0027322 k( 226) = ( 0.1926487 0.6338521 0.4595015), wk = 0.0027322 k( 227) = ( 0.1765946 0.6299745 0.4639426), wk = 0.0027322 k( 228) = ( 0.1605406 0.6260968 0.4683838), wk = 0.0027322 k( 229) = ( 0.1444865 0.6222192 0.4728250), wk = 0.0027322 k( 230) = ( 0.1284325 0.6183416 0.4772661), wk = 0.0027322 k( 231) = ( 0.1123784 0.6144640 0.4817073), wk = 0.0027322 k( 232) = ( 0.0963244 0.6105864 0.4861484), wk = 0.0027322 k( 233) = ( 0.0802703 0.6067088 0.4905896), wk = 0.0027322 k( 234) = ( 0.0642162 0.6028312 0.4950307), wk = 0.0027322 k( 235) = ( 0.0481622 0.5989535 0.4994719), wk = 0.0027322 k( 236) = ( 0.0321081 0.5950759 0.5039130), wk = 0.0027322 k( 237) = ( 0.0160541 0.5911983 0.5083542), wk = 0.0027322 k( 238) = ( 0.0000000 0.5873207 0.5127953), wk = 0.0027322 k( 239) = ( 0.0000000 0.5873207 0.5127953), wk = 0.0027322 k( 240) = ( 0.0060976 0.5764005 0.5253026), wk = 0.0027322 k( 241) = ( 0.0121951 0.5654804 0.5378098), wk = 0.0027322 k( 242) = ( 0.0182927 0.5545602 0.5503170), wk = 0.0027322 k( 243) = ( 0.0243902 0.5436401 0.5628242), wk = 0.0027322 k( 244) = ( 0.0304878 0.5327199 0.5753314), wk = 0.0027322 k( 245) = ( 0.0365854 0.5217997 0.5878386), wk = 0.0027322 k( 246) = ( 0.0426829 0.5108796 0.6003458), wk = 0.0027322 k( 247) = ( 0.0487805 0.4999594 0.6128530), wk = 0.0027322 k( 248) = ( 0.0548780 0.4890392 0.6253602), wk = 0.0027322 k( 249) = ( 0.0609756 0.4781191 0.6378674), wk = 0.0027322 k( 250) = ( 0.0670732 0.4671989 0.6503746), wk = 0.0027322 k( 251) = ( 0.0731707 0.4562788 0.6628818), wk = 0.0027322 k( 252) = ( 0.0792683 0.4453586 0.6753890), wk = 0.0027322 k( 253) = ( 0.0853658 0.4344385 0.6878962), wk = 0.0027322 k( 254) = ( 0.0914634 0.4235183 0.7004034), wk = 0.0027322 k( 255) = ( 0.0975610 0.4125981 0.7129106), wk = 0.0027322 k( 256) = ( 0.1036585 0.4016780 0.7254178), wk = 0.0027322 k( 257) = ( 0.1097561 0.3907578 0.7379250), wk = 0.0027322 k( 258) = ( 0.1158537 0.3798376 0.7504322), wk = 0.0027322 k( 259) = ( 0.1219512 0.3689175 0.7629394), wk = 0.0027322 k( 260) = ( 0.1280488 0.3579973 0.7754466), wk = 0.0027322 k( 261) = ( 0.1341463 0.3470772 0.7879538), wk = 0.0027322 k( 262) = ( 0.1402439 0.3361570 0.8004610), wk = 0.0027322 k( 263) = ( 0.1463415 0.3252369 0.8129682), wk = 0.0027322 k( 264) = ( 0.1524390 0.3143167 0.8254754), wk = 0.0027322 k( 265) = ( 0.1585366 0.3033965 0.8379827), wk = 0.0027322 k( 266) = ( 0.1646342 0.2924764 0.8504899), wk = 0.0027322 k( 267) = ( 0.1707317 0.2815562 0.8629971), wk = 0.0027322 k( 268) = ( 0.1768293 0.2706360 0.8755043), wk = 0.0027322 k( 269) = ( 0.1829268 0.2597159 0.8880115), wk = 0.0027322 k( 270) = ( 0.1890244 0.2487957 0.9005187), wk = 0.0027322 k( 271) = ( 0.1951219 0.2378756 0.9130259), wk = 0.0027322 k( 272) = ( 0.2012195 0.2269554 0.9255331), wk = 0.0027322 k( 273) = ( 0.2073171 0.2160353 0.9380403), wk = 0.0027322 k( 274) = ( 0.2134146 0.2051151 0.9505475), wk = 0.0027322 k( 275) = ( 0.2195122 0.1941949 0.9630547), wk = 0.0027322 k( 276) = ( 0.2256098 0.1832748 0.9755619), wk = 0.0027322 k( 277) = ( 0.2317073 0.1723546 0.9880691), wk = 0.0027322 k( 278) = ( 0.2378049 0.1614344 1.0005763), wk = 0.0027322 k( 279) = ( 0.2439024 0.1505143 1.0130835), wk = 0.0027322 k( 280) = ( 0.2500000 0.1395941 1.0255907), wk = 0.0027322 k( 281) = ( 0.2500000 0.1395941 1.0255907), wk = 0.0027322 k( 282) = ( 0.2631579 0.1469412 1.0171759), wk = 0.0027322 k( 283) = ( 0.2763158 0.1542883 1.0087611), wk = 0.0027322 k( 284) = ( 0.2894737 0.1616353 1.0003462), wk = 0.0027322 k( 285) = ( 0.3026316 0.1689824 0.9919314), wk = 0.0027322 k( 286) = ( 0.3157895 0.1763294 0.9835166), wk = 0.0027322 k( 287) = ( 0.3289474 0.1836765 0.9751018), wk = 0.0027322 k( 288) = ( 0.3421053 0.1910235 0.9666870), wk = 0.0027322 k( 289) = ( 0.3552632 0.1983706 0.9582722), wk = 0.0027322 k( 290) = ( 0.3684211 0.2057177 0.9498573), wk = 0.0027322 k( 291) = ( 0.3815789 0.2130647 0.9414425), wk = 0.0027322 k( 292) = ( 0.3947368 0.2204118 0.9330277), wk = 0.0027322 k( 293) = ( 0.4078947 0.2277588 0.9246129), wk = 0.0027322 k( 294) = ( 0.4210526 0.2351059 0.9161981), wk = 0.0027322 k( 295) = ( 0.4342105 0.2424530 0.9077832), wk = 0.0027322 k( 296) = ( 0.4473684 0.2498000 0.8993684), wk = 0.0027322 k( 297) = ( 0.4605263 0.2571471 0.8909536), wk = 0.0027322 k( 298) = ( 0.4736842 0.2644941 0.8825388), wk = 0.0027322 k( 299) = ( 0.4868421 0.2718412 0.8741240), wk = 0.0027322 k( 300) = ( 0.5000000 0.2791883 0.8657091), wk = 0.0027322 k( 301) = ( 0.5000000 0.2791883 0.8657091), wk = 0.0027322 k( 302) = ( 0.5000000 0.2791883 0.8476735), wk = 0.0027322 k( 303) = ( 0.5000000 0.2791883 0.8296379), wk = 0.0027322 k( 304) = ( 0.5000000 0.2791883 0.8116023), wk = 0.0027322 k( 305) = ( 0.5000000 0.2791883 0.7935667), wk = 0.0027322 k( 306) = ( 0.5000000 0.2791883 0.7755311), wk = 0.0027322 k( 307) = ( 0.5000000 0.2791883 0.7574955), wk = 0.0027322 k( 308) = ( 0.5000000 0.2791883 0.7394599), wk = 0.0027322 k( 309) = ( 0.5000000 0.2791883 0.7214243), wk = 0.0027322 k( 310) = ( 0.5000000 0.2791883 0.7033887), wk = 0.0027322 k( 311) = ( 0.5000000 0.2791883 0.6853531), wk = 0.0027322 k( 312) = ( 0.5000000 0.2791883 0.6673175), wk = 0.0027322 k( 313) = ( 0.5000000 0.2791883 0.6492819), wk = 0.0027322 k( 314) = ( 0.5000000 0.2791883 0.6312463), wk = 0.0027322 k( 315) = ( 0.5000000 0.2791883 0.6132106), wk = 0.0027322 k( 316) = ( 0.5000000 0.2791883 0.5951750), wk = 0.0027322 k( 317) = ( 0.5000000 0.2791883 0.5771394), wk = 0.0027322 k( 318) = ( 0.5000000 0.2791883 0.5591038), wk = 0.0027322 k( 319) = ( 0.5000000 0.2791883 0.5410682), wk = 0.0027322 k( 320) = ( 0.5000000 0.2791883 0.5230326), wk = 0.0027322 k( 321) = ( 0.5000000 0.2791883 0.5049970), wk = 0.0027322 k( 322) = ( 0.5000000 0.2791883 0.4869614), wk = 0.0027322 k( 323) = ( 0.5000000 0.2791883 0.4689258), wk = 0.0027322 k( 324) = ( 0.5000000 0.2791883 0.4508902), wk = 0.0027322 k( 325) = ( 0.5000000 0.2791883 0.4328546), wk = 0.0027322 k( 326) = ( 0.5000000 0.2791883 0.4148190), wk = 0.0027322 k( 327) = ( 0.5000000 0.2791883 0.3967834), wk = 0.0027322 k( 328) = ( 0.5000000 0.2791883 0.3787478), wk = 0.0027322 k( 329) = ( 0.5000000 0.2791883 0.3607121), wk = 0.0027322 k( 330) = ( 0.5000000 0.2791883 0.3426765), wk = 0.0027322 k( 331) = ( 0.5000000 0.2791883 0.3246409), wk = 0.0027322 k( 332) = ( 0.5000000 0.2791883 0.3066053), wk = 0.0027322 k( 333) = ( 0.5000000 0.2791883 0.2885697), wk = 0.0027322 k( 334) = ( 0.5000000 0.2791883 0.2705341), wk = 0.0027322 k( 335) = ( 0.5000000 0.2791883 0.2524985), wk = 0.0027322 k( 336) = ( 0.5000000 0.2791883 0.2344629), wk = 0.0027322 k( 337) = ( 0.5000000 0.2791883 0.2164273), wk = 0.0027322 k( 338) = ( 0.5000000 0.2791883 0.1983917), wk = 0.0027322 k( 339) = ( 0.5000000 0.2791883 0.1803561), wk = 0.0027322 k( 340) = ( 0.5000000 0.2791883 0.1623205), wk = 0.0027322 k( 341) = ( 0.5000000 0.2791883 0.1442849), wk = 0.0027322 k( 342) = ( 0.5000000 0.2791883 0.1262493), wk = 0.0027322 k( 343) = ( 0.5000000 0.2791883 0.1082136), wk = 0.0027322 k( 344) = ( 0.5000000 0.2791883 0.0901780), wk = 0.0027322 k( 345) = ( 0.5000000 0.2791883 0.0721424), wk = 0.0027322 k( 346) = ( 0.5000000 0.2791883 0.0541068), wk = 0.0027322 k( 347) = ( 0.5000000 0.2791883 0.0360712), wk = 0.0027322 k( 348) = ( 0.5000000 0.2791883 0.0180356), wk = 0.0027322 k( 349) = ( 0.5000000 0.2791883 -0.0000000), wk = 0.0027322 k( 350) = ( 0.0000000 0.0000000 1.0255907), wk = 0.0027322 k( 351) = ( 0.0156250 0.0087246 1.0255907), wk = 0.0027322 k( 352) = ( 0.0312500 0.0174493 1.0255907), wk = 0.0027322 k( 353) = ( 0.0468750 0.0261739 1.0255907), wk = 0.0027322 k( 354) = ( 0.0625000 0.0348985 1.0255907), wk = 0.0027322 k( 355) = ( 0.0781250 0.0436232 1.0255907), wk = 0.0027322 k( 356) = ( 0.0937500 0.0523478 1.0255907), wk = 0.0027322 k( 357) = ( 0.1093750 0.0610724 1.0255907), wk = 0.0027322 k( 358) = ( 0.1250000 0.0697971 1.0255907), wk = 0.0027322 k( 359) = ( 0.1406250 0.0785217 1.0255907), wk = 0.0027322 k( 360) = ( 0.1562500 0.0872463 1.0255907), wk = 0.0027322 k( 361) = ( 0.1718750 0.0959710 1.0255907), wk = 0.0027322 k( 362) = ( 0.1875000 0.1046956 1.0255907), wk = 0.0027322 k( 363) = ( 0.2031250 0.1134202 1.0255907), wk = 0.0027322 k( 364) = ( 0.2187500 0.1221449 1.0255907), wk = 0.0027322 k( 365) = ( 0.2343750 0.1308695 1.0255907), wk = 0.0027322 k( 366) = ( 0.2500000 0.1395941 1.0255907), wk = 0.0027322 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 2) = ( 0.0000000 0.0000000 0.0087719), wk = 0.0027322 k( 3) = ( 0.0000000 0.0000000 0.0175439), wk = 0.0027322 k( 4) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0027322 k( 5) = ( 0.0000000 0.0000000 0.0350877), wk = 0.0027322 k( 6) = ( 0.0000000 0.0000000 0.0438597), wk = 0.0027322 k( 7) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0027322 k( 8) = ( 0.0000000 0.0000000 0.0614035), wk = 0.0027322 k( 9) = ( 0.0000000 0.0000000 0.0701754), wk = 0.0027322 k( 10) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0027322 k( 11) = ( 0.0000000 0.0000000 0.0877193), wk = 0.0027322 k( 12) = ( 0.0000000 0.0000000 0.0964912), wk = 0.0027322 k( 13) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0027322 k( 14) = ( 0.0000000 0.0000000 0.1140351), wk = 0.0027322 k( 15) = ( 0.0000000 0.0000000 0.1228070), wk = 0.0027322 k( 16) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0027322 k( 17) = ( 0.0000000 0.0000000 0.1403509), wk = 0.0027322 k( 18) = ( 0.0000000 0.0000000 0.1491228), wk = 0.0027322 k( 19) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0027322 k( 20) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0027322 k( 21) = ( 0.0000000 0.0000000 0.1754386), wk = 0.0027322 k( 22) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0027322 k( 23) = ( 0.0000000 0.0000000 0.1929825), wk = 0.0027322 k( 24) = ( 0.0000000 0.0000000 0.2017544), wk = 0.0027322 k( 25) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0027322 k( 26) = ( 0.0000000 0.0000000 0.2192983), wk = 0.0027322 k( 27) = ( 0.0000000 0.0000000 0.2280702), wk = 0.0027322 k( 28) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0027322 k( 29) = ( 0.0000000 0.0000000 0.2456140), wk = 0.0027322 k( 30) = ( 0.0000000 0.0000000 0.2543860), wk = 0.0027322 k( 31) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0027322 k( 32) = ( 0.0000000 0.0000000 0.2719298), wk = 0.0027322 k( 33) = ( 0.0000000 0.0000000 0.2807018), wk = 0.0027322 k( 34) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0027322 k( 35) = ( 0.0000000 0.0000000 0.2982456), wk = 0.0027322 k( 36) = ( 0.0000000 0.0000000 0.3070175), wk = 0.0027322 k( 37) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0027322 k( 38) = ( 0.0000000 0.0000000 0.3245614), wk = 0.0027322 k( 39) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0027322 k( 40) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0027322 k( 41) = ( 0.0000000 0.0000000 0.3508772), wk = 0.0027322 k( 42) = ( 0.0000000 0.0000000 0.3596491), wk = 0.0027322 k( 43) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0027322 k( 44) = ( 0.0000000 0.0000000 0.3771930), wk = 0.0027322 k( 45) = ( 0.0000000 0.0000000 0.3859649), wk = 0.0027322 k( 46) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0027322 k( 47) = ( 0.0000000 0.0000000 0.4035088), wk = 0.0027322 k( 48) = ( 0.0000000 0.0000000 0.4122807), wk = 0.0027322 k( 49) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0027322 k( 50) = ( 0.0000000 0.0000000 0.4298246), wk = 0.0027322 k( 51) = ( 0.0000000 0.0000000 0.4385965), wk = 0.0027322 k( 52) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0027322 k( 53) = ( 0.0000000 0.0000000 0.4561404), wk = 0.0027322 k( 54) = ( 0.0000000 0.0000000 0.4649123), wk = 0.0027322 k( 55) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0027322 k( 56) = ( 0.0000000 0.0000000 0.4824561), wk = 0.0027322 k( 57) = ( 0.0000000 0.0000000 0.4912281), wk = 0.0027322 k( 58) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027322 k( 59) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027322 k( 60) = ( -0.0086607 0.0086607 0.5000000), wk = 0.0027322 k( 61) = ( -0.0173213 0.0173214 0.5000000), wk = 0.0027322 k( 62) = ( -0.0259820 0.0259820 0.5000000), wk = 0.0027322 k( 63) = ( -0.0346427 0.0346427 0.5000000), wk = 0.0027322 k( 64) = ( -0.0433034 0.0433034 0.5000000), wk = 0.0027322 k( 65) = ( -0.0519641 0.0519641 0.5000000), wk = 0.0027322 k( 66) = ( -0.0606247 0.0606247 0.5000000), wk = 0.0027322 k( 67) = ( -0.0692854 0.0692854 0.5000000), wk = 0.0027322 k( 68) = ( -0.0779461 0.0779461 0.5000000), wk = 0.0027322 k( 69) = ( -0.0779461 0.0779461 0.5000000), wk = 0.0027322 k( 70) = ( -0.0841528 0.0841528 0.4937933), wk = 0.0027322 k( 71) = ( -0.0903594 0.0903594 0.4875867), wk = 0.0027322 k( 72) = ( -0.0965661 0.0965661 0.4813800), wk = 0.0027322 k( 73) = ( -0.1027728 0.1027728 0.4751733), wk = 0.0027322 k( 74) = ( -0.1089795 0.1089795 0.4689666), wk = 0.0027322 k( 75) = ( -0.1151861 0.1151861 0.4627599), wk = 0.0027322 k( 76) = ( -0.1213928 0.1213928 0.4565533), wk = 0.0027322 k( 77) = ( -0.1275995 0.1275995 0.4503466), wk = 0.0027322 k( 78) = ( -0.1338062 0.1338062 0.4441399), wk = 0.0027322 k( 79) = ( -0.1400128 0.1400128 0.4379332), wk = 0.0027322 k( 80) = ( -0.1462195 0.1462195 0.4317266), wk = 0.0027322 k( 81) = ( -0.1524262 0.1524262 0.4255199), wk = 0.0027322 k( 82) = ( -0.1586329 0.1586329 0.4193132), wk = 0.0027322 k( 83) = ( -0.1648395 0.1648395 0.4131066), wk = 0.0027322 k( 84) = ( -0.1710462 0.1710462 0.4068999), wk = 0.0027322 k( 85) = ( -0.1772529 0.1772529 0.4006932), wk = 0.0027322 k( 86) = ( -0.1834596 0.1834596 0.3944865), wk = 0.0027322 k( 87) = ( -0.1896662 0.1896662 0.3882799), wk = 0.0027322 k( 88) = ( -0.1958729 0.1958729 0.3820732), wk = 0.0027322 k( 89) = ( -0.2020796 0.2020796 0.3758665), wk = 0.0027322 k( 90) = ( -0.2082863 0.2082863 0.3696598), wk = 0.0027322 k( 91) = ( -0.2144929 0.2144929 0.3634532), wk = 0.0027322 k( 92) = ( -0.2206996 0.2206996 0.3572465), wk = 0.0027322 k( 93) = ( -0.2269063 0.2269063 0.3510398), wk = 0.0027322 k( 94) = ( -0.2331130 0.2331130 0.3448331), wk = 0.0027322 k( 95) = ( -0.2393196 0.2393196 0.3386264), wk = 0.0027322 k( 96) = ( -0.2455263 0.2455263 0.3324198), wk = 0.0027322 k( 97) = ( -0.2517330 0.2517330 0.3262131), wk = 0.0027322 k( 98) = ( -0.2579397 0.2579397 0.3200064), wk = 0.0027322 k( 99) = ( -0.2641463 0.2641463 0.3137997), wk = 0.0027322 k( 100) = ( -0.2703530 0.2703530 0.3075931), wk = 0.0027322 k( 101) = ( -0.2765597 0.2765597 0.3013864), wk = 0.0027322 k( 102) = ( -0.2827664 0.2827664 0.2951797), wk = 0.0027322 k( 103) = ( -0.2889730 0.2889730 0.2889730), wk = 0.0027322 k( 104) = ( -0.2889730 0.2889730 0.2889730), wk = 0.0027322 k( 105) = ( -0.2828247 0.2828247 0.2828247), wk = 0.0027322 k( 106) = ( -0.2766763 0.2766763 0.2766763), wk = 0.0027322 k( 107) = ( -0.2705280 0.2705280 0.2705280), wk = 0.0027322 k( 108) = ( -0.2643796 0.2643796 0.2643796), wk = 0.0027322 k( 109) = ( -0.2582312 0.2582312 0.2582312), wk = 0.0027322 k( 110) = ( -0.2520829 0.2520829 0.2520829), wk = 0.0027322 k( 111) = ( -0.2459345 0.2459345 0.2459345), wk = 0.0027322 k( 112) = ( -0.2397861 0.2397861 0.2397861), wk = 0.0027322 k( 113) = ( -0.2336378 0.2336378 0.2336378), wk = 0.0027322 k( 114) = ( -0.2274894 0.2274894 0.2274894), wk = 0.0027322 k( 115) = ( -0.2213411 0.2213411 0.2213411), wk = 0.0027322 k( 116) = ( -0.2151927 0.2151927 0.2151927), wk = 0.0027322 k( 117) = ( -0.2090443 0.2090443 0.2090443), wk = 0.0027322 k( 118) = ( -0.2028960 0.2028960 0.2028960), wk = 0.0027322 k( 119) = ( -0.1967476 0.1967476 0.1967476), wk = 0.0027322 k( 120) = ( -0.1905992 0.1905992 0.1905992), wk = 0.0027322 k( 121) = ( -0.1844509 0.1844509 0.1844509), wk = 0.0027322 k( 122) = ( -0.1783025 0.1783025 0.1783025), wk = 0.0027322 k( 123) = ( -0.1721542 0.1721542 0.1721542), wk = 0.0027322 k( 124) = ( -0.1660058 0.1660058 0.1660058), wk = 0.0027322 k( 125) = ( -0.1598574 0.1598574 0.1598574), wk = 0.0027322 k( 126) = ( -0.1537091 0.1537091 0.1537091), wk = 0.0027322 k( 127) = ( -0.1475607 0.1475607 0.1475607), wk = 0.0027322 k( 128) = ( -0.1414123 0.1414123 0.1414123), wk = 0.0027322 k( 129) = ( -0.1352640 0.1352640 0.1352640), wk = 0.0027322 k( 130) = ( -0.1291156 0.1291156 0.1291156), wk = 0.0027322 k( 131) = ( -0.1229673 0.1229673 0.1229673), wk = 0.0027322 k( 132) = ( -0.1168189 0.1168189 0.1168189), wk = 0.0027322 k( 133) = ( -0.1106705 0.1106705 0.1106705), wk = 0.0027322 k( 134) = ( -0.1045222 0.1045222 0.1045222), wk = 0.0027322 k( 135) = ( -0.0983738 0.0983738 0.0983738), wk = 0.0027322 k( 136) = ( -0.0922254 0.0922254 0.0922254), wk = 0.0027322 k( 137) = ( -0.0860771 0.0860771 0.0860771), wk = 0.0027322 k( 138) = ( -0.0799287 0.0799287 0.0799287), wk = 0.0027322 k( 139) = ( -0.0737803 0.0737803 0.0737804), wk = 0.0027322 k( 140) = ( -0.0676320 0.0676320 0.0676320), wk = 0.0027322 k( 141) = ( -0.0614836 0.0614836 0.0614836), wk = 0.0027322 k( 142) = ( -0.0553353 0.0553353 0.0553353), wk = 0.0027322 k( 143) = ( -0.0491869 0.0491869 0.0491869), wk = 0.0027322 k( 144) = ( -0.0430385 0.0430385 0.0430385), wk = 0.0027322 k( 145) = ( -0.0368902 0.0368902 0.0368902), wk = 0.0027322 k( 146) = ( -0.0307418 0.0307418 0.0307418), wk = 0.0027322 k( 147) = ( -0.0245934 0.0245935 0.0245934), wk = 0.0027322 k( 148) = ( -0.0184451 0.0184451 0.0184451), wk = 0.0027322 k( 149) = ( -0.0122967 0.0122967 0.0122967), wk = 0.0027322 k( 150) = ( -0.0061484 0.0061484 0.0061484), wk = 0.0027322 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027322 k( 153) = ( 0.0156250 0.0156250 -0.0156250), wk = 0.0027322 k( 154) = ( 0.0312500 0.0312500 -0.0312500), wk = 0.0027322 k( 155) = ( 0.0468750 0.0468750 -0.0468750), wk = 0.0027322 k( 156) = ( 0.0625000 0.0625000 -0.0625000), wk = 0.0027322 k( 157) = ( 0.0781250 0.0781250 -0.0781250), wk = 0.0027322 k( 158) = ( 0.0937500 0.0937500 -0.0937500), wk = 0.0027322 k( 159) = ( 0.1093750 0.1093750 -0.1093750), wk = 0.0027322 k( 160) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0027322 k( 161) = ( 0.1406250 0.1406250 -0.1406250), wk = 0.0027322 k( 162) = ( 0.1562500 0.1562500 -0.1562500), wk = 0.0027322 k( 163) = ( 0.1718750 0.1718750 -0.1718750), wk = 0.0027322 k( 164) = ( 0.1875000 0.1875000 -0.1875000), wk = 0.0027322 k( 165) = ( 0.2031250 0.2031250 -0.2031250), wk = 0.0027322 k( 166) = ( 0.2187500 0.2187500 -0.2187500), wk = 0.0027322 k( 167) = ( 0.2343750 0.2343750 -0.2343750), wk = 0.0027322 k( 168) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0027322 k( 169) = ( 0.2656250 0.2656250 -0.2656250), wk = 0.0027322 k( 170) = ( 0.2812500 0.2812500 -0.2812500), wk = 0.0027322 k( 171) = ( 0.2968750 0.2968750 -0.2968750), wk = 0.0027322 k( 172) = ( 0.3125000 0.3125000 -0.3125000), wk = 0.0027322 k( 173) = ( 0.3281250 0.3281250 -0.3281250), wk = 0.0027322 k( 174) = ( 0.3437500 0.3437500 -0.3437500), wk = 0.0027322 k( 175) = ( 0.3593750 0.3593750 -0.3593750), wk = 0.0027322 k( 176) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0027322 k( 177) = ( 0.3906250 0.3906250 -0.3906250), wk = 0.0027322 k( 178) = ( 0.4062500 0.4062500 -0.4062500), wk = 0.0027322 k( 179) = ( 0.4218750 0.4218750 -0.4218750), wk = 0.0027322 k( 180) = ( 0.4375000 0.4375000 -0.4375000), wk = 0.0027322 k( 181) = ( 0.4531250 0.4531250 -0.4531250), wk = 0.0027322 k( 182) = ( 0.4687500 0.4687500 -0.4687500), wk = 0.0027322 k( 183) = ( 0.4843750 0.4843750 -0.4843750), wk = 0.0027322 k( 184) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0027322 k( 185) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0027322 k( 186) = ( 0.4937933 0.5062067 -0.4937933), wk = 0.0027322 k( 187) = ( 0.4875867 0.5124133 -0.4875867), wk = 0.0027322 k( 188) = ( 0.4813800 0.5186200 -0.4813800), wk = 0.0027322 k( 189) = ( 0.4751733 0.5248267 -0.4751733), wk = 0.0027322 k( 190) = ( 0.4689666 0.5310334 -0.4689666), wk = 0.0027322 k( 191) = ( 0.4627599 0.5372400 -0.4627600), wk = 0.0027322 k( 192) = ( 0.4565533 0.5434467 -0.4565533), wk = 0.0027322 k( 193) = ( 0.4503466 0.5496534 -0.4503466), wk = 0.0027322 k( 194) = ( 0.4441399 0.5558601 -0.4441399), wk = 0.0027322 k( 195) = ( 0.4379332 0.5620667 -0.4379333), wk = 0.0027322 k( 196) = ( 0.4317266 0.5682734 -0.4317266), wk = 0.0027322 k( 197) = ( 0.4255199 0.5744801 -0.4255199), wk = 0.0027322 k( 198) = ( 0.4193132 0.5806868 -0.4193132), wk = 0.0027322 k( 199) = ( 0.4131066 0.5868935 -0.4131066), wk = 0.0027322 k( 200) = ( 0.4068999 0.5931001 -0.4068999), wk = 0.0027322 k( 201) = ( 0.4006932 0.5993068 -0.4006932), wk = 0.0027322 k( 202) = ( 0.3944865 0.6055135 -0.3944865), wk = 0.0027322 k( 203) = ( 0.3882798 0.6117202 -0.3882799), wk = 0.0027322 k( 204) = ( 0.3820732 0.6179268 -0.3820732), wk = 0.0027322 k( 205) = ( 0.3758665 0.6241335 -0.3758665), wk = 0.0027322 k( 206) = ( 0.3696598 0.6303402 -0.3696598), wk = 0.0027322 k( 207) = ( 0.3634532 0.6365468 -0.3634532), wk = 0.0027322 k( 208) = ( 0.3572465 0.6427535 -0.3572465), wk = 0.0027322 k( 209) = ( 0.3510398 0.6489602 -0.3510398), wk = 0.0027322 k( 210) = ( 0.3448331 0.6551669 -0.3448331), wk = 0.0027322 k( 211) = ( 0.3386264 0.6613736 -0.3386264), wk = 0.0027322 k( 212) = ( 0.3324198 0.6675802 -0.3324198), wk = 0.0027322 k( 213) = ( 0.3262131 0.6737869 -0.3262131), wk = 0.0027322 k( 214) = ( 0.3200064 0.6799936 -0.3200064), wk = 0.0027322 k( 215) = ( 0.3137997 0.6862003 -0.3137997), wk = 0.0027322 k( 216) = ( 0.3075931 0.6924069 -0.3075931), wk = 0.0027322 k( 217) = ( 0.3013864 0.6986136 -0.3013864), wk = 0.0027322 k( 218) = ( 0.2951797 0.7048203 -0.2951797), wk = 0.0027322 k( 219) = ( 0.2889730 0.7110270 -0.2889730), wk = 0.0027322 k( 220) = ( 0.2889730 0.7110270 -0.2889730), wk = 0.0027322 k( 221) = ( 0.2729190 0.6993032 -0.2729190), wk = 0.0027322 k( 222) = ( 0.2568649 0.6875795 -0.2568649), wk = 0.0027322 k( 223) = ( 0.2408109 0.6758558 -0.2408109), wk = 0.0027322 k( 224) = ( 0.2247568 0.6641321 -0.2247568), wk = 0.0027322 k( 225) = ( 0.2087027 0.6524084 -0.2087028), wk = 0.0027322 k( 226) = ( 0.1926487 0.6406846 -0.1926487), wk = 0.0027322 k( 227) = ( 0.1765946 0.6289609 -0.1765946), wk = 0.0027322 k( 228) = ( 0.1605406 0.6172372 -0.1605406), wk = 0.0027322 k( 229) = ( 0.1444865 0.6055135 -0.1444865), wk = 0.0027322 k( 230) = ( 0.1284325 0.5937898 -0.1284325), wk = 0.0027322 k( 231) = ( 0.1123784 0.5820660 -0.1123784), wk = 0.0027322 k( 232) = ( 0.0963244 0.5703423 -0.0963244), wk = 0.0027322 k( 233) = ( 0.0802703 0.5586186 -0.0802703), wk = 0.0027322 k( 234) = ( 0.0642162 0.5468949 -0.0642162), wk = 0.0027322 k( 235) = ( 0.0481622 0.5351712 -0.0481622), wk = 0.0027322 k( 236) = ( 0.0321081 0.5234474 -0.0321081), wk = 0.0027322 k( 237) = ( 0.0160541 0.5117237 -0.0160541), wk = 0.0027322 k( 238) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027322 k( 239) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027322 k( 240) = ( 0.0060976 0.4939024 0.0060976), wk = 0.0027322 k( 241) = ( 0.0121951 0.4878049 0.0121951), wk = 0.0027322 k( 242) = ( 0.0182927 0.4817073 0.0182927), wk = 0.0027322 k( 243) = ( 0.0243902 0.4756098 0.0243902), wk = 0.0027322 k( 244) = ( 0.0304878 0.4695122 0.0304878), wk = 0.0027322 k( 245) = ( 0.0365854 0.4634146 0.0365854), wk = 0.0027322 k( 246) = ( 0.0426829 0.4573171 0.0426829), wk = 0.0027322 k( 247) = ( 0.0487805 0.4512195 0.0487805), wk = 0.0027322 k( 248) = ( 0.0548780 0.4451219 0.0548781), wk = 0.0027322 k( 249) = ( 0.0609756 0.4390244 0.0609756), wk = 0.0027322 k( 250) = ( 0.0670732 0.4329268 0.0670732), wk = 0.0027322 k( 251) = ( 0.0731707 0.4268293 0.0731707), wk = 0.0027322 k( 252) = ( 0.0792683 0.4207317 0.0792683), wk = 0.0027322 k( 253) = ( 0.0853658 0.4146341 0.0853659), wk = 0.0027322 k( 254) = ( 0.0914634 0.4085366 0.0914634), wk = 0.0027322 k( 255) = ( 0.0975610 0.4024390 0.0975610), wk = 0.0027322 k( 256) = ( 0.1036585 0.3963415 0.1036585), wk = 0.0027322 k( 257) = ( 0.1097561 0.3902439 0.1097561), wk = 0.0027322 k( 258) = ( 0.1158537 0.3841463 0.1158537), wk = 0.0027322 k( 259) = ( 0.1219512 0.3780488 0.1219512), wk = 0.0027322 k( 260) = ( 0.1280488 0.3719512 0.1280488), wk = 0.0027322 k( 261) = ( 0.1341463 0.3658537 0.1341463), wk = 0.0027322 k( 262) = ( 0.1402439 0.3597561 0.1402439), wk = 0.0027322 k( 263) = ( 0.1463415 0.3536585 0.1463415), wk = 0.0027322 k( 264) = ( 0.1524390 0.3475610 0.1524390), wk = 0.0027322 k( 265) = ( 0.1585366 0.3414634 0.1585366), wk = 0.0027322 k( 266) = ( 0.1646342 0.3353659 0.1646341), wk = 0.0027322 k( 267) = ( 0.1707317 0.3292683 0.1707317), wk = 0.0027322 k( 268) = ( 0.1768293 0.3231707 0.1768293), wk = 0.0027322 k( 269) = ( 0.1829268 0.3170732 0.1829268), wk = 0.0027322 k( 270) = ( 0.1890244 0.3109756 0.1890244), wk = 0.0027322 k( 271) = ( 0.1951219 0.3048781 0.1951219), wk = 0.0027322 k( 272) = ( 0.2012195 0.2987805 0.2012195), wk = 0.0027322 k( 273) = ( 0.2073171 0.2926829 0.2073171), wk = 0.0027322 k( 274) = ( 0.2134146 0.2865854 0.2134146), wk = 0.0027322 k( 275) = ( 0.2195122 0.2804878 0.2195122), wk = 0.0027322 k( 276) = ( 0.2256098 0.2743902 0.2256098), wk = 0.0027322 k( 277) = ( 0.2317073 0.2682927 0.2317073), wk = 0.0027322 k( 278) = ( 0.2378049 0.2621951 0.2378049), wk = 0.0027322 k( 279) = ( 0.2439024 0.2560976 0.2439024), wk = 0.0027322 k( 280) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0027322 k( 281) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0027322 k( 282) = ( 0.2631579 0.2631579 0.2327397), wk = 0.0027322 k( 283) = ( 0.2763158 0.2763158 0.2154794), wk = 0.0027322 k( 284) = ( 0.2894737 0.2894737 0.1982190), wk = 0.0027322 k( 285) = ( 0.3026316 0.3026316 0.1809587), wk = 0.0027322 k( 286) = ( 0.3157895 0.3157895 0.1636984), wk = 0.0027322 k( 287) = ( 0.3289474 0.3289474 0.1464381), wk = 0.0027322 k( 288) = ( 0.3421053 0.3421053 0.1291778), wk = 0.0027322 k( 289) = ( 0.3552632 0.3552632 0.1119174), wk = 0.0027322 k( 290) = ( 0.3684211 0.3684211 0.0946571), wk = 0.0027322 k( 291) = ( 0.3815789 0.3815789 0.0773968), wk = 0.0027322 k( 292) = ( 0.3947368 0.3947368 0.0601365), wk = 0.0027322 k( 293) = ( 0.4078947 0.4078947 0.0428762), wk = 0.0027322 k( 294) = ( 0.4210526 0.4210526 0.0256158), wk = 0.0027322 k( 295) = ( 0.4342105 0.4342105 0.0083555), wk = 0.0027322 k( 296) = ( 0.4473684 0.4473684 -0.0089048), wk = 0.0027322 k( 297) = ( 0.4605263 0.4605263 -0.0261651), wk = 0.0027322 k( 298) = ( 0.4736842 0.4736842 -0.0434255), wk = 0.0027322 k( 299) = ( 0.4868421 0.4868421 -0.0606858), wk = 0.0027322 k( 300) = ( 0.5000000 0.5000000 -0.0779461), wk = 0.0027322 k( 301) = ( 0.5000000 0.5000000 -0.0779461), wk = 0.0027322 k( 302) = ( 0.5000000 0.5000000 -0.0867389), wk = 0.0027322 k( 303) = ( 0.5000000 0.5000000 -0.0955317), wk = 0.0027322 k( 304) = ( 0.5000000 0.5000000 -0.1043245), wk = 0.0027322 k( 305) = ( 0.5000000 0.5000000 -0.1131173), wk = 0.0027322 k( 306) = ( 0.5000000 0.5000000 -0.1219100), wk = 0.0027322 k( 307) = ( 0.5000000 0.5000000 -0.1307028), wk = 0.0027322 k( 308) = ( 0.5000000 0.5000000 -0.1394956), wk = 0.0027322 k( 309) = ( 0.5000000 0.5000000 -0.1482884), wk = 0.0027322 k( 310) = ( 0.5000000 0.5000000 -0.1570812), wk = 0.0027322 k( 311) = ( 0.5000000 0.5000000 -0.1658740), wk = 0.0027322 k( 312) = ( 0.5000000 0.5000000 -0.1746668), wk = 0.0027322 k( 313) = ( 0.5000000 0.5000000 -0.1834596), wk = 0.0027322 k( 314) = ( 0.5000000 0.5000000 -0.1922524), wk = 0.0027322 k( 315) = ( 0.5000000 0.5000000 -0.2010451), wk = 0.0027322 k( 316) = ( 0.5000000 0.5000000 -0.2098379), wk = 0.0027322 k( 317) = ( 0.5000000 0.5000000 -0.2186307), wk = 0.0027322 k( 318) = ( 0.5000000 0.5000000 -0.2274235), wk = 0.0027322 k( 319) = ( 0.5000000 0.5000000 -0.2362163), wk = 0.0027322 k( 320) = ( 0.5000000 0.5000000 -0.2450091), wk = 0.0027322 k( 321) = ( 0.5000000 0.5000000 -0.2538019), wk = 0.0027322 k( 322) = ( 0.5000000 0.5000000 -0.2625947), wk = 0.0027322 k( 323) = ( 0.5000000 0.5000000 -0.2713875), wk = 0.0027322 k( 324) = ( 0.5000000 0.5000000 -0.2801803), wk = 0.0027322 k( 325) = ( 0.5000000 0.5000000 -0.2889730), wk = 0.0027322 k( 326) = ( 0.5000000 0.5000000 -0.2977658), wk = 0.0027322 k( 327) = ( 0.5000000 0.5000000 -0.3065586), wk = 0.0027322 k( 328) = ( 0.5000000 0.5000000 -0.3153514), wk = 0.0027322 k( 329) = ( 0.5000000 0.5000000 -0.3241442), wk = 0.0027322 k( 330) = ( 0.5000000 0.5000000 -0.3329370), wk = 0.0027322 k( 331) = ( 0.5000000 0.5000000 -0.3417298), wk = 0.0027322 k( 332) = ( 0.5000000 0.5000000 -0.3505226), wk = 0.0027322 k( 333) = ( 0.5000000 0.5000000 -0.3593154), wk = 0.0027322 k( 334) = ( 0.5000000 0.5000000 -0.3681082), wk = 0.0027322 k( 335) = ( 0.5000000 0.5000000 -0.3769009), wk = 0.0027322 k( 336) = ( 0.5000000 0.5000000 -0.3856937), wk = 0.0027322 k( 337) = ( 0.5000000 0.5000000 -0.3944865), wk = 0.0027322 k( 338) = ( 0.5000000 0.5000000 -0.4032793), wk = 0.0027322 k( 339) = ( 0.5000000 0.5000000 -0.4120721), wk = 0.0027322 k( 340) = ( 0.5000000 0.5000000 -0.4208649), wk = 0.0027322 k( 341) = ( 0.5000000 0.5000000 -0.4296577), wk = 0.0027322 k( 342) = ( 0.5000000 0.5000000 -0.4384505), wk = 0.0027322 k( 343) = ( 0.5000000 0.5000000 -0.4472433), wk = 0.0027322 k( 344) = ( 0.5000000 0.5000000 -0.4560361), wk = 0.0027322 k( 345) = ( 0.5000000 0.5000000 -0.4648288), wk = 0.0027322 k( 346) = ( 0.5000000 0.5000000 -0.4736216), wk = 0.0027322 k( 347) = ( 0.5000000 0.5000000 -0.4824144), wk = 0.0027322 k( 348) = ( 0.5000000 0.5000000 -0.4912072), wk = 0.0027322 k( 349) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0027322 k( 350) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027322 k( 351) = ( 0.0156250 0.0156250 0.4843750), wk = 0.0027322 k( 352) = ( 0.0312500 0.0312500 0.4687500), wk = 0.0027322 k( 353) = ( 0.0468750 0.0468750 0.4531250), wk = 0.0027322 k( 354) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0027322 k( 355) = ( 0.0781250 0.0781250 0.4218750), wk = 0.0027322 k( 356) = ( 0.0937500 0.0937500 0.4062500), wk = 0.0027322 k( 357) = ( 0.1093750 0.1093750 0.3906250), wk = 0.0027322 k( 358) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0027322 k( 359) = ( 0.1406250 0.1406250 0.3593750), wk = 0.0027322 k( 360) = ( 0.1562500 0.1562500 0.3437500), wk = 0.0027322 k( 361) = ( 0.1718750 0.1718750 0.3281250), wk = 0.0027322 k( 362) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0027322 k( 363) = ( 0.2031250 0.2031250 0.2968750), wk = 0.0027322 k( 364) = ( 0.2187500 0.2187500 0.2812500), wk = 0.0027322 k( 365) = ( 0.2343750 0.2343750 0.2656250), wk = 0.0027322 k( 366) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0027322 Dense grid: 49565 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.34 Mb ( 364, 62) NL pseudopotentials 0.47 Mb ( 182, 170) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1377) G-vector shells 0.00 Mb ( 619) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.38 Mb ( 364, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.32 Mb ( 170, 2, 62) The potential is recalculated from file : ./CaxCoSix2.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.8 secs Computing kpt #: 2 total cpu time spent up to now is 5.8 secs Computing kpt #: 3 total cpu time spent up to now is 6.9 secs Computing kpt #: 4 total cpu time spent up to now is 7.9 secs Computing kpt #: 5 total cpu time spent up to now is 9.0 secs Computing kpt #: 6 total cpu time spent up to now is 10.3 secs Computing kpt #: 7 total cpu time spent up to now is 11.6 secs Computing kpt #: 8 total cpu time spent up to now is 12.8 secs Computing kpt #: 9 total cpu time spent up to now is 14.3 secs Computing kpt #: 10 total cpu time spent up to now is 15.6 secs Computing kpt #: 11 total cpu time spent up to now is 16.9 secs Computing kpt #: 12 total cpu time spent up to now is 18.2 secs Computing kpt #: 13 total cpu time spent up to now is 19.3 secs Computing kpt #: 14 total cpu time spent up to now is 20.5 secs Computing kpt #: 15 total cpu time spent up to now is 21.5 secs Computing kpt #: 16 total cpu time spent up to now is 22.5 secs Computing kpt #: 17 total cpu time spent up to now is 23.5 secs Computing kpt #: 18 total cpu time spent up to now is 24.5 secs Computing kpt #: 19 total cpu time spent up to now is 25.5 secs Computing kpt #: 20 total cpu time spent up to now is 26.5 secs Computing kpt #: 21 total cpu time spent up to now is 27.6 secs Computing kpt #: 22 total cpu time spent up to now is 28.6 secs Computing kpt #: 23 total cpu time spent up to now is 29.7 secs Computing kpt #: 24 total cpu time spent up to now is 30.7 secs Computing kpt #: 25 total cpu time spent up to now is 31.9 secs Computing kpt #: 26 total cpu time spent up to now is 33.1 secs Computing kpt #: 27 total cpu time spent up to now is 34.1 secs Computing kpt #: 28 total cpu time spent up to now is 35.2 secs Computing kpt #: 29 total cpu time spent up to now is 36.5 secs Computing kpt #: 30 total cpu time spent up to now is 38.1 secs Computing kpt #: 31 total cpu time spent up to now is 39.7 secs Computing kpt #: 32 total cpu time spent up to now is 40.7 secs Computing kpt #: 33 total cpu time spent up to now is 41.7 secs Computing kpt #: 34 total cpu time spent up to now is 42.6 secs Computing kpt #: 35 total cpu time spent up to now is 43.6 secs Computing kpt #: 36 total cpu time spent up to now is 44.6 secs Computing kpt #: 37 total cpu time spent up to now is 45.6 secs Computing kpt #: 38 total cpu time spent up to now is 46.6 secs Computing kpt #: 39 total cpu time spent up to now is 47.6 secs Computing kpt #: 40 total cpu time spent up to now is 48.6 secs Computing kpt #: 41 total cpu time spent up to now is 49.5 secs Computing kpt #: 42 total cpu time spent up to now is 50.5 secs Computing kpt #: 43 total cpu time spent up to now is 51.4 secs Computing kpt #: 44 total cpu time spent up to now is 52.4 secs Computing kpt #: 45 total cpu time spent up to now is 53.4 secs Computing kpt #: 46 total cpu time spent up to now is 54.3 secs Computing kpt #: 47 total cpu time spent up to now is 55.3 secs Computing kpt #: 48 total cpu time spent up to now is 56.3 secs Computing kpt #: 49 total cpu time spent up to now is 57.4 secs Computing kpt #: 50 total cpu time spent up to now is 58.4 secs Computing kpt #: 51 total cpu time spent up to now is 59.4 secs Computing kpt #: 52 total cpu time spent up to now is 60.3 secs Computing kpt #: 53 total cpu time spent up to now is 61.3 secs Computing kpt #: 54 total cpu time spent up to now is 62.3 secs Computing kpt #: 55 total cpu time spent up to now is 63.2 secs Computing kpt #: 56 total cpu time spent up to now is 64.2 secs Computing kpt #: 57 total cpu time spent up to now is 65.3 secs Computing kpt #: 58 total cpu time spent up to now is 66.5 secs Computing kpt #: 59 total cpu time spent up to now is 67.5 secs Computing kpt #: 60 total cpu time spent up to now is 68.5 secs Computing kpt #: 61 total cpu time spent up to now is 69.4 secs Computing kpt #: 62 total cpu time spent up to now is 70.5 secs Computing kpt #: 63 total cpu time spent up to now is 71.4 secs Computing kpt #: 64 total cpu time spent up to now is 72.4 secs Computing kpt #: 65 total cpu time spent up to now is 73.4 secs Computing kpt #: 66 total cpu time spent up to now is 74.4 secs Computing kpt #: 67 total cpu time spent up to now is 75.4 secs Computing kpt #: 68 total cpu time spent up to now is 76.4 secs Computing kpt #: 69 total cpu time spent up to now is 77.4 secs Computing kpt #: 70 total cpu time spent up to now is 78.5 secs Computing kpt #: 71 total cpu time spent up to now is 79.5 secs Computing kpt #: 72 total cpu time spent up to now is 80.5 secs Computing kpt #: 73 total cpu time spent up to now is 81.5 secs Computing kpt #: 74 total cpu time spent up to now is 82.5 secs Computing kpt #: 75 total cpu time spent up to now is 83.5 secs Computing kpt #: 76 total cpu time spent up to now is 84.5 secs Computing kpt #: 77 total cpu time spent up to now is 85.5 secs Computing kpt #: 78 total cpu time spent up to now is 86.5 secs Computing kpt #: 79 total cpu time spent up to now is 87.5 secs Computing kpt #: 80 total cpu time spent up to now is 88.5 secs Computing kpt #: 81 total cpu time spent up to now is 89.5 secs Computing kpt #: 82 total cpu time spent up to now is 90.5 secs Computing kpt #: 83 total cpu time spent up to now is 91.5 secs Computing kpt #: 84 total cpu time spent up to now is 92.6 secs Computing kpt #: 85 total cpu time spent up to now is 93.6 secs Computing kpt #: 86 total cpu time spent up to now is 94.6 secs Computing kpt #: 87 total cpu time spent up to now is 95.7 secs Computing kpt #: 88 total cpu time spent up to now is 97.0 secs Computing kpt #: 89 total cpu time spent up to now is 98.2 secs Computing kpt #: 90 total cpu time spent up to now is 99.4 secs Computing kpt #: 91 total cpu time spent up to now is 100.4 secs Computing kpt #: 92 total cpu time spent up to now is 101.6 secs Computing kpt #: 93 total cpu time spent up to now is 102.6 secs Computing kpt #: 94 total cpu time spent up to now is 103.7 secs Computing kpt #: 95 total cpu time spent up to now is 104.7 secs Computing kpt #: 96 total cpu time spent up to now is 105.7 secs Computing kpt #: 97 total cpu time spent up to now is 107.4 secs Computing kpt #: 98 total cpu time spent up to now is 109.0 secs Computing kpt #: 99 total cpu time spent up to now is 110.8 secs Computing kpt #: 100 total cpu time spent up to now is 112.3 secs Computing kpt #: 101 total cpu time spent up to now is 113.3 secs Computing kpt #: 102 total cpu time spent up to now is 114.3 secs Computing kpt #: 103 total cpu time spent up to now is 115.3 secs Computing kpt #: 104 total cpu time spent up to now is 116.3 secs Computing kpt #: 105 total cpu time spent up to now is 117.3 secs Computing kpt #: 106 total cpu time spent up to now is 118.2 secs Computing kpt #: 107 total cpu time spent up to now is 119.2 secs Computing kpt #: 108 total cpu time spent up to now is 120.2 secs Computing kpt #: 109 total cpu time spent up to now is 121.2 secs Computing kpt #: 110 total cpu time spent up to now is 122.2 secs Computing kpt #: 111 total cpu time spent up to now is 123.1 secs Computing kpt #: 112 total cpu time spent up to now is 124.1 secs Computing kpt #: 113 total cpu time spent up to now is 125.1 secs Computing kpt #: 114 total cpu time spent up to now is 126.1 secs Computing kpt #: 115 total cpu time spent up to now is 127.0 secs Computing kpt #: 116 total cpu time spent up to now is 128.0 secs Computing kpt #: 117 total cpu time spent up to now is 129.0 secs Computing kpt #: 118 total cpu time spent up to now is 130.0 secs Computing kpt #: 119 total cpu time spent up to now is 131.0 secs Computing kpt #: 120 total cpu time spent up to now is 132.1 secs Computing kpt #: 121 total cpu time spent up to now is 133.1 secs Computing kpt #: 122 total cpu time spent up to now is 134.1 secs Computing kpt #: 123 total cpu time spent up to now is 135.1 secs Computing kpt #: 124 total cpu time spent up to now is 136.1 secs Computing kpt #: 125 total cpu time spent up to now is 137.0 secs Computing kpt #: 126 total cpu time spent up to now is 138.0 secs Computing kpt #: 127 total cpu time spent up to now is 139.0 secs Computing kpt #: 128 total cpu time spent up to now is 140.0 secs Computing kpt #: 129 total cpu time spent up to now is 141.0 secs Computing kpt #: 130 total cpu time spent up to now is 142.0 secs Computing kpt #: 131 total cpu time spent up to now is 142.9 secs Computing kpt #: 132 total cpu time spent up to now is 143.9 secs Computing kpt #: 133 total cpu time spent up to now is 144.9 secs Computing kpt #: 134 total cpu time spent up to now is 145.9 secs Computing kpt #: 135 total cpu time spent up to now is 146.9 secs Computing kpt #: 136 total cpu time spent up to now is 147.8 secs Computing kpt #: 137 total cpu time spent up to now is 148.8 secs Computing kpt #: 138 total cpu time spent up to now is 149.8 secs Computing kpt #: 139 total cpu time spent up to now is 150.8 secs Computing kpt #: 140 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 153.5 secs Computing kpt #: 141 total cpu time spent up to now is 155.1 secs Computing kpt #: 142 total cpu time spent up to now is 156.4 secs Computing kpt #: 143 total cpu time spent up to now is 157.7 secs Computing kpt #: 144 total cpu time spent up to now is 159.0 secs Computing kpt #: 145 total cpu time spent up to now is 160.4 secs Computing kpt #: 146 total cpu time spent up to now is 161.7 secs Computing kpt #: 147 total cpu time spent up to now is 162.9 secs Computing kpt #: 148 total cpu time spent up to now is 164.0 secs Computing kpt #: 149 total cpu time spent up to now is 165.0 secs Computing kpt #: 150 total cpu time spent up to now is 166.1 secs Computing kpt #: 151 total cpu time spent up to now is 167.1 secs Computing kpt #: 152 total cpu time spent up to now is 168.2 secs Computing kpt #: 153 total cpu time spent up to now is 169.2 secs Computing kpt #: 154 total cpu time spent up to now is 170.3 secs Computing kpt #: 155 total cpu time spent up to now is 171.3 secs Computing kpt #: 156 total cpu time spent up to now is 172.3 secs Computing kpt #: 157 total cpu time spent up to now is 173.4 secs Computing kpt #: 158 total cpu time spent up to now is 174.4 secs Computing kpt #: 159 total cpu time spent up to now is 175.6 secs Computing kpt #: 160 total cpu time spent up to now is 176.7 secs Computing kpt #: 161 total cpu time spent up to now is 177.9 secs Computing kpt #: 162 total cpu time spent up to now is 179.1 secs Computing kpt #: 163 total cpu time spent up to now is 180.1 secs Computing kpt #: 164 total cpu time spent up to now is 181.4 secs Computing kpt #: 165 total cpu time spent up to now is 182.6 secs Computing kpt #: 166 total cpu time spent up to now is 183.8 secs Computing kpt #: 167 total cpu time spent up to now is 185.1 secs Computing kpt #: 168 total cpu time spent up to now is 186.3 secs Computing kpt #: 169 total cpu time spent up to now is 187.7 secs Computing kpt #: 170 total cpu time spent up to now is 188.9 secs Computing kpt #: 171 total cpu time spent up to now is 190.1 secs Computing kpt #: 172 total cpu time spent up to now is 191.3 secs Computing kpt #: 173 total cpu time spent up to now is 192.4 secs Computing kpt #: 174 total cpu time spent up to now is 193.4 secs Computing kpt #: 175 total cpu time spent up to now is 194.5 secs Computing kpt #: 176 total cpu time spent up to now is 195.6 secs Computing kpt #: 177 total cpu time spent up to now is 196.6 secs Computing kpt #: 178 total cpu time spent up to now is 197.7 secs Computing kpt #: 179 total cpu time spent up to now is 198.6 secs Computing kpt #: 180 total cpu time spent up to now is 199.6 secs Computing kpt #: 181 total cpu time spent up to now is 200.5 secs Computing kpt #: 182 total cpu time spent up to now is 201.5 secs Computing kpt #: 183 total cpu time spent up to now is 202.4 secs Computing kpt #: 184 total cpu time spent up to now is 203.3 secs Computing kpt #: 185 total cpu time spent up to now is 204.3 secs Computing kpt #: 186 total cpu time spent up to now is 205.2 secs Computing kpt #: 187 total cpu time spent up to now is 206.2 secs Computing kpt #: 188 total cpu time spent up to now is 207.1 secs Computing kpt #: 189 total cpu time spent up to now is 208.1 secs Computing kpt #: 190 total cpu time spent up to now is 209.2 secs Computing kpt #: 191 total cpu time spent up to now is 210.2 secs Computing kpt #: 192 total cpu time spent up to now is 211.2 secs Computing kpt #: 193 total cpu time spent up to now is 212.3 secs Computing kpt #: 194 total cpu time spent up to now is 213.6 secs Computing kpt #: 195 total cpu time spent up to now is 214.7 secs Computing kpt #: 196 total cpu time spent up to now is 215.9 secs Computing kpt #: 197 total cpu time spent up to now is 217.1 secs Computing kpt #: 198 total cpu time spent up to now is 218.4 secs Computing kpt #: 199 total cpu time spent up to now is 219.6 secs Computing kpt #: 200 total cpu time spent up to now is 220.9 secs Computing kpt #: 201 total cpu time spent up to now is 222.1 secs Computing kpt #: 202 total cpu time spent up to now is 223.3 secs Computing kpt #: 203 total cpu time spent up to now is 224.3 secs Computing kpt #: 204 total cpu time spent up to now is 225.3 secs Computing kpt #: 205 total cpu time spent up to now is 226.6 secs Computing kpt #: 206 total cpu time spent up to now is 227.7 secs Computing kpt #: 207 total cpu time spent up to now is 229.2 secs Computing kpt #: 208 total cpu time spent up to now is 230.4 secs Computing kpt #: 209 total cpu time spent up to now is 231.5 secs Computing kpt #: 210 total cpu time spent up to now is 232.8 secs Computing kpt #: 211 total cpu time spent up to now is 234.1 secs Computing kpt #: 212 total cpu time spent up to now is 236.0 secs Computing kpt #: 213 total cpu time spent up to now is 237.3 secs Computing kpt #: 214 total cpu time spent up to now is 238.5 secs Computing kpt #: 215 total cpu time spent up to now is 239.8 secs Computing kpt #: 216 total cpu time spent up to now is 241.0 secs Computing kpt #: 217 total cpu time spent up to now is 242.0 secs Computing kpt #: 218 total cpu time spent up to now is 243.0 secs Computing kpt #: 219 total cpu time spent up to now is 244.0 secs Computing kpt #: 220 total cpu time spent up to now is 244.9 secs Computing kpt #: 221 total cpu time spent up to now is 245.9 secs Computing kpt #: 222 total cpu time spent up to now is 246.9 secs Computing kpt #: 223 total cpu time spent up to now is 247.9 secs Computing kpt #: 224 total cpu time spent up to now is 248.9 secs Computing kpt #: 225 total cpu time spent up to now is 250.1 secs Computing kpt #: 226 total cpu time spent up to now is 251.2 secs Computing kpt #: 227 total cpu time spent up to now is 252.4 secs Computing kpt #: 228 total cpu time spent up to now is 253.5 secs Computing kpt #: 229 total cpu time spent up to now is 254.7 secs Computing kpt #: 230 total cpu time spent up to now is 255.8 secs Computing kpt #: 231 total cpu time spent up to now is 257.0 secs Computing kpt #: 232 total cpu time spent up to now is 258.1 secs Computing kpt #: 233 total cpu time spent up to now is 259.1 secs Computing kpt #: 234 total cpu time spent up to now is 260.2 secs Computing kpt #: 235 total cpu time spent up to now is 261.1 secs Computing kpt #: 236 total cpu time spent up to now is 262.1 secs Computing kpt #: 237 total cpu time spent up to now is 263.2 secs Computing kpt #: 238 total cpu time spent up to now is 264.2 secs Computing kpt #: 239 total cpu time spent up to now is 265.2 secs Computing kpt #: 240 total cpu time spent up to now is 266.2 secs Computing kpt #: 241 total cpu time spent up to now is 267.2 secs Computing kpt #: 242 total cpu time spent up to now is 268.2 secs Computing kpt #: 243 total cpu time spent up to now is 269.2 secs Computing kpt #: 244 total cpu time spent up to now is 270.2 secs Computing kpt #: 245 total cpu time spent up to now is 271.3 secs Computing kpt #: 246 total cpu time spent up to now is 272.3 secs Computing kpt #: 247 total cpu time spent up to now is 273.3 secs Computing kpt #: 248 total cpu time spent up to now is 274.3 secs Computing kpt #: 249 total cpu time spent up to now is 275.3 secs Computing kpt #: 250 total cpu time spent up to now is 276.3 secs Computing kpt #: 251 total cpu time spent up to now is 277.3 secs Computing kpt #: 252 total cpu time spent up to now is 278.4 secs Computing kpt #: 253 total cpu time spent up to now is 279.4 secs Computing kpt #: 254 total cpu time spent up to now is 280.4 secs Computing kpt #: 255 total cpu time spent up to now is 281.5 secs Computing kpt #: 256 total cpu time spent up to now is 282.5 secs Computing kpt #: 257 total cpu time spent up to now is 283.5 secs Computing kpt #: 258 total cpu time spent up to now is 284.6 secs Computing kpt #: 259 total cpu time spent up to now is 285.6 secs Computing kpt #: 260 total cpu time spent up to now is 286.6 secs Computing kpt #: 261 total cpu time spent up to now is 287.7 secs Computing kpt #: 262 total cpu time spent up to now is 288.8 secs Computing kpt #: 263 total cpu time spent up to now is 289.8 secs Computing kpt #: 264 total cpu time spent up to now is 290.8 secs Computing kpt #: 265 total cpu time spent up to now is 291.8 secs Computing kpt #: 266 total cpu time spent up to now is 292.8 secs Computing kpt #: 267 total cpu time spent up to now is 293.8 secs Computing kpt #: 268 total cpu time spent up to now is 294.7 secs Computing kpt #: 269 total cpu time spent up to now is 295.7 secs Computing kpt #: 270 total cpu time spent up to now is 296.7 secs Computing kpt #: 271 total cpu time spent up to now is 297.7 secs Computing kpt #: 272 total cpu time spent up to now is 298.7 secs Computing kpt #: 273 total cpu time spent up to now is 299.7 secs Computing kpt #: 274 total cpu time spent up to now is 300.7 secs Computing kpt #: 275 total cpu time spent up to now is 301.7 secs Computing kpt #: 276 total cpu time spent up to now is 302.7 secs Computing kpt #: 277 total cpu time spent up to now is 303.7 secs Computing kpt #: 278 total cpu time spent up to now is 304.7 secs Computing kpt #: 279 total cpu time spent up to now is 305.7 secs Computing kpt #: 280 total cpu time spent up to now is 306.8 secs Computing kpt #: 281 total cpu time spent up to now is 307.8 secs Computing kpt #: 282 total cpu time spent up to now is 309.0 secs Computing kpt #: 283 total cpu time spent up to now is 310.2 secs Computing kpt #: 284 total cpu time spent up to now is 311.4 secs Computing kpt #: 285 total cpu time spent up to now is 312.4 secs Computing kpt #: 286 total cpu time spent up to now is 313.4 secs Computing kpt #: 287 total cpu time spent up to now is 314.4 secs Computing kpt #: 288 total cpu time spent up to now is 315.4 secs Computing kpt #: 289 total cpu time spent up to now is 316.5 secs Computing kpt #: 290 total cpu time spent up to now is 317.5 secs Computing kpt #: 291 total cpu time spent up to now is 318.5 secs Computing kpt #: 292 total cpu time spent up to now is 319.5 secs Computing kpt #: 293 total cpu time spent up to now is 320.5 secs Computing kpt #: 294 total cpu time spent up to now is 321.5 secs Computing kpt #: 295 total cpu time spent up to now is 322.5 secs Computing kpt #: 296 total cpu time spent up to now is 323.5 secs Computing kpt #: 297 total cpu time spent up to now is 324.5 secs Computing kpt #: 298 total cpu time spent up to now is 325.5 secs Computing kpt #: 299 total cpu time spent up to now is 326.5 secs Computing kpt #: 300 total cpu time spent up to now is 328.0 secs Computing kpt #: 301 total cpu time spent up to now is 329.0 secs Computing kpt #: 302 total cpu time spent up to now is 330.0 secs Computing kpt #: 303 total cpu time spent up to now is 331.0 secs Computing kpt #: 304 total cpu time spent up to now is 332.0 secs Computing kpt #: 305 total cpu time spent up to now is 333.0 secs Computing kpt #: 306 total cpu time spent up to now is 334.0 secs Computing kpt #: 307 total cpu time spent up to now is 335.1 secs Computing kpt #: 308 total cpu time spent up to now is 336.1 secs Computing kpt #: 309 total cpu time spent up to now is 337.2 secs Computing kpt #: 310 total cpu time spent up to now is 338.2 secs Computing kpt #: 311 total cpu time spent up to now is 339.2 secs Computing kpt #: 312 total cpu time spent up to now is 340.3 secs Computing kpt #: 313 total cpu time spent up to now is 341.3 secs Computing kpt #: 314 total cpu time spent up to now is 342.3 secs Computing kpt #: 315 total cpu time spent up to now is 343.3 secs Computing kpt #: 316 total cpu time spent up to now is 344.4 secs Computing kpt #: 317 total cpu time spent up to now is 345.4 secs Computing kpt #: 318 total cpu time spent up to now is 346.4 secs Computing kpt #: 319 total cpu time spent up to now is 347.4 secs Computing kpt #: 320 total cpu time spent up to now is 348.4 secs Computing kpt #: 321 total cpu time spent up to now is 349.5 secs Computing kpt #: 322 total cpu time spent up to now is 350.5 secs Computing kpt #: 323 total cpu time spent up to now is 351.5 secs Computing kpt #: 324 total cpu time spent up to now is 352.5 secs Computing kpt #: 325 total cpu time spent up to now is 353.4 secs Computing kpt #: 326 total cpu time spent up to now is 354.6 secs Computing kpt #: 327 total cpu time spent up to now is 355.8 secs Computing kpt #: 328 total cpu time spent up to now is 357.3 secs Computing kpt #: 329 total cpu time spent up to now is 358.6 secs Computing kpt #: 330 total cpu time spent up to now is 359.7 secs Computing kpt #: 331 total cpu time spent up to now is 360.9 secs Computing kpt #: 332 total cpu time spent up to now is 362.6 secs Computing kpt #: 333 total cpu time spent up to now is 363.8 secs Computing kpt #: 334 total cpu time spent up to now is 365.0 secs Computing kpt #: 335 total cpu time spent up to now is 366.2 secs Computing kpt #: 336 total cpu time spent up to now is 367.4 secs Computing kpt #: 337 total cpu time spent up to now is 368.4 secs Computing kpt #: 338 total cpu time spent up to now is 369.4 secs Computing kpt #: 339 total cpu time spent up to now is 370.4 secs Computing kpt #: 340 total cpu time spent up to now is 371.4 secs Computing kpt #: 341 total cpu time spent up to now is 372.5 secs Computing kpt #: 342 total cpu time spent up to now is 373.6 secs Computing kpt #: 343 total cpu time spent up to now is 374.6 secs Computing kpt #: 344 total cpu time spent up to now is 375.7 secs Computing kpt #: 345 total cpu time spent up to now is 376.7 secs Computing kpt #: 346 total cpu time spent up to now is 377.7 secs Computing kpt #: 347 total cpu time spent up to now is 378.6 secs Computing kpt #: 348 total cpu time spent up to now is 379.6 secs Computing kpt #: 349 total cpu time spent up to now is 380.5 secs Computing kpt #: 350 total cpu time spent up to now is 381.5 secs Computing kpt #: 351 total cpu time spent up to now is 382.5 secs Computing kpt #: 352 total cpu time spent up to now is 383.5 secs Computing kpt #: 353 total cpu time spent up to now is 384.5 secs Computing kpt #: 354 total cpu time spent up to now is 385.5 secs Computing kpt #: 355 total cpu time spent up to now is 386.5 secs Computing kpt #: 356 total cpu time spent up to now is 387.5 secs Computing kpt #: 357 total cpu time spent up to now is 388.5 secs Computing kpt #: 358 total cpu time spent up to now is 389.5 secs Computing kpt #: 359 total cpu time spent up to now is 390.5 secs Computing kpt #: 360 total cpu time spent up to now is 391.5 secs Computing kpt #: 361 total cpu time spent up to now is 392.5 secs Computing kpt #: 362 total cpu time spent up to now is 393.5 secs Computing kpt #: 363 total cpu time spent up to now is 394.6 secs Computing kpt #: 364 total cpu time spent up to now is 395.6 secs Computing kpt #: 365 total cpu time spent up to now is 396.8 secs Computing kpt #: 366 total cpu time spent up to now is 397.9 secs ethr = 1.92E-08, avg # of iterations = 20.7 total cpu time spent up to now is 397.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4173 -9.4173 -9.0552 -9.0552 -9.0293 -9.0293 1.4873 1.4873 5.4149 5.4149 6.8366 6.8366 8.9363 8.9363 8.9650 8.9650 9.2101 9.2101 9.3892 9.3892 10.2637 10.2637 10.2903 10.2903 10.8711 10.8711 11.0962 11.0962 11.2563 11.2563 11.7554 11.7554 11.7627 11.7627 11.8777 11.8777 12.9626 12.9626 14.5461 14.5461 14.5494 14.5494 16.3221 16.3221 k = 0.0000 0.0000 0.0180 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4174 -9.4174 -9.0553 -9.0553 -9.0293 -9.0293 1.4887 1.4887 5.4148 5.4148 6.8378 6.8378 8.9351 8.9351 8.9641 8.9641 9.2114 9.2114 9.3894 9.3894 10.2627 10.2627 10.2894 10.2894 10.8706 10.8706 11.0961 11.0961 11.2555 11.2555 11.7395 11.7395 11.7585 11.7585 11.8957 11.8957 12.9586 12.9586 14.5376 14.5376 14.5548 14.5548 16.3283 16.3283 k = 0.0000 0.0000 0.0360 ( 6243 PWs) bands (ev): -79.7999 -79.7999 -79.7892 -79.7892 -45.5002 -45.5002 -45.4644 -45.4644 -43.8324 -43.8324 -43.7704 -43.7704 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4175 -9.4175 -9.0555 -9.0555 -9.0293 -9.0293 1.4928 1.4928 5.4144 5.4144 6.8414 6.8414 8.9308 8.9308 8.9615 8.9615 9.2154 9.2154 9.3898 9.3898 10.2586 10.2586 10.2880 10.2880 10.8689 10.8689 11.0958 11.0958 11.2531 11.2531 11.6992 11.6992 11.7552 11.7552 11.9321 11.9321 12.9465 12.9465 14.5102 14.5102 14.5724 14.5724 16.3461 16.3461 k = 0.0000 0.0000 0.0540 ( 6239 PWs) bands (ev): -79.7998 -79.7998 -79.7891 -79.7891 -45.5000 -45.5000 -45.4645 -45.4645 -43.8322 -43.8322 -43.7705 -43.7705 -43.6872 -43.6872 -43.6782 -43.6782 -28.1069 -28.1069 -9.4178 -9.4178 -9.0559 -9.0559 -9.0293 -9.0293 1.4998 1.4998 5.4139 5.4139 6.8474 6.8474 8.9226 8.9226 8.9599 8.9599 9.2214 9.2214 9.3911 9.3911 10.2487 10.2487 10.2889 10.2889 10.8668 10.8668 11.0950 11.0950 11.2491 11.2491 11.6524 11.6524 11.7508 11.7508 11.9739 11.9739 12.9271 12.9271 14.4668 14.4668 14.6025 14.6025 16.3735 16.3735 k = 0.0000 0.0000 0.0720 ( 6243 PWs) bands (ev): -79.7998 -79.7998 -79.7893 -79.7893 -45.5000 -45.5000 -45.4646 -45.4646 -43.8321 -43.8321 -43.7707 -43.7707 -43.6872 -43.6872 -43.6782 -43.6782 -28.1069 -28.1069 -9.4181 -9.4181 -9.0565 -9.0565 -9.0294 -9.0294 1.5095 1.5095 5.4130 5.4130 6.8558 6.8558 8.9094 8.9094 8.9596 8.9596 9.2295 9.2295 9.3923 9.3923 10.2317 10.2317 10.2925 10.2925 10.8633 10.8633 11.0942 11.0942 11.2435 11.2435 11.6036 11.6036 11.7442 11.7442 12.0153 12.0153 12.9011 12.9011 14.4096 14.4096 14.6433 14.6433 16.4076 16.4076 k = 0.0000 0.0000 0.0900 ( 6241 PWs) bands (ev): -79.7998 -79.7998 -79.7892 -79.7892 -45.4998 -45.4998 -45.4647 -45.4647 -43.8318 -43.8318 -43.7709 -43.7709 -43.6872 -43.6872 -43.6783 -43.6783 -28.1068 -28.1068 -9.4185 -9.4185 -9.0572 -9.0572 -9.0295 -9.0295 1.5219 1.5219 5.4121 5.4121 6.8663 6.8663 8.8923 8.8923 8.9611 8.9611 9.2395 9.2395 9.3945 9.3945 10.2080 10.2080 10.2981 10.2981 10.8590 10.8590 11.0930 11.0930 11.2363 11.2363 11.5547 11.5547 11.7356 11.7356 12.0559 12.0559 12.8695 12.8695 14.3420 14.3420 14.6941 14.6941 16.4455 16.4455 k = 0.0000 0.0000 0.1080 ( 6225 PWs) bands (ev): -79.7995 -79.7995 -79.7889 -79.7889 -45.4996 -45.4996 -45.4648 -45.4648 -43.8315 -43.8315 -43.7710 -43.7710 -43.6871 -43.6871 -43.6783 -43.6783 -28.1067 -28.1067 -9.4191 -9.4191 -9.0581 -9.0581 -9.0296 -9.0296 1.5371 1.5371 5.4109 5.4109 6.8793 6.8793 8.8719 8.8719 8.9641 8.9641 9.2505 9.2505 9.3971 9.3971 10.1786 10.1786 10.3061 10.3061 10.8545 10.8545 11.0916 11.0916 11.2290 11.2290 11.5075 11.5075 11.7257 11.7257 12.0945 12.0945 12.8334 12.8334 14.2667 14.2667 14.7539 14.7539 16.4848 16.4848 k = 0.0000 0.0000 0.1259 ( 6217 PWs) bands (ev): -79.7993 -79.7993 -79.7888 -79.7888 -45.4994 -45.4994 -45.4649 -45.4649 -43.8312 -43.8312 -43.7713 -43.7713 -43.6870 -43.6870 -43.6783 -43.6783 -28.1066 -28.1066 -9.4197 -9.4197 -9.0591 -9.0591 -9.0297 -9.0297 1.5550 1.5550 5.4095 5.4095 6.8944 6.8944 8.8484 8.8484 8.9677 8.9677 9.2622 9.2622 9.3999 9.3999 10.1425 10.1425 10.3155 10.3155 10.8500 10.8500 11.0898 11.0898 11.2197 11.2197 11.4614 11.4614 11.7139 11.7139 12.1303 12.1303 12.7937 12.7937 14.1857 14.1857 14.8210 14.8210 16.5236 16.5236 k = 0.0000 0.0000 0.1439 ( 6211 PWs) bands (ev): -79.7994 -79.7994 -79.7884 -79.7884 -45.4991 -45.4991 -45.4652 -45.4652 -43.8308 -43.8308 -43.7717 -43.7717 -43.6869 -43.6869 -43.6784 -43.6784 -28.1065 -28.1065 -9.4204 -9.4204 -9.0603 -9.0603 -9.0298 -9.0298 1.5755 1.5755 5.4081 5.4081 6.9116 6.9116 8.8225 8.8225 8.9725 8.9725 9.2743 9.2743 9.4037 9.4037 10.1004 10.1004 10.3255 10.3255 10.8449 10.8449 11.0869 11.0869 11.2075 11.2075 11.4177 11.4177 11.6998 11.6998 12.1641 12.1641 12.7512 12.7512 14.1016 14.1016 14.8952 14.8952 16.5608 16.5608 k = 0.0000 0.0000 0.1619 ( 6219 PWs) bands (ev): -79.7994 -79.7994 -79.7888 -79.7888 -45.4989 -45.4989 -45.4654 -45.4654 -43.8305 -43.8305 -43.7721 -43.7721 -43.6868 -43.6868 -43.6785 -43.6785 -28.1063 -28.1063 -9.4212 -9.4212 -9.0616 -9.0616 -9.0300 -9.0300 1.5986 1.5986 5.4063 5.4063 6.9308 6.9308 8.7942 8.7942 8.9771 8.9771 9.2871 9.2871 9.4072 9.4072 10.0523 10.0523 10.3373 10.3373 10.8383 10.8383 11.0834 11.0834 11.1943 11.1943 11.3753 11.3753 11.6846 11.6846 12.1941 12.1941 12.7066 12.7066 14.0155 14.0155 14.9744 14.9744 16.5960 16.5960 k = 0.0000 0.0000 0.1799 ( 6231 PWs) bands (ev): -79.7996 -79.7996 -79.7890 -79.7890 -45.4987 -45.4987 -45.4657 -45.4657 -43.8301 -43.8301 -43.7726 -43.7726 -43.6868 -43.6868 -43.6786 -43.6786 -28.1062 -28.1062 -9.4220 -9.4220 -9.0630 -9.0630 -9.0301 -9.0301 1.6243 1.6243 5.4045 5.4045 6.9519 6.9519 8.7637 8.7637 8.9824 8.9824 9.2998 9.2998 9.4116 9.4116 9.9983 9.9983 10.3496 10.3496 10.8318 10.8318 11.0789 11.0789 11.1796 11.1796 11.3363 11.3363 11.6672 11.6672 12.2223 12.2223 12.6606 12.6606 13.9287 13.9287 15.0586 15.0586 16.6288 16.6288 k = 0.0000 0.0000 0.1979 ( 6221 PWs) bands (ev): -79.7993 -79.7993 -79.7890 -79.7890 -45.4984 -45.4984 -45.4660 -45.4660 -43.8296 -43.8296 -43.7731 -43.7731 -43.6867 -43.6867 -43.6786 -43.6786 -28.1060 -28.1060 -9.4230 -9.4230 -9.0646 -9.0646 -9.0303 -9.0303 1.6526 1.6526 5.4026 5.4026 6.9749 6.9749 8.7322 8.7322 8.9887 8.9887 9.3137 9.3137 9.4167 9.4167 9.9393 9.9393 10.3636 10.3636 10.8258 10.8258 11.0739 11.0739 11.1641 11.1641 11.3007 11.3007 11.6494 11.6494 12.2484 12.2484 12.6139 12.6139 13.8432 13.8432 15.1475 15.1475 16.6598 16.6598 k = 0.0000 0.0000 0.2159 ( 6221 PWs) bands (ev): -79.7992 -79.7992 -79.7891 -79.7891 -45.4981 -45.4981 -45.4663 -45.4663 -43.8291 -43.8291 -43.7736 -43.7736 -43.6867 -43.6867 -43.6787 -43.6787 -28.1058 -28.1058 -9.4240 -9.4240 -9.0663 -9.0663 -9.0304 -9.0304 1.6833 1.6833 5.4006 5.4006 6.9995 6.9995 8.6990 8.6990 8.9951 8.9951 9.3276 9.3276 9.4223 9.4223 9.8752 9.8752 10.3782 10.3782 10.8194 10.8194 11.0676 11.0676 11.1465 11.1465 11.2679 11.2679 11.6297 11.6297 12.2720 12.2720 12.5665 12.5665 13.7594 13.7594 15.2397 15.2397 16.6891 16.6891 k = 0.0000 0.0000 0.2339 ( 6215 PWs) bands (ev): -79.7990 -79.7990 -79.7890 -79.7890 -45.4978 -45.4978 -45.4666 -45.4666 -43.8286 -43.8286 -43.7742 -43.7742 -43.6866 -43.6866 -43.6787 -43.6787 -28.1056 -28.1056 -9.4252 -9.4252 -9.0681 -9.0681 -9.0306 -9.0306 1.7164 1.7164 5.3987 5.3987 7.0253 7.0253 8.6650 8.6650 9.0021 9.0021 9.3421 9.3421 9.4290 9.4290 9.8069 9.8069 10.3932 10.3932 10.8132 10.8132 11.0595 11.0595 11.1286 11.1286 11.2384 11.2384 11.6087 11.6087 12.2935 12.2935 12.5191 12.5191 13.6781 13.6781 15.3351 15.3351 16.7169 16.7169 k = 0.0000 0.0000 0.2519 ( 6219 PWs) bands (ev): -79.7989 -79.7989 -79.7892 -79.7892 -45.4975 -45.4975 -45.4669 -45.4669 -43.8281 -43.8281 -43.7748 -43.7748 -43.6865 -43.6865 -43.6788 -43.6788 -28.1054 -28.1054 -9.4263 -9.4263 -9.0700 -9.0700 -9.0308 -9.0308 1.7519 1.7519 5.3967 5.3967 7.0524 7.0524 8.6300 8.6300 9.0097 9.0097 9.3565 9.3565 9.4356 9.4356 9.7347 9.7347 10.4088 10.4088 10.8059 10.8059 11.0496 11.0496 11.1099 11.1099 11.2108 11.2108 11.5866 11.5866 12.3127 12.3127 12.4718 12.4718 13.5997 13.5997 15.4331 15.4331 16.7436 16.7436 k = 0.0000 0.0000 0.2699 ( 6215 PWs) bands (ev): -79.7993 -79.7993 -79.7888 -79.7888 -45.4970 -45.4970 -45.4674 -45.4674 -43.8273 -43.8273 -43.7756 -43.7756 -43.6863 -43.6863 -43.6790 -43.6790 -28.1051 -28.1051 -9.4276 -9.4276 -9.0720 -9.0720 -9.0309 -9.0309 1.7896 1.7896 5.3949 5.3949 7.0803 7.0803 8.5949 8.5949 9.0180 9.0180 9.3704 9.3704 9.4439 9.4439 9.6597 9.6597 10.4240 10.4240 10.7990 10.7990 11.0378 11.0378 11.0900 11.0900 11.1859 11.1859 11.5624 11.5624 12.3313 12.3313 12.4250 12.4250 13.5251 13.5251 15.5334 15.5334 16.7693 16.7693 k = 0.0000 0.0000 0.2879 ( 6219 PWs) bands (ev): -79.7992 -79.7992 -79.7890 -79.7890 -45.4967 -45.4967 -45.4678 -45.4678 -43.8268 -43.8268 -43.7763 -43.7763 -43.6862 -43.6862 -43.6790 -43.6790 -28.1049 -28.1049 -9.4289 -9.4289 -9.0741 -9.0741 -9.0311 -9.0311 1.8296 1.8296 5.3930 5.3930 7.1088 7.1088 8.5595 8.5595 9.0263 9.0263 9.3846 9.3846 9.4517 9.4517 9.5820 9.5820 10.4398 10.4398 10.7910 10.7910 11.0244 11.0244 11.0713 11.0713 11.1635 11.1635 11.5376 11.5376 12.3465 12.3465 12.3785 12.3785 13.4542 13.4542 15.6351 15.6351 16.7935 16.7935 k = 0.0000 0.0000 0.3059 ( 6215 PWs) bands (ev): -79.7991 -79.7991 -79.7890 -79.7890 -45.4963 -45.4963 -45.4682 -45.4682 -43.8261 -43.8261 -43.7770 -43.7770 -43.6861 -43.6861 -43.6791 -43.6791 -28.1046 -28.1046 -9.4303 -9.4303 -9.0763 -9.0763 -9.0313 -9.0313 1.8716 1.8716 5.3912 5.3912 7.1376 7.1376 8.5250 8.5250 9.0350 9.0350 9.3978 9.3978 9.4596 9.4596 9.5042 9.5042 10.4556 10.4556 10.7825 10.7825 11.0094 11.0094 11.0529 11.0529 11.1432 11.1432 11.5120 11.5120 12.3325 12.3325 12.3608 12.3608 13.3880 13.3880 15.7380 15.7380 16.7916 16.7916 k = 0.0000 0.0000 0.3239 ( 6215 PWs) bands (ev): -79.7986 -79.7986 -79.7894 -79.7894 -45.4960 -45.4960 -45.4685 -45.4685 -43.8255 -43.8255 -43.7777 -43.7777 -43.6860 -43.6860 -43.6791 -43.6791 -28.1044 -28.1044 -9.4317 -9.4317 -9.0786 -9.0786 -9.0315 -9.0315 1.9157 1.9157 5.3894 5.3894 7.1661 7.1661 8.4912 8.4912 9.0436 9.0436 9.3972 9.3972 9.4350 9.4350 9.4718 9.4718 10.4716 10.4716 10.7728 10.7728 10.9931 10.9931 11.0351 11.0351 11.1247 11.1247 11.4859 11.4859 12.2870 12.2870 12.3729 12.3729 13.3259 13.3259 15.8415 15.8415 16.7751 16.7751 k = 0.0000 0.0000 0.3419 ( 6211 PWs) bands (ev): -79.7985 -79.7985 -79.7894 -79.7894 -45.4955 -45.4955 -45.4689 -45.4689 -43.8248 -43.8248 -43.7784 -43.7784 -43.6858 -43.6858 -43.6792 -43.6792 -28.1041 -28.1041 -9.4332 -9.4332 -9.0809 -9.0809 -9.0316 -9.0316 1.9617 1.9617 5.3879 5.3879 7.1940 7.1940 8.4591 8.4591 9.0532 9.0532 9.3291 9.3291 9.4355 9.4355 9.4812 9.4812 10.4871 10.4871 10.7622 10.7622 10.9755 10.9755 11.0169 11.0169 11.1075 11.1075 11.4588 11.4588 12.2426 12.2426 12.3840 12.3840 13.2686 13.2686 15.9456 15.9456 16.7632 16.7632 k = 0.0000 0.0000 0.3599 ( 6223 PWs) bands (ev): -79.7987 -79.7987 -79.7897 -79.7897 -45.4952 -45.4952 -45.4695 -45.4695 -43.8242 -43.8242 -43.7793 -43.7793 -43.6857 -43.6857 -43.6793 -43.6793 -28.1038 -28.1038 -9.4347 -9.4347 -9.0833 -9.0833 -9.0318 -9.0318 2.0095 2.0095 5.3865 5.3865 7.2205 7.2205 8.4289 8.4289 9.0626 9.0626 9.2465 9.2465 9.4482 9.4482 9.4915 9.4915 10.5017 10.5017 10.7500 10.7500 10.9569 10.9569 10.9983 10.9983 11.0916 11.0916 11.4303 11.4303 12.1987 12.1987 12.3934 12.3934 13.2154 13.2154 16.0494 16.0494 16.7557 16.7557 k = 0.0000 0.0000 0.3778 ( 6223 PWs) bands (ev): -79.7985 -79.7985 -79.7898 -79.7898 -45.4947 -45.4947 -45.4699 -45.4699 -43.8235 -43.8235 -43.7802 -43.7802 -43.6856 -43.6856 -43.6794 -43.6794 -28.1035 -28.1035 -9.4363 -9.4363 -9.0857 -9.0857 -9.0320 -9.0320 2.0591 2.0591 5.3853 5.3853 7.2452 7.2452 8.4018 8.4018 9.0727 9.0727 9.1622 9.1622 9.4622 9.4622 9.5027 9.5027 10.5162 10.5162 10.7367 10.7367 10.9377 10.9377 10.9801 10.9801 11.0775 11.0775 11.4023 11.4023 12.1558 12.1558 12.4022 12.4022 13.1669 13.1669 16.1528 16.1528 16.7528 16.7528 k = 0.0000 0.0000 0.3958 ( 6227 PWs) bands (ev): -79.7984 -79.7984 -79.7901 -79.7901 -45.4943 -45.4943 -45.4704 -45.4704 -43.8228 -43.8228 -43.7811 -43.7811 -43.6855 -43.6855 -43.6795 -43.6795 -28.1032 -28.1032 -9.4378 -9.4378 -9.0881 -9.0881 -9.0321 -9.0321 2.1102 2.1102 5.3843 5.3843 7.2674 7.2674 8.3786 8.3786 9.0773 9.0773 9.0830 9.0830 9.4769 9.4769 9.5145 9.5145 10.5301 10.5301 10.7217 10.7217 10.9174 10.9174 10.9609 10.9609 11.0645 11.0645 11.3743 11.3743 12.1134 12.1134 12.4096 12.4096 13.1231 13.1231 16.2552 16.2552 16.7543 16.7543 k = 0.0000 0.0000 0.4138 ( 6227 PWs) bands (ev): -79.7983 -79.7983 -79.7903 -79.7903 -45.4939 -45.4939 -45.4709 -45.4709 -43.8220 -43.8220 -43.7819 -43.7819 -43.6853 -43.6853 -43.6795 -43.6795 -28.1029 -28.1029 -9.4395 -9.4395 -9.0906 -9.0906 -9.0323 -9.0323 2.1628 2.1628 5.3836 5.3836 7.2863 7.2863 8.3599 8.3599 8.9929 8.9929 9.0935 9.0935 9.4912 9.4912 9.5271 9.5271 10.5430 10.5430 10.7050 10.7050 10.8960 10.8960 10.9424 10.9424 11.0533 11.0533 11.3467 11.3467 12.0722 12.0722 12.4158 12.4158 13.0835 13.0835 16.3561 16.3561 16.7603 16.7603 k = 0.0000 0.0000 0.4318 ( 6235 PWs) bands (ev): -79.7983 -79.7983 -79.7906 -79.7906 -45.4935 -45.4935 -45.4714 -45.4714 -43.8213 -43.8213 -43.7829 -43.7829 -43.6851 -43.6851 -43.6796 -43.6796 -28.1026 -28.1026 -9.4411 -9.4411 -9.0931 -9.0931 -9.0324 -9.0324 2.2167 2.2167 5.3831 5.3831 7.3013 7.3013 8.3464 8.3464 8.9087 8.9087 9.1041 9.1041 9.5050 9.5050 9.5397 9.5397 10.5549 10.5549 10.6868 10.6868 10.8729 10.8729 10.9238 10.9238 11.0437 11.0437 11.3194 11.3194 12.0317 12.0317 12.4213 12.4213 13.0476 13.0476 16.4551 16.4551 16.7700 16.7700 k = 0.0000 0.0000 0.4498 ( 6233 PWs) bands (ev): -79.7981 -79.7981 -79.7907 -79.7907 -45.4930 -45.4930 -45.4719 -45.4719 -43.8206 -43.8206 -43.7838 -43.7838 -43.6849 -43.6849 -43.6796 -43.6796 -28.1023 -28.1023 -9.4428 -9.4428 -9.0957 -9.0957 -9.0325 -9.0325 2.2718 2.2718 5.3829 5.3829 7.3119 7.3119 8.3390 8.3390 8.8252 8.8252 9.1150 9.1150 9.5188 9.5188 9.5527 9.5527 10.5654 10.5654 10.6683 10.6683 10.8486 10.8486 10.9062 10.9062 11.0360 11.0360 11.2933 11.2933 11.9919 11.9919 12.4264 12.4264 13.0157 13.0157 16.5516 16.5516 16.7832 16.7832 k = 0.0000 0.0000 0.4678 ( 6225 PWs) bands (ev): -79.7978 -79.7978 -79.7907 -79.7907 -45.4925 -45.4925 -45.4724 -45.4724 -43.8198 -43.8198 -43.7847 -43.7847 -43.6847 -43.6847 -43.6797 -43.6797 -28.1020 -28.1020 -9.4444 -9.4444 -9.0982 -9.0982 -9.0327 -9.0327 2.3280 2.3280 5.3829 5.3829 7.3176 7.3176 8.3381 8.3381 8.7428 8.7428 9.1264 9.1264 9.5328 9.5328 9.5659 9.5659 10.5743 10.5743 10.6494 10.6494 10.8230 10.8230 10.8896 10.8896 11.0298 11.0298 11.2680 11.2680 11.9532 11.9532 12.4315 12.4315 12.9874 12.9874 16.6454 16.6454 16.7988 16.7988 k = 0.0000 0.0000 0.4858 ( 6229 PWs) bands (ev): -79.7978 -79.7978 -79.7909 -79.7909 -45.4920 -45.4920 -45.4729 -45.4729 -43.8191 -43.8191 -43.7857 -43.7857 -43.6845 -43.6845 -43.6797 -43.6797 -28.1017 -28.1017 -9.4461 -9.4461 -9.1007 -9.1007 -9.0328 -9.0328 2.3850 2.3850 5.3832 5.3832 7.3183 7.3183 8.3438 8.3438 8.6615 8.6615 9.1373 9.1373 9.5459 9.5459 9.5790 9.5790 10.5811 10.5811 10.6293 10.6293 10.7954 10.7954 10.8727 10.8727 11.0248 11.0248 11.2445 11.2445 11.9149 11.9149 12.4354 12.4354 12.9618 12.9618 16.7356 16.7356 16.8159 16.8159 k = 0.0000 0.0000 0.5038 ( 6225 PWs) bands (ev): -79.7977 -79.7977 -79.7909 -79.7909 -45.4915 -45.4915 -45.4735 -45.4735 -43.8183 -43.8183 -43.7867 -43.7867 -43.6842 -43.6842 -43.6798 -43.6798 -28.1013 -28.1013 -9.4478 -9.4478 -9.1032 -9.1032 -9.0329 -9.0329 2.4427 2.4427 5.3839 5.3839 7.3142 7.3142 8.3559 8.3559 8.5815 8.5815 9.1488 9.1488 9.5587 9.5587 9.5922 9.5922 10.5855 10.5855 10.6095 10.6095 10.7665 10.7665 10.8574 10.8574 11.0213 11.0213 11.2232 11.2232 11.8777 11.8777 12.4389 12.4389 12.9387 12.9387 16.8222 16.8222 16.8324 16.8324 k = 0.0000 0.0000 0.5218 ( 6225 PWs) bands (ev): -79.7974 -79.7974 -79.7912 -79.7912 -45.4911 -45.4911 -45.4739 -45.4739 -43.8176 -43.8176 -43.7876 -43.7876 -43.6840 -43.6840 -43.6798 -43.6798 -28.1010 -28.1010 -9.4494 -9.4494 -9.1057 -9.1057 -9.0330 -9.0330 2.5010 2.5010 5.3848 5.3848 7.3057 7.3057 8.3745 8.3745 8.5032 8.5032 9.1598 9.1598 9.5712 9.5712 9.6051 9.6051 10.5848 10.5848 10.5903 10.5903 10.7365 10.7365 10.8431 10.8431 11.0196 11.0196 11.2047 11.2047 11.8408 11.8408 12.4413 12.4413 12.9178 12.9178 16.8445 16.8445 16.9044 16.9044 k = 0.0000 0.0000 0.5398 ( 6205 PWs) bands (ev): -79.7965 -79.7965 -79.7913 -79.7913 -45.4907 -45.4907 -45.4742 -45.4742 -43.8168 -43.8168 -43.7884 -43.7884 -43.6838 -43.6838 -43.6797 -43.6797 -28.1007 -28.1007 -9.4511 -9.4511 -9.1082 -9.1082 -9.0330 -9.0330 2.5597 2.5597 5.3861 5.3861 7.2936 7.2936 8.3985 8.3985 8.4274 8.4274 9.1709 9.1709 9.5838 9.5838 9.6182 9.6182 10.5656 10.5656 10.5871 10.5871 10.7065 10.7065 10.8309 10.8309 11.0191 11.0191 11.1901 11.1901 11.8047 11.8047 12.4437 12.4437 12.8996 12.8996 16.8466 16.8466 16.9011 16.9011 k = 0.0000 0.0000 0.5578 ( 6193 PWs) bands (ev): -79.7962 -79.7962 -79.7912 -79.7912 -45.4901 -45.4901 -45.4747 -45.4747 -43.8160 -43.8160 -43.7894 -43.7894 -43.6836 -43.6836 -43.6797 -43.6797 -28.1004 -28.1004 -9.4527 -9.4527 -9.1106 -9.1106 -9.0331 -9.0331 2.6185 2.6185 5.3876 5.3876 7.2783 7.2783 8.3512 8.3512 8.4294 8.4294 9.1821 9.1821 9.5955 9.5955 9.6307 9.6307 10.5449 10.5449 10.5824 10.5824 10.6751 10.6751 10.8190 10.8190 11.0188 11.0188 11.1782 11.1782 11.7694 11.7694 12.4462 12.4462 12.8813 12.8813 16.7638 16.7638 16.8340 16.8340 k = 0.0000 0.0000 0.5758 ( 6193 PWs) bands (ev): -79.7962 -79.7962 -79.7912 -79.7912 -45.4896 -45.4896 -45.4753 -45.4753 -43.8153 -43.8153 -43.7904 -43.7904 -43.6833 -43.6833 -43.6797 -43.6797 -28.1001 -28.1001 -9.4543 -9.4543 -9.1130 -9.1130 -9.0332 -9.0332 2.6773 2.6773 5.3895 5.3895 7.2607 7.2607 8.2788 8.2788 8.4631 8.4631 9.1928 9.1928 9.6063 9.6063 9.6426 9.6426 10.5234 10.5234 10.5741 10.5741 10.6432 10.6432 10.8067 10.8067 11.0191 11.0191 11.1698 11.1698 11.7342 11.7342 12.4480 12.4480 12.8631 12.8631 16.6375 16.6375 16.7956 16.7956 k = 0.0000 0.0000 0.5938 ( 6183 PWs) bands (ev): -79.7957 -79.7957 -79.7913 -79.7913 -45.4891 -45.4891 -45.4757 -45.4757 -43.8145 -43.8145 -43.7912 -43.7912 -43.6831 -43.6831 -43.6796 -43.6796 -28.0998 -28.0998 -9.4559 -9.4559 -9.1153 -9.1153 -9.0332 -9.0332 2.7358 2.7358 5.3915 5.3915 7.2417 7.2417 8.2081 8.2081 8.5007 8.5007 9.2034 9.2034 9.6167 9.6167 9.6543 9.6543 10.5019 10.5019 10.5622 10.5622 10.6113 10.6113 10.7969 10.7969 11.0212 11.0212 11.1654 11.1654 11.6997 11.6997 12.4493 12.4493 12.8454 12.8454 16.5210 16.5210 16.7333 16.7333 k = 0.0000 0.0000 0.6118 ( 6191 PWs) bands (ev): -79.7956 -79.7956 -79.7917 -79.7917 -45.4888 -45.4888 -45.4762 -45.4762 -43.8139 -43.8139 -43.7922 -43.7922 -43.6829 -43.6829 -43.6797 -43.6797 -28.0995 -28.0995 -9.4575 -9.4575 -9.1176 -9.1176 -9.0332 -9.0332 2.7938 2.7938 5.3938 5.3938 7.2218 7.2218 8.1397 8.1397 8.5411 8.5411 9.2134 9.2134 9.6259 9.6259 9.6652 9.6652 10.4805 10.4805 10.5462 10.5462 10.5793 10.5793 10.7871 10.7871 11.0226 11.0226 11.1642 11.1642 11.6647 11.6647 12.4499 12.4499 12.8273 12.8273 16.4144 16.4144 16.6517 16.6518 k = 0.0000 0.0000 0.6297 ( 6191 PWs) bands (ev): -79.7954 -79.7954 -79.7919 -79.7919 -45.4883 -45.4883 -45.4767 -45.4767 -43.8132 -43.8132 -43.7931 -43.7931 -43.6827 -43.6827 -43.6797 -43.6797 -28.0992 -28.0992 -9.4590 -9.4590 -9.1198 -9.1198 -9.0333 -9.0333 2.8512 2.8512 5.3963 5.3963 7.2018 7.2018 8.0736 8.0736 8.5838 8.5838 9.2234 9.2234 9.6339 9.6339 9.6760 9.6760 10.4591 10.4591 10.5258 10.5258 10.5487 10.5487 10.7788 10.7788 11.0247 11.0247 11.1671 11.1671 11.6310 11.6310 12.4507 12.4507 12.8077 12.8077 16.3186 16.3186 16.5585 16.5585 k = 0.0000 0.0000 0.6477 ( 6187 PWs) bands (ev): -79.7953 -79.7953 -79.7919 -79.7919 -45.4879 -45.4879 -45.4772 -45.4772 -43.8125 -43.8125 -43.7940 -43.7940 -43.6824 -43.6824 -43.6797 -43.6797 -28.0989 -28.0989 -9.4605 -9.4605 -9.1219 -9.1219 -9.0333 -9.0333 2.9077 2.9077 5.3991 5.3991 7.1824 7.1824 8.0098 8.0098 8.6281 8.6281 9.2333 9.2333 9.6406 9.6406 9.6868 9.6868 10.4379 10.4379 10.5007 10.5007 10.5206 10.5206 10.7721 10.7721 11.0274 11.0274 11.1737 11.1737 11.5980 11.5980 12.4514 12.4514 12.7867 12.7867 16.2342 16.2342 16.4588 16.4588 k = 0.0000 0.0000 0.6657 ( 6183 PWs) bands (ev): -79.7950 -79.7950 -79.7920 -79.7920 -45.4874 -45.4874 -45.4776 -45.4776 -43.8119 -43.8119 -43.7949 -43.7949 -43.6822 -43.6822 -43.6797 -43.6797 -28.0986 -28.0986 -9.4619 -9.4619 -9.1240 -9.1240 -9.0333 -9.0333 2.9631 2.9631 5.4021 5.4021 7.1638 7.1638 7.9486 7.9486 8.6736 8.6736 9.2428 9.2428 9.6460 9.6460 9.6973 9.6973 10.4164 10.4164 10.4719 10.4719 10.4944 10.4944 10.7670 10.7670 11.0305 11.0305 11.1834 11.1834 11.5653 11.5653 12.4519 12.4519 12.7640 12.7640 16.1618 16.1618 16.3564 16.3564 k = 0.0000 0.0000 0.6837 ( 6181 PWs) bands (ev): -79.7948 -79.7948 -79.7921 -79.7921 -45.4870 -45.4870 -45.4780 -45.4780 -43.8112 -43.8112 -43.7957 -43.7957 -43.6820 -43.6820 -43.6797 -43.6797 -28.0983 -28.0983 -9.4633 -9.4633 -9.1260 -9.1260 -9.0333 -9.0333 3.0171 3.0171 5.4053 5.4053 7.1466 7.1466 7.8899 7.8899 8.7197 8.7197 9.2517 9.2517 9.6498 9.6498 9.7080 9.7080 10.3942 10.3942 10.4421 10.4421 10.4684 10.4684 10.7628 10.7628 11.0345 11.0345 11.1959 11.1959 11.5325 11.5325 12.4518 12.4518 12.7395 12.7395 16.1016 16.1016 16.2532 16.2532 k = 0.0000 0.0000 0.7017 ( 6179 PWs) bands (ev): -79.7945 -79.7945 -79.7924 -79.7924 -45.4867 -45.4867 -45.4784 -45.4784 -43.8107 -43.8107 -43.7966 -43.7966 -43.6818 -43.6818 -43.6796 -43.6796 -28.0980 -28.0980 -9.4646 -9.4646 -9.1279 -9.1279 -9.0333 -9.0333 3.0695 3.0695 5.4085 5.4085 7.1312 7.1312 7.8338 7.8338 8.7662 8.7662 9.2603 9.2603 9.6523 9.6523 9.7184 9.7184 10.3708 10.3708 10.4132 10.4132 10.4420 10.4420 10.7600 10.7600 11.0379 11.0379 11.2108 11.2108 11.5004 11.5004 12.4515 12.4515 12.7136 12.7136 16.0536 16.0536 16.1513 16.1513 k = 0.0000 0.0000 0.7197 ( 6173 PWs) bands (ev): -79.7943 -79.7943 -79.7924 -79.7924 -45.4863 -45.4863 -45.4788 -45.4788 -43.8101 -43.8101 -43.7974 -43.7974 -43.6815 -43.6815 -43.6796 -43.6796 -28.0978 -28.0978 -9.4659 -9.4659 -9.1298 -9.1298 -9.0333 -9.0333 3.1202 3.1202 5.4119 5.4119 7.1176 7.1176 7.7805 7.7805 8.8121 8.8121 9.2687 9.2687 9.6532 9.6532 9.7289 9.7289 10.3461 10.3461 10.3859 10.3859 10.4156 10.4156 10.7590 10.7590 11.0412 11.0412 11.2276 11.2276 11.4691 11.4691 12.4519 12.4519 12.6850 12.6850 16.0173 16.0173 16.0520 16.0520 k = 0.0000 0.0000 0.7377 ( 6169 PWs) bands (ev): -79.7941 -79.7941 -79.7923 -79.7923 -45.4859 -45.4859 -45.4792 -45.4792 -43.8095 -43.8095 -43.7981 -43.7981 -43.6812 -43.6812 -43.6795 -43.6795 -28.0975 -28.0975 -9.4672 -9.4672 -9.1315 -9.1315 -9.0333 -9.0333 3.1689 3.1689 5.4153 5.4153 7.1062 7.1062 7.7299 7.7299 8.8574 8.8574 9.2765 9.2765 9.6527 9.6527 9.7393 9.7393 10.3192 10.3192 10.3604 10.3604 10.3900 10.3900 10.7595 10.7595 11.0445 11.0445 11.2460 11.2460 11.4383 11.4383 12.4521 12.4521 12.6547 12.6547 15.9512 15.9512 15.9975 15.9975 k = 0.0000 0.0000 0.7557 ( 6167 PWs) bands (ev): -79.7938 -79.7938 -79.7926 -79.7926 -45.4856 -45.4856 -45.4796 -45.4796 -43.8090 -43.8090 -43.7988 -43.7988 -43.6811 -43.6811 -43.6795 -43.6795 -28.0973 -28.0973 -9.4683 -9.4683 -9.1332 -9.1332 -9.0333 -9.0333 3.2154 3.2154 5.4188 5.4188 7.0972 7.0972 7.6821 7.6821 8.9016 8.9016 9.2837 9.2837 9.6514 9.6514 9.7497 9.7497 10.2906 10.2906 10.3354 10.3354 10.3660 10.3660 10.7609 10.7609 11.0477 11.0477 11.2655 11.2655 11.4071 11.4071 12.4514 12.4514 12.6243 12.6243 15.8574 15.8574 15.9862 15.9862 k = 0.0000 0.0000 0.7737 ( 6167 PWs) bands (ev): -79.7939 -79.7939 -79.7925 -79.7925 -45.4852 -45.4852 -45.4800 -45.4800 -43.8084 -43.8084 -43.7996 -43.7996 -43.6809 -43.6809 -43.6795 -43.6795 -28.0971 -28.0971 -9.4694 -9.4694 -9.1348 -9.1348 -9.0333 -9.0333 3.2596 3.2596 5.4223 5.4223 7.0903 7.0903 7.6372 7.6372 8.9441 8.9441 9.2904 9.2904 9.6487 9.6487 9.7607 9.7607 10.2610 10.2610 10.3099 10.3099 10.3450 10.3450 10.7635 10.7635 11.0507 11.0507 11.2862 11.2862 11.3768 11.3768 12.4509 12.4509 12.5913 12.5913 15.7666 15.7666 15.9874 15.9874 k = 0.0000 0.0000 0.7917 ( 6161 PWs) bands (ev): -79.7937 -79.7937 -79.7925 -79.7925 -45.4848 -45.4848 -45.4803 -45.4803 -43.8079 -43.8079 -43.8002 -43.8002 -43.6806 -43.6806 -43.6795 -43.6795 -28.0968 -28.0968 -9.4705 -9.4705 -9.1362 -9.1362 -9.0333 -9.0333 3.3012 3.3012 5.4257 5.4257 7.0856 7.0856 7.5953 7.5953 8.9848 8.9848 9.2969 9.2969 9.6456 9.6456 9.7711 9.7711 10.2313 10.2313 10.2832 10.2832 10.3266 10.3266 10.7689 10.7689 11.0536 11.0536 11.3062 11.3062 11.3484 11.3484 12.4506 12.4506 12.5585 12.5585 15.6797 15.6797 16.0003 16.0003 k = 0.0000 0.0000 0.8097 ( 6169 PWs) bands (ev): -79.7939 -79.7939 -79.7926 -79.7926 -45.4845 -45.4845 -45.4808 -45.4808 -43.8075 -43.8075 -43.8009 -43.8009 -43.6804 -43.6804 -43.6796 -43.6796 -28.0967 -28.0967 -9.4714 -9.4714 -9.1376 -9.1376 -9.0332 -9.0332 3.3401 3.3401 5.4290 5.4290 7.0829 7.0829 7.5562 7.5562 9.0227 9.0227 9.3026 9.3026 9.6420 9.6420 9.7816 9.7816 10.2015 10.2015 10.2556 10.2556 10.3105 10.3105 10.7747 10.7747 11.0565 11.0565 11.3119 11.3119 11.3345 11.3345 12.4500 12.4500 12.5240 12.5240 15.5971 15.5971 16.0238 16.0238 k = 0.0000 0.0000 0.8277 ( 6169 PWs) bands (ev): -79.7938 -79.7938 -79.7926 -79.7926 -45.4843 -45.4843 -45.4811 -45.4811 -43.8071 -43.8071 -43.8015 -43.8015 -43.6803 -43.6803 -43.6795 -43.6795 -28.0965 -28.0965 -9.4724 -9.4724 -9.1389 -9.1389 -9.0332 -9.0332 3.3762 3.3762 5.4322 5.4322 7.0824 7.0824 7.5202 7.5202 9.0578 9.0578 9.3079 9.3079 9.6389 9.6389 9.7926 9.7926 10.1719 10.1719 10.2281 10.2281 10.2963 10.2963 10.7821 10.7821 11.0592 11.0592 11.2865 11.2865 11.3525 11.3525 12.4491 12.4491 12.4917 12.4917 15.5198 15.5198 16.0575 16.0575 k = 0.0000 0.0000 0.8457 ( 6161 PWs) bands (ev): -79.7934 -79.7934 -79.7927 -79.7927 -45.4840 -45.4840 -45.4813 -45.4813 -43.8067 -43.8067 -43.8020 -43.8020 -43.6801 -43.6801 -43.6795 -43.6795 -28.0963 -28.0963 -9.4732 -9.4732 -9.1400 -9.1400 -9.0332 -9.0332 3.4095 3.4095 5.4354 5.4354 7.0838 7.0838 7.4872 7.4872 9.0896 9.0896 9.3129 9.3129 9.6370 9.6370 9.8042 9.8042 10.1429 10.1429 10.2010 10.2010 10.2835 10.2835 10.7915 10.7915 11.0618 11.0618 11.2589 11.2589 11.3732 11.3732 12.4454 12.4454 12.4632 12.4632 15.4482 15.4482 16.1006 16.1006 k = 0.0000 0.0000 0.8637 ( 6159 PWs) bands (ev): -79.7932 -79.7932 -79.7929 -79.7929 -45.4838 -45.4838 -45.4815 -45.4815 -43.8064 -43.8064 -43.8025 -43.8025 -43.6799 -43.6799 -43.6794 -43.6794 -28.0961 -28.0961 -9.4739 -9.4739 -9.1411 -9.1411 -9.0332 -9.0332 3.4397 3.4397 5.4383 5.4383 7.0865 7.0865 7.4572 7.4572 9.1174 9.1174 9.3174 9.3174 9.6365 9.6365 9.8156 9.8156 10.1145 10.1145 10.1741 10.1741 10.2721 10.2721 10.8020 10.8020 11.0649 11.0649 11.2315 11.2315 11.3931 11.3931 12.4252 12.4252 12.4526 12.4526 15.3817 15.3817 16.1524 16.1524 k = 0.0000 0.0000 0.8816 ( 6161 PWs) bands (ev): -79.7932 -79.7932 -79.7930 -79.7930 -45.4836 -45.4836 -45.4818 -45.4818 -43.8061 -43.8061 -43.8030 -43.8030 -43.6798 -43.6798 -43.6794 -43.6794 -28.0960 -28.0960 -9.4746 -9.4746 -9.1421 -9.1421 -9.0331 -9.0331 3.4668 3.4668 5.4410 5.4410 7.0904 7.0904 7.4303 7.4303 9.1411 9.1411 9.3212 9.3212 9.6381 9.6381 9.8275 9.8275 10.0866 10.0866 10.1479 10.1479 10.2621 10.2621 10.8129 10.8129 11.0669 11.0669 11.2045 11.2045 11.4123 11.4123 12.3981 12.3981 12.4509 12.4509 15.3209 15.3209 16.2115 16.2115 k = 0.0000 0.0000 0.8996 ( 6169 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4835 -45.4835 -45.4820 -45.4820 -43.8059 -43.8059 -43.8034 -43.8034 -43.6797 -43.6797 -43.6795 -43.6795 -28.0959 -28.0959 -9.4752 -9.4752 -9.1429 -9.1429 -9.0331 -9.0331 3.4908 3.4908 5.4435 5.4435 7.0952 7.0952 7.4065 7.4065 9.1602 9.1602 9.3245 9.3245 9.6423 9.6423 9.8393 9.8393 10.0593 10.0593 10.1225 10.1225 10.2535 10.2535 10.8248 10.8248 11.0685 11.0685 11.1781 11.1781 11.4297 11.4297 12.3722 12.3722 12.4496 12.4496 15.2664 15.2664 16.2771 16.2771 k = 0.0000 0.0000 0.9176 ( 6165 PWs) bands (ev): -79.7932 -79.7932 -79.7931 -79.7931 -45.4833 -45.4833 -45.4822 -45.4822 -43.8057 -43.8057 -43.8037 -43.8037 -43.6796 -43.6796 -43.6795 -43.6795 -28.0958 -28.0958 -9.4757 -9.4757 -9.1436 -9.1436 -9.0331 -9.0331 3.5117 3.5117 5.4457 5.4457 7.1005 7.1005 7.3858 7.3858 9.1753 9.1753 9.3275 9.3275 9.6490 9.6490 9.8520 9.8520 10.0333 10.0333 10.0985 10.0985 10.2459 10.2459 10.8379 10.8379 11.0701 11.0701 11.1535 11.1535 11.4459 11.4459 12.3497 12.3497 12.4492 12.4492 15.2188 15.2188 16.3478 16.3478 k = 0.0000 0.0000 0.9356 ( 6158 PWs) bands (ev): -79.7931 -79.7931 -79.7930 -79.7930 -45.4831 -45.4831 -45.4823 -45.4823 -43.8054 -43.8054 -43.8040 -43.8040 -43.6795 -43.6795 -43.6794 -43.6794 -28.0957 -28.0957 -9.4762 -9.4762 -9.1443 -9.1443 -9.0331 -9.0331 3.5294 3.5294 5.4476 5.4476 7.1059 7.1059 7.3685 7.3685 9.1863 9.1863 9.3298 9.3298 9.6581 9.6581 9.8656 9.8656 10.0086 10.0086 10.0760 10.0760 10.2396 10.2396 10.8510 10.8510 11.0713 11.0713 11.1304 11.1304 11.4605 11.4605 12.3300 12.3300 12.4496 12.4496 15.1778 15.1778 16.4217 16.4217 k = 0.0000 0.0000 0.9536 ( 6158 PWs) bands (ev): -79.7931 -79.7931 -79.7930 -79.7930 -45.4830 -45.4830 -45.4825 -45.4825 -43.8052 -43.8052 -43.8043 -43.8043 -43.6794 -43.6794 -43.6793 -43.6793 -28.0956 -28.0956 -9.4765 -9.4765 -9.1448 -9.1448 -9.0331 -9.0331 3.5438 3.5438 5.4492 5.4492 7.1108 7.1108 7.3542 7.3542 9.1940 9.1940 9.3318 9.3318 9.6684 9.6684 9.8788 9.8788 9.9860 9.9860 10.0549 10.0549 10.2344 10.2344 10.8642 10.8642 11.0720 11.0720 11.1095 11.1095 11.4726 11.4726 12.3133 12.3133 12.4494 12.4494 15.1439 15.1439 16.4968 16.4968 k = 0.0000 0.0000 0.9716 ( 6158 PWs) bands (ev): -79.7930 -79.7930 -79.7930 -79.7930 -45.4829 -45.4829 -45.4826 -45.4826 -43.8051 -43.8051 -43.8044 -43.8044 -43.6794 -43.6794 -43.6793 -43.6793 -28.0955 -28.0955 -9.4768 -9.4768 -9.1452 -9.1452 -9.0331 -9.0331 3.5551 3.5551 5.4505 5.4505 7.1151 7.1151 7.3430 7.3430 9.1989 9.1989 9.3333 9.3333 9.6791 9.6791 9.8921 9.8921 9.9661 9.9661 10.0358 10.0358 10.2304 10.2304 10.8766 10.8766 11.0716 11.0716 11.0918 11.0918 11.4823 11.4823 12.3001 12.3001 12.4491 12.4491 15.1174 15.1174 16.5692 16.5692 k = 0.0000 0.0000 0.9896 ( 6148 PWs) bands (ev): -79.7931 -79.7931 -79.7926 -79.7926 -45.4827 -45.4827 -45.4827 -45.4827 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6791 -43.6791 -28.0955 -28.0955 -9.4770 -9.4770 -9.1454 -9.1454 -9.0330 -9.0330 3.5631 3.5631 5.4514 5.4514 7.1183 7.1183 7.3351 7.3351 9.2019 9.2019 9.3342 9.3342 9.6893 9.6893 9.9052 9.9052 9.9496 9.9496 10.0198 10.0198 10.2277 10.2277 10.8871 10.8871 11.0686 11.0686 11.0817 11.0817 11.4896 11.4896 12.2905 12.2905 12.4497 12.4497 15.0982 15.0982 16.6331 16.6331 k = 0.0000 0.0000 1.0076 ( 6156 PWs) bands (ev): -79.7930 -79.7930 -79.7929 -79.7929 -45.4828 -45.4828 -45.4827 -45.4827 -43.8049 -43.8049 -43.8047 -43.8047 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1456 -9.1456 -9.0330 -9.0330 3.5679 3.5679 5.4520 5.4520 7.1204 7.1204 7.3303 7.3303 9.2034 9.2034 9.3350 9.3350 9.6959 9.6959 9.9159 9.9159 9.9372 9.9372 10.0083 10.0083 10.2250 10.2250 10.8947 10.8947 11.0611 11.0611 11.0785 11.0785 11.4933 11.4933 12.2848 12.2848 12.4488 12.4488 15.0867 15.0867 16.6801 16.6801 k = 0.0000 0.0000 1.0256 ( 6154 PWs) bands (ev): -79.7930 -79.7930 -79.7929 -79.7929 -45.4827 -45.4827 -45.4827 -45.4827 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5695 3.5695 5.4521 5.4521 7.1211 7.1211 7.3287 7.3287 9.2039 9.2039 9.3354 9.3354 9.6982 9.6982 9.9233 9.9233 9.9294 9.9294 10.0039 10.0039 10.2248 10.2248 10.8981 10.8981 11.0578 11.0578 11.0779 11.0779 11.4946 11.4946 12.2831 12.2831 12.4491 12.4491 15.0827 15.0827 16.6978 16.6978 k = 0.0000 0.0000 1.0256 ( 6154 PWs) bands (ev): -79.7930 -79.7930 -79.7929 -79.7929 -45.4827 -45.4827 -45.4827 -45.4827 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5695 3.5695 5.4521 5.4521 7.1211 7.1211 7.3287 7.3287 9.2039 9.2039 9.3354 9.3354 9.6982 9.6982 9.9233 9.9233 9.9294 9.9294 10.0039 10.0039 10.2248 10.2248 10.8981 10.8981 11.0578 11.0578 11.0779 11.0779 11.4946 11.4946 12.2831 12.2831 12.4491 12.4491 15.0827 15.0827 16.6978 16.6978 k =-0.0087 0.0155 1.0256 ( 6160 PWs) bands (ev): -79.7931 -79.7931 -79.7929 -79.7929 -45.4828 -45.4828 -45.4827 -45.4827 -43.8049 -43.8049 -43.8047 -43.8047 -43.6795 -43.6795 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1456 -9.1456 -9.0330 -9.0330 3.5696 3.5696 5.4470 5.4470 7.1225 7.1225 7.3333 7.3333 9.1994 9.1994 9.3357 9.3357 9.6994 9.6994 9.9227 9.9227 9.9295 9.9295 10.0034 10.0034 10.2244 10.2244 10.9004 10.9004 11.0571 11.0571 11.0733 11.0733 11.5018 11.5018 12.2828 12.2828 12.4515 12.4515 15.0826 15.0826 16.6954 16.6954 k =-0.0173 0.0310 1.0256 ( 6154 PWs) bands (ev): -79.7930 -79.7930 -79.7929 -79.7929 -45.4827 -45.4827 -45.4827 -45.4827 -43.8048 -43.8048 -43.8048 -43.8048 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4770 -9.4770 -9.1454 -9.1454 -9.0331 -9.0331 3.5699 3.5699 5.4319 5.4319 7.1266 7.1266 7.3463 7.3463 9.1862 9.1862 9.3373 9.3373 9.7013 9.7013 9.9218 9.9218 9.9320 9.9320 10.0030 10.0030 10.2233 10.2233 10.9107 10.9107 11.0524 11.0524 11.0644 11.0644 11.5226 11.5226 12.2829 12.2829 12.4579 12.4579 15.0825 15.0825 16.6905 16.6905 k =-0.0260 0.0465 1.0256 ( 6160 PWs) bands (ev): -79.7933 -79.7933 -79.7928 -79.7928 -45.4828 -45.4828 -45.4827 -45.4827 -43.8048 -43.8048 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4768 -9.4768 -9.1452 -9.1452 -9.0331 -9.0331 3.5703 3.5703 5.4072 5.4072 7.1334 7.1334 7.3676 7.3676 9.1657 9.1657 9.3389 9.3389 9.7052 9.7052 9.9192 9.9192 9.9348 9.9348 10.0014 10.0014 10.2211 10.2211 10.9271 10.9271 11.0349 11.0349 11.0602 11.0602 11.5536 11.5536 12.2831 12.2831 12.4687 12.4687 15.0818 15.0818 16.6822 16.6822 k =-0.0346 0.0620 1.0256 ( 6148 PWs) bands (ev): -79.7929 -79.7929 -79.7928 -79.7928 -45.4829 -45.4829 -45.4825 -45.4825 -43.8049 -43.8049 -43.8044 -43.8044 -43.6795 -43.6795 -43.6792 -43.6792 -28.0956 -28.0956 -9.4766 -9.4766 -9.1448 -9.1448 -9.0332 -9.0332 3.5708 3.5708 5.3737 5.3737 7.1429 7.1429 7.3967 7.3967 9.1391 9.1391 9.3397 9.3397 9.7117 9.7117 9.9171 9.9171 9.9383 9.9383 9.9993 9.9993 10.2191 10.2191 10.9466 10.9466 11.0138 11.0138 11.0600 11.0600 11.5936 11.5936 12.2832 12.2832 12.4853 12.4853 15.0808 15.0808 16.6707 16.6707 k =-0.0433 0.0776 1.0256 ( 6152 PWs) bands (ev): -79.7931 -79.7931 -79.7927 -79.7927 -45.4830 -45.4830 -45.4824 -45.4824 -43.8051 -43.8051 -43.8042 -43.8042 -43.6796 -43.6796 -43.6792 -43.6792 -28.0957 -28.0957 -9.4762 -9.4762 -9.1443 -9.1443 -9.0332 -9.0332 3.5715 3.5715 5.3323 5.3323 7.1552 7.1552 7.4321 7.4321 9.1074 9.1074 9.3393 9.3393 9.7196 9.7196 9.9132 9.9132 9.9421 9.9421 9.9970 9.9970 10.2154 10.2154 10.9559 10.9559 11.0060 11.0060 11.0589 11.0589 11.6392 11.6392 12.2834 12.2834 12.5051 12.5051 15.0797 15.0797 16.6564 16.6564 k =-0.0520 0.0931 1.0256 ( 6156 PWs) bands (ev): -79.7931 -79.7931 -79.7928 -79.7928 -45.4831 -45.4831 -45.4822 -45.4822 -43.8053 -43.8053 -43.8039 -43.8039 -43.6797 -43.6797 -43.6792 -43.6792 -28.0957 -28.0957 -9.4758 -9.4758 -9.1437 -9.1437 -9.0333 -9.0333 3.5722 3.5722 5.2840 5.2840 7.1701 7.1701 7.4731 7.4731 9.0715 9.0715 9.3375 9.3375 9.7291 9.7291 9.9091 9.9091 9.9458 9.9458 9.9946 9.9946 10.2111 10.2111 10.9379 10.9379 11.0297 11.0297 11.0580 11.0580 11.6898 11.6898 12.2836 12.2836 12.5296 12.5296 15.0783 15.0783 16.6394 16.6394 k =-0.0606 0.1086 1.0256 ( 6166 PWs) bands (ev): -79.7932 -79.7932 -79.7931 -79.7931 -45.4834 -45.4834 -45.4821 -45.4821 -43.8056 -43.8056 -43.8036 -43.8036 -43.6799 -43.6799 -43.6792 -43.6792 -28.0959 -28.0959 -9.4753 -9.4753 -9.1429 -9.1429 -9.0334 -9.0334 3.5728 3.5728 5.2298 5.2298 7.1877 7.1877 7.5184 7.5184 9.0320 9.0320 9.3346 9.3346 9.7400 9.7400 9.9040 9.9040 9.9486 9.9486 9.9929 9.9929 10.2060 10.2060 10.9106 10.9106 11.0556 11.0556 11.0689 11.0689 11.7439 11.7439 12.2832 12.2832 12.5581 12.5581 15.0768 15.0768 16.6197 16.6197 k =-0.0693 0.1241 1.0256 ( 6172 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4836 -45.4836 -45.4818 -45.4818 -43.8059 -43.8059 -43.8032 -43.8032 -43.6801 -43.6801 -43.6793 -43.6793 -28.0960 -28.0960 -9.4747 -9.4747 -9.1421 -9.1421 -9.0336 -9.0336 3.5735 3.5735 5.1707 5.1707 7.2079 7.2079 7.5673 7.5673 8.9896 8.9896 9.3305 9.3305 9.7523 9.7523 9.8979 9.8979 9.9498 9.9498 9.9933 9.9933 10.2003 10.2003 10.8830 10.8830 11.0549 11.0549 11.1129 11.1129 11.8011 11.8011 12.2831 12.2831 12.5920 12.5920 15.0753 15.0753 16.5987 16.5987 k =-0.0779 0.1396 1.0256 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4839 -45.4839 -45.4817 -45.4817 -43.8063 -43.8063 -43.8028 -43.8028 -43.6802 -43.6802 -43.6793 -43.6793 -28.0961 -28.0961 -9.4741 -9.4741 -9.1412 -9.1412 -9.0337 -9.0337 3.5739 3.5739 5.1074 5.1074 7.2308 7.2308 7.6187 7.6187 8.9448 8.9448 9.3257 9.3257 9.7653 9.7653 9.8908 9.8908 9.9479 9.9479 9.9965 9.9965 10.1938 10.1938 10.8570 10.8570 11.0534 11.0534 11.1624 11.1624 11.8612 11.8612 12.2833 12.2833 12.6304 12.6304 15.0738 15.0738 16.5756 16.5756 k =-0.0779 0.1396 1.0256 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4839 -45.4839 -45.4817 -45.4817 -43.8063 -43.8063 -43.8028 -43.8028 -43.6802 -43.6802 -43.6793 -43.6793 -28.0961 -28.0961 -9.4741 -9.4741 -9.1412 -9.1412 -9.0337 -9.0337 3.5739 3.5739 5.1074 5.1074 7.2308 7.2308 7.6187 7.6187 8.9448 8.9448 9.3257 9.3257 9.7653 9.7653 9.8908 9.8908 9.9479 9.9479 9.9965 9.9965 10.1938 10.1938 10.8570 10.8570 11.0534 11.0534 11.1624 11.1624 11.8612 11.8612 12.2833 12.2833 12.6304 12.6304 15.0738 15.0738 16.5756 16.5756 k =-0.0842 0.1507 1.0129 ( 6186 PWs) bands (ev): -79.7937 -79.7937 -79.7933 -79.7933 -45.4840 -45.4840 -45.4815 -45.4815 -43.8065 -43.8065 -43.8025 -43.8025 -43.6803 -43.6803 -43.6793 -43.6793 -28.0962 -28.0962 -9.4736 -9.4736 -9.1404 -9.1404 -9.0338 -9.0338 3.5734 3.5734 5.0601 5.0601 7.2480 7.2480 7.6573 7.6573 8.9122 8.9122 9.3213 9.3213 9.7746 9.7746 9.8843 9.8843 9.9459 9.9459 10.0025 10.0025 10.1885 10.1885 10.8394 10.8394 11.0501 11.0501 11.2021 11.2021 11.9050 11.9050 12.2851 12.2851 12.6610 12.6610 15.0744 15.0744 16.5536 16.5536 k =-0.0904 0.1618 1.0001 ( 6188 PWs) bands (ev): -79.7937 -79.7937 -79.7934 -79.7934 -45.4842 -45.4842 -45.4813 -45.4813 -43.8067 -43.8067 -43.8021 -43.8021 -43.6805 -43.6805 -43.6794 -43.6794 -28.0963 -28.0963 -9.4730 -9.4730 -9.1395 -9.1395 -9.0339 -9.0339 3.5715 3.5715 5.0118 5.0118 7.2648 7.2648 7.6977 7.6977 8.8803 8.8803 9.3153 9.3153 9.7825 9.7825 9.8762 9.8762 9.9444 9.9444 10.0133 10.0133 10.1839 10.1839 10.8229 10.8229 11.0457 11.0457 11.2443 11.2443 11.9484 11.9484 12.2897 12.2897 12.6953 12.6953 15.0790 15.0790 16.5225 16.5225 k =-0.0966 0.1729 0.9874 ( 6194 PWs) bands (ev): -79.7938 -79.7938 -79.7935 -79.7935 -45.4844 -45.4844 -45.4812 -45.4812 -43.8070 -43.8070 -43.8018 -43.8018 -43.6806 -43.6806 -43.6794 -43.6794 -28.0965 -28.0965 -9.4723 -9.4723 -9.1386 -9.1386 -9.0340 -9.0340 3.5683 3.5683 4.9626 4.9626 7.2807 7.2807 7.7395 7.7395 8.8499 8.8499 9.3084 9.3084 9.7892 9.7892 9.8675 9.8675 9.9417 9.9417 10.0280 10.0280 10.1793 10.1793 10.8068 10.8068 11.0402 11.0402 11.2883 11.2883 11.9909 11.9909 12.2964 12.2964 12.7329 12.7329 15.0872 15.0872 16.4842 16.4842 k =-0.1028 0.1841 0.9747 ( 6198 PWs) bands (ev): -79.7939 -79.7939 -79.7936 -79.7936 -45.4846 -45.4846 -45.4810 -45.4810 -43.8072 -43.8072 -43.8015 -43.8015 -43.6808 -43.6808 -43.6795 -43.6795 -28.0966 -28.0966 -9.4717 -9.4717 -9.1375 -9.1375 -9.0341 -9.0341 3.5638 3.5638 4.9130 4.9130 7.2953 7.2953 7.7823 7.7823 8.8215 8.8215 9.3004 9.3004 9.7949 9.7949 9.8591 9.8591 9.9374 9.9374 10.0463 10.0463 10.1756 10.1756 10.7922 10.7922 11.0337 11.0337 11.3326 11.3326 12.0327 12.0327 12.3069 12.3069 12.7739 12.7739 15.0992 15.0992 16.4411 16.4411 k =-0.1090 0.1952 0.9619 ( 6200 PWs) bands (ev): -79.7942 -79.7942 -79.7934 -79.7934 -45.4846 -45.4846 -45.4809 -45.4809 -43.8073 -43.8073 -43.8012 -43.8012 -43.6809 -43.6809 -43.6795 -43.6795 -28.0968 -28.0968 -9.4709 -9.4709 -9.1364 -9.1364 -9.0342 -9.0342 3.5581 3.5581 4.8633 4.8633 7.3083 7.3083 7.8259 7.8259 8.7956 8.7956 9.2914 9.2914 9.7994 9.7994 9.8515 9.8515 9.9317 9.9317 10.0676 10.0676 10.1712 10.1712 10.7792 10.7792 11.0274 11.0274 11.3764 11.3764 12.0738 12.0738 12.3218 12.3218 12.8193 12.8193 15.1150 15.1150 16.3949 16.3949 k =-0.1152 0.2063 0.9492 ( 6206 PWs) bands (ev): -79.7944 -79.7944 -79.7934 -79.7934 -45.4848 -45.4848 -45.4808 -45.4808 -43.8075 -43.8075 -43.8008 -43.8008 -43.6810 -43.6810 -43.6796 -43.6796 -28.0970 -28.0970 -9.4702 -9.4702 -9.1352 -9.1352 -9.0342 -9.0342 3.5514 3.5514 4.8136 4.8136 7.3192 7.3192 7.8702 7.8702 8.7727 8.7727 9.2814 9.2814 9.8030 9.8030 9.8454 9.8454 9.9245 9.9245 10.0904 10.0904 10.1669 10.1669 10.7672 10.7672 11.0208 11.0208 11.4189 11.4189 12.1137 12.1137 12.3403 12.3403 12.8690 12.8690 15.1343 15.1343 16.3467 16.3467 k =-0.1214 0.2174 0.9365 ( 6206 PWs) bands (ev): -79.7945 -79.7945 -79.7933 -79.7933 -45.4849 -45.4849 -45.4806 -45.4806 -43.8076 -43.8076 -43.8005 -43.8005 -43.6812 -43.6812 -43.6797 -43.6797 -28.0972 -28.0972 -9.4694 -9.4694 -9.1339 -9.1339 -9.0342 -9.0342 3.5438 3.5438 4.7643 4.7643 7.3276 7.3276 7.9146 7.9146 8.7530 8.7530 9.2706 9.2706 9.8046 9.8046 9.8420 9.8420 9.9162 9.9162 10.1147 10.1147 10.1639 10.1639 10.7567 10.7567 11.0140 11.0140 11.4597 11.4597 12.1526 12.1526 12.3636 12.3636 12.9229 12.9229 15.1571 15.1571 16.2987 16.2987 k =-0.1276 0.2285 0.9237 ( 6204 PWs) bands (ev): -79.7945 -79.7945 -79.7932 -79.7932 -45.4850 -45.4850 -45.4804 -45.4804 -43.8078 -43.8078 -43.8001 -43.8001 -43.6813 -43.6813 -43.6797 -43.6797 -28.0973 -28.0973 -9.4686 -9.4686 -9.1326 -9.1326 -9.0342 -9.0342 3.5354 3.5354 4.7155 4.7155 7.3333 7.3333 7.9594 7.9594 8.7369 8.7369 9.2589 9.2589 9.8029 9.8029 9.8423 9.8423 9.9076 9.9076 10.1369 10.1369 10.1645 10.1645 10.7474 10.7474 11.0069 11.0069 11.4983 11.4983 12.1903 12.1903 12.3911 12.3911 12.9818 12.9818 15.1832 15.1832 16.2514 16.2514 k =-0.1338 0.2396 0.9110 ( 6211 PWs) bands (ev): -79.7946 -79.7946 -79.7934 -79.7934 -45.4852 -45.4852 -45.4803 -45.4803 -43.8079 -43.8079 -43.7998 -43.7998 -43.6815 -43.6815 -43.6798 -43.6798 -28.0975 -28.0975 -9.4678 -9.4678 -9.1312 -9.1312 -9.0342 -9.0342 3.5263 3.5263 4.6674 4.6674 7.3360 7.3360 8.0039 8.0039 8.7244 8.7244 9.2465 9.2465 9.7974 9.7974 9.8453 9.8453 9.8997 9.8997 10.1450 10.1450 10.1797 10.1797 10.7388 10.7388 10.9989 10.9989 11.5343 11.5343 12.2263 12.2263 12.4232 12.4232 13.0449 13.0449 15.2126 15.2126 16.2056 16.2056 k =-0.1400 0.2507 0.8983 ( 6213 PWs) bands (ev): -79.7946 -79.7946 -79.7934 -79.7934 -45.4853 -45.4853 -45.4801 -45.4801 -43.8081 -43.8081 -43.7994 -43.7994 -43.6817 -43.6817 -43.6799 -43.6799 -28.0977 -28.0977 -9.4670 -9.4670 -9.1298 -9.1298 -9.0342 -9.0342 3.5165 3.5165 4.6202 4.6202 7.3356 7.3356 8.0485 8.0485 8.7155 8.7155 9.2340 9.2340 9.7888 9.7888 9.8488 9.8488 9.8952 9.8952 10.1431 10.1431 10.2062 10.2062 10.7313 10.7313 10.9898 10.9898 11.5683 11.5683 12.2612 12.2612 12.4590 12.4590 13.1132 13.1132 15.2452 15.2452 16.1624 16.1624 k =-0.1462 0.2619 0.8855 ( 6207 PWs) bands (ev): -79.7946 -79.7946 -79.7932 -79.7932 -45.4854 -45.4854 -45.4799 -45.4799 -43.8081 -43.8081 -43.7991 -43.7991 -43.6818 -43.6818 -43.6800 -43.6800 -28.0980 -28.0980 -9.4662 -9.4662 -9.1283 -9.1283 -9.0340 -9.0340 3.5063 3.5063 4.5741 4.5741 7.3322 7.3322 8.0929 8.0929 8.7103 8.7103 9.2218 9.2218 9.7774 9.7774 9.8504 9.8504 9.8961 9.8961 10.1388 10.1388 10.2352 10.2352 10.7248 10.7248 10.9805 10.9805 11.6009 11.6009 12.2950 12.2950 12.4986 12.4986 13.1867 13.1867 15.2812 15.2812 16.1223 16.1223 k =-0.1524 0.2730 0.8728 ( 6213 PWs) bands (ev): -79.7947 -79.7947 -79.7933 -79.7933 -45.4855 -45.4855 -45.4798 -45.4798 -43.8083 -43.8083 -43.7987 -43.7987 -43.6820 -43.6820 -43.6801 -43.6801 -28.0982 -28.0982 -9.4655 -9.4655 -9.1269 -9.1269 -9.0339 -9.0339 3.4957 3.4957 4.5292 4.5292 7.3257 7.3257 8.1368 8.1368 8.7080 8.7080 9.2094 9.2094 9.7628 9.7628 9.8494 9.8494 9.9031 9.9031 10.1334 10.1334 10.2652 10.2652 10.7183 10.7183 10.9703 10.9703 11.6316 11.6316 12.3271 12.3271 12.5400 12.5400 13.2646 13.2646 15.3201 15.3201 16.0854 16.0854 k =-0.1586 0.2841 0.8601 ( 6217 PWs) bands (ev): -79.7948 -79.7948 -79.7934 -79.7934 -45.4857 -45.4857 -45.4797 -45.4797 -43.8084 -43.8084 -43.7984 -43.7984 -43.6822 -43.6822 -43.6802 -43.6802 -28.0984 -28.0984 -9.4647 -9.4647 -9.1254 -9.1254 -9.0337 -9.0337 3.4848 3.4848 4.4856 4.4856 7.3165 7.3165 8.1800 8.1800 8.7087 8.7087 9.1974 9.1974 9.7456 9.7456 9.8472 9.8472 9.9145 9.9145 10.1280 10.1280 10.2955 10.2955 10.7124 10.7124 10.9591 10.9591 11.6612 11.6612 12.3577 12.3577 12.5846 12.5846 13.3470 13.3470 15.3619 15.3619 16.0521 16.0521 k =-0.1648 0.2952 0.8474 ( 6215 PWs) bands (ev): -79.7948 -79.7948 -79.7933 -79.7933 -45.4858 -45.4858 -45.4795 -45.4795 -43.8085 -43.8085 -43.7981 -43.7981 -43.6823 -43.6823 -43.6803 -43.6803 -28.0986 -28.0986 -9.4640 -9.4640 -9.1240 -9.1240 -9.0334 -9.0334 3.4737 3.4737 4.4434 4.4434 7.3049 7.3049 8.2229 8.2229 8.7117 8.7117 9.1862 9.1862 9.7260 9.7260 9.8457 9.8457 9.9289 9.9289 10.1226 10.1226 10.3259 10.3259 10.7069 10.7069 10.9473 10.9473 11.6910 11.6910 12.3870 12.3870 12.6304 12.6304 13.4345 13.4345 15.4068 15.4068 16.0226 16.0226 k =-0.1710 0.3063 0.8346 ( 6215 PWs) bands (ev): -79.7949 -79.7949 -79.7932 -79.7932 -45.4858 -45.4858 -45.4794 -45.4794 -43.8086 -43.8086 -43.7977 -43.7977 -43.6824 -43.6824 -43.6804 -43.6804 -28.0988 -28.0988 -9.4632 -9.4632 -9.1226 -9.1226 -9.0331 -9.0331 3.4626 3.4626 4.4028 4.4028 7.2911 7.2911 8.2651 8.2651 8.7166 8.7166 9.1761 9.1761 9.7042 9.7042 9.8451 9.8451 9.9456 9.9456 10.1169 10.1169 10.3559 10.3559 10.7013 10.7013 10.9341 10.9341 11.7211 11.7211 12.4148 12.4148 12.6768 12.6768 13.5262 13.5262 15.4544 15.4544 15.9962 15.9962 k =-0.1773 0.3174 0.8219 ( 6220 PWs) bands (ev): -79.7952 -79.7952 -79.7932 -79.7932 -45.4859 -45.4859 -45.4793 -45.4793 -43.8087 -43.8087 -43.7975 -43.7975 -43.6826 -43.6826 -43.6805 -43.6805 -28.0990 -28.0990 -9.4626 -9.4626 -9.1212 -9.1212 -9.0327 -9.0327 3.4515 3.4515 4.3637 4.3637 7.2755 7.2755 8.3066 8.3066 8.7226 8.7226 9.1671 9.1671 9.6807 9.6807 9.8455 9.8455 9.9634 9.9634 10.1110 10.1110 10.3848 10.3848 10.6956 10.6956 10.9198 10.9198 11.7522 11.7522 12.4414 12.4414 12.7226 12.7226 13.6222 13.6222 15.5047 15.5047 15.9703 15.9703 k =-0.1835 0.3286 0.8092 ( 6221 PWs) bands (ev): -79.7953 -79.7953 -79.7931 -79.7931 -45.4860 -45.4860 -45.4792 -45.4792 -43.8087 -43.8087 -43.7972 -43.7972 -43.6827 -43.6827 -43.6807 -43.6807 -28.0992 -28.0992 -9.4619 -9.4619 -9.1199 -9.1199 -9.0323 -9.0323 3.4405 3.4405 4.3264 4.3264 7.2587 7.2587 8.3475 8.3475 8.7290 8.7290 9.1596 9.1596 9.6559 9.6559 9.8471 9.8471 9.9826 9.9826 10.1056 10.1056 10.4127 10.4127 10.6903 10.6903 10.9046 10.9046 11.7851 11.7851 12.4664 12.4664 12.7668 12.7668 13.7221 13.7221 15.5579 15.5579 15.9381 15.9381 k =-0.1897 0.3397 0.7964 ( 6215 PWs) bands (ev): -79.7953 -79.7953 -79.7928 -79.7928 -45.4860 -45.4860 -45.4791 -45.4791 -43.8088 -43.8088 -43.7969 -43.7969 -43.6828 -43.6828 -43.6808 -43.6808 -28.0995 -28.0995 -9.4613 -9.4613 -9.1186 -9.1186 -9.0318 -9.0318 3.4296 3.4296 4.2909 4.2909 7.2407 7.2407 8.3875 8.3875 8.7357 8.7357 9.1541 9.1541 9.6302 9.6302 9.8500 9.8500 10.0027 10.0027 10.1007 10.1007 10.4391 10.4391 10.6855 10.6855 10.8882 10.8882 11.8204 11.8204 12.4905 12.4905 12.8092 12.8092 13.8260 13.8260 15.6137 15.6137 15.8911 15.8911 k =-0.1959 0.3508 0.7837 ( 6211 PWs) bands (ev): -79.7952 -79.7952 -79.7928 -79.7928 -45.4861 -45.4861 -45.4789 -45.4789 -43.8088 -43.8088 -43.7966 -43.7966 -43.6829 -43.6829 -43.6808 -43.6808 -28.0997 -28.0997 -9.4607 -9.4607 -9.1174 -9.1174 -9.0313 -9.0313 3.4191 3.4191 4.2572 4.2572 7.2222 7.2222 8.4269 8.4269 8.7419 8.7419 9.1501 9.1501 9.6038 9.6038 9.8536 9.8536 10.0227 10.0227 10.0974 10.0974 10.4636 10.4636 10.6807 10.6807 10.8707 10.8707 11.8582 11.8582 12.5129 12.5129 12.8482 12.8482 13.9335 13.9335 15.6719 15.6719 15.8317 15.8317 k =-0.2021 0.3619 0.7710 ( 6215 PWs) bands (ev): -79.7953 -79.7953 -79.7929 -79.7929 -45.4861 -45.4861 -45.4788 -45.4788 -43.8089 -43.8089 -43.7963 -43.7963 -43.6830 -43.6830 -43.6809 -43.6809 -28.0999 -28.0999 -9.4602 -9.4602 -9.1162 -9.1162 -9.0307 -9.0307 3.4089 3.4089 4.2254 4.2254 7.2034 7.2034 8.4652 8.4652 8.7471 8.7471 9.1480 9.1480 9.5768 9.5768 9.8574 9.8574 10.0404 10.0404 10.0966 10.0966 10.4857 10.4857 10.6759 10.6759 10.8521 10.8521 11.8991 11.8991 12.5339 12.5339 12.8833 12.8833 14.0439 14.0439 15.7323 15.7323 15.7669 15.7669 k =-0.2083 0.3730 0.7582 ( 6209 PWs) bands (ev): -79.7952 -79.7952 -79.7928 -79.7928 -45.4862 -45.4862 -45.4787 -45.4787 -43.8089 -43.8089 -43.7960 -43.7960 -43.6831 -43.6831 -43.6810 -43.6810 -28.1000 -28.1000 -9.4597 -9.4597 -9.1151 -9.1151 -9.0301 -9.0301 3.3990 3.3990 4.1956 4.1956 7.1847 7.1847 8.5027 8.5027 8.7516 8.7516 9.1479 9.1479 9.5495 9.5495 9.8628 9.8628 10.0523 10.0523 10.1030 10.1030 10.5053 10.5053 10.6720 10.6720 10.8323 10.8323 11.9432 11.9432 12.5535 12.5535 12.9145 12.9145 14.1574 14.1574 15.7002 15.7002 15.7956 15.7956 k =-0.2145 0.3841 0.7455 ( 6211 PWs) bands (ev): -79.7953 -79.7953 -79.7927 -79.7927 -45.4862 -45.4862 -45.4786 -45.4786 -43.8090 -43.8090 -43.7958 -43.7958 -43.6832 -43.6832 -43.6811 -43.6811 -28.1002 -28.1002 -9.4593 -9.4593 -9.1142 -9.1142 -9.0295 -9.0295 3.3897 3.3897 4.1678 4.1678 7.1663 7.1663 8.5391 8.5391 8.7548 8.7548 9.1495 9.1495 9.5220 9.5220 9.8681 9.8681 10.0553 10.0553 10.1186 10.1186 10.5221 10.5221 10.6683 10.6683 10.8114 10.8114 11.9906 11.9906 12.5717 12.5717 12.9400 12.9400 14.2728 14.2728 15.6338 15.6338 15.8607 15.8607 k =-0.2207 0.3953 0.7328 ( 6217 PWs) bands (ev): -79.7954 -79.7954 -79.7929 -79.7929 -45.4863 -45.4863 -45.4785 -45.4785 -43.8091 -43.8091 -43.7955 -43.7955 -43.6834 -43.6834 -43.6812 -43.6812 -28.1004 -28.1004 -9.4588 -9.4588 -9.1132 -9.1132 -9.0289 -9.0289 3.3809 3.3809 4.1421 4.1421 7.1485 7.1485 8.5742 8.5742 8.7567 8.7567 9.1524 9.1524 9.4946 9.4946 9.8740 9.8740 10.0529 10.0529 10.1403 10.1403 10.5360 10.5360 10.6655 10.6655 10.7891 10.7891 12.0411 12.0411 12.5883 12.5883 12.9595 12.9595 14.3901 14.3901 15.5685 15.5685 15.9278 15.9278 k =-0.2269 0.4064 0.7200 ( 6213 PWs) bands (ev): -79.7953 -79.7953 -79.7928 -79.7928 -45.4864 -45.4864 -45.4784 -45.4784 -43.8091 -43.8091 -43.7953 -43.7953 -43.6835 -43.6835 -43.6813 -43.6813 -28.1005 -28.1005 -9.4585 -9.4585 -9.1124 -9.1124 -9.0283 -9.0283 3.3727 3.3727 4.1185 4.1185 7.1316 7.1316 8.6082 8.6082 8.7577 8.7577 9.1568 9.1568 9.4676 9.4676 9.8806 9.8806 10.0487 10.0487 10.1651 10.1651 10.5471 10.5471 10.6640 10.6640 10.7664 10.7664 12.0948 12.0948 12.6039 12.6039 12.9732 12.9732 14.5086 14.5086 15.5055 15.5055 15.9969 15.9969 k =-0.2331 0.4175 0.7073 ( 6210 PWs) bands (ev): -79.7952 -79.7952 -79.7927 -79.7927 -45.4864 -45.4864 -45.4783 -45.4783 -43.8091 -43.8091 -43.7951 -43.7951 -43.6835 -43.6835 -43.6814 -43.6814 -28.1007 -28.1007 -9.4581 -9.4581 -9.1117 -9.1117 -9.0277 -9.0277 3.3651 3.3651 4.0971 4.0971 7.1157 7.1157 8.6408 8.6408 8.7577 8.7577 9.1621 9.1621 9.4411 9.4411 9.8872 9.8872 10.0436 10.0436 10.1913 10.1913 10.5553 10.5553 10.6632 10.6632 10.7429 10.7429 12.1513 12.1513 12.6179 12.6179 12.9805 12.9805 14.6278 14.6278 15.4454 15.4454 16.0674 16.0674 k =-0.2393 0.4286 0.6946 ( 6202 PWs) bands (ev): -79.7951 -79.7951 -79.7925 -79.7925 -45.4864 -45.4864 -45.4782 -45.4782 -43.8091 -43.8091 -43.7949 -43.7949 -43.6836 -43.6836 -43.6814 -43.6814 -28.1008 -28.1008 -9.4578 -9.4578 -9.1110 -9.1110 -9.0271 -9.0271 3.3582 3.3582 4.0778 4.0778 7.1011 7.1011 8.6719 8.6719 8.7572 8.7572 9.1678 9.1678 9.4156 9.4156 9.8947 9.8947 10.0378 10.0378 10.2186 10.2186 10.5611 10.5611 10.6637 10.6637 10.7186 10.7186 12.2097 12.2097 12.6307 12.6307 12.9813 12.9813 14.7473 14.7473 15.3892 15.3892 16.1388 16.1388 k =-0.2455 0.4397 0.6819 ( 6206 PWs) bands (ev): -79.7952 -79.7952 -79.7926 -79.7926 -45.4864 -45.4864 -45.4781 -45.4781 -43.8092 -43.8092 -43.7947 -43.7947 -43.6836 -43.6836 -43.6815 -43.6815 -28.1009 -28.1009 -9.4576 -9.4576 -9.1105 -9.1105 -9.0265 -9.0265 3.3520 3.3520 4.0607 4.0607 7.0879 7.0879 8.7007 8.7007 8.7558 8.7558 9.1739 9.1739 9.3908 9.3908 9.9018 9.9018 10.0315 10.0315 10.2460 10.2460 10.5642 10.5642 10.6642 10.6642 10.6942 10.6942 12.2698 12.2698 12.6418 12.6418 12.9744 12.9744 14.8651 14.8651 15.3373 15.3373 16.2096 16.2096 k =-0.2517 0.4508 0.6691 ( 6210 PWs) bands (ev): -79.7952 -79.7952 -79.7927 -79.7927 -45.4865 -45.4865 -45.4781 -45.4781 -43.8092 -43.8092 -43.7946 -43.7946 -43.6837 -43.6837 -43.6816 -43.6816 -28.1011 -28.1011 -9.4574 -9.4574 -9.1100 -9.1100 -9.0260 -9.0260 3.3466 3.3466 4.0459 4.0459 7.0761 7.0761 8.7270 8.7270 8.7548 8.7548 9.1797 9.1797 9.3674 9.3674 9.9089 9.9089 10.0249 10.0249 10.2735 10.2735 10.5657 10.5657 10.6618 10.6618 10.6729 10.6729 12.3306 12.3306 12.6513 12.6513 12.9612 12.9612 14.9804 14.9804 15.2908 15.2908 16.2784 16.2784 k =-0.2579 0.4619 0.6564 ( 6205 PWs) bands (ev): -79.7951 -79.7951 -79.7926 -79.7926 -45.4865 -45.4865 -45.4780 -45.4780 -43.8092 -43.8092 -43.7944 -43.7944 -43.6838 -43.6838 -43.6816 -43.6816 -28.1011 -28.1011 -9.4572 -9.4572 -9.1096 -9.1096 -9.0255 -9.0255 3.3419 3.3419 4.0333 4.0333 7.0660 7.0660 8.7463 8.7463 8.7586 8.7586 9.1852 9.1852 9.3463 9.3463 9.9160 9.9160 10.0188 10.0188 10.3007 10.3007 10.5660 10.5660 10.6417 10.6417 10.6700 10.6700 12.3916 12.3916 12.6595 12.6595 12.9426 12.9426 15.0912 15.0912 15.2505 15.2505 16.3442 16.3442 k =-0.2641 0.4731 0.6437 ( 6199 PWs) bands (ev): -79.7951 -79.7951 -79.7924 -79.7924 -45.4865 -45.4865 -45.4779 -45.4779 -43.8092 -43.8092 -43.7943 -43.7943 -43.6838 -43.6838 -43.6816 -43.6816 -28.1012 -28.1012 -9.4570 -9.4570 -9.1093 -9.1093 -9.0252 -9.0252 3.3381 3.3381 4.0230 4.0230 7.0576 7.0576 8.7493 8.7493 8.7758 8.7758 9.1900 9.1900 9.3277 9.3277 9.9225 9.9225 10.0131 10.0131 10.3272 10.3272 10.5651 10.5651 10.6184 10.6184 10.6713 10.6713 12.4507 12.4507 12.6665 12.6665 12.9186 12.9186 15.1906 15.1906 15.2211 15.2211 16.4076 16.4077 k =-0.2704 0.4842 0.6309 ( 6197 PWs) bands (ev): -79.7951 -79.7951 -79.7924 -79.7924 -45.4865 -45.4865 -45.4779 -45.4779 -43.8092 -43.8092 -43.7942 -43.7942 -43.6838 -43.6838 -43.6817 -43.6817 -28.1013 -28.1013 -9.4569 -9.4569 -9.1090 -9.1090 -9.0248 -9.0248 3.3351 3.3351 4.0149 4.0149 7.0510 7.0510 8.7486 8.7486 8.7927 8.7927 9.1938 9.1938 9.3125 9.3125 9.9285 9.9285 10.0082 10.0082 10.3520 10.3520 10.5627 10.5627 10.5966 10.5966 10.6725 10.6725 12.5062 12.5062 12.6719 12.6719 12.8904 12.8904 15.1867 15.1868 15.2913 15.2913 16.4522 16.4522 k =-0.2766 0.4953 0.6182 ( 6198 PWs) bands (ev): -79.7950 -79.7950 -79.7925 -79.7925 -45.4865 -45.4865 -45.4779 -45.4779 -43.8092 -43.8092 -43.7942 -43.7942 -43.6838 -43.6838 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1088 -9.1088 -9.0246 -9.0246 3.3330 3.3330 4.0091 4.0091 7.0463 7.0463 8.7477 8.7477 8.8056 8.8056 9.1967 9.1967 9.3006 9.3006 9.9336 9.9336 10.0035 10.0035 10.3734 10.3734 10.5574 10.5574 10.5810 10.5810 10.6735 10.6735 12.5549 12.5549 12.6761 12.6761 12.8611 12.8611 15.1676 15.1676 15.3671 15.3671 16.3845 16.3845 k =-0.2828 0.5064 0.6055 ( 6204 PWs) bands (ev): -79.7951 -79.7951 -79.7926 -79.7926 -45.4866 -45.4866 -45.4779 -45.4779 -43.8093 -43.8093 -43.7942 -43.7942 -43.6839 -43.6839 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1087 -9.1087 -9.0245 -9.0245 3.3317 3.3317 4.0057 4.0057 7.0434 7.0434 8.7470 8.7470 8.8136 8.8136 9.1984 9.1984 9.2929 9.2929 9.9366 9.9366 10.0001 10.0001 10.3891 10.3891 10.5485 10.5485 10.5742 10.5742 10.6742 10.6742 12.5907 12.5907 12.6789 12.6789 12.8363 12.8363 15.1558 15.1558 15.4184 15.4184 16.3375 16.3375 k =-0.2890 0.5175 0.5927 ( 6200 PWs) bands (ev): -79.7950 -79.7950 -79.7925 -79.7925 -45.4866 -45.4866 -45.4778 -45.4778 -43.8093 -43.8093 -43.7941 -43.7941 -43.6839 -43.6839 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1087 -9.1087 -9.0244 -9.0244 3.3312 3.3312 4.0046 4.0046 7.0425 7.0425 8.7468 8.7468 8.8165 8.8165 9.1990 9.1990 9.2906 9.2906 9.9379 9.9379 9.9990 9.9990 10.3952 10.3952 10.5441 10.5441 10.5727 10.5727 10.6745 10.6745 12.6045 12.6045 12.6803 12.6803 12.8260 12.8260 15.1518 15.1518 15.4370 15.4370 16.3207 16.3207 k =-0.2890 0.5175 0.5927 ( 6200 PWs) bands (ev): -79.7950 -79.7950 -79.7925 -79.7925 -45.4866 -45.4866 -45.4778 -45.4778 -43.8093 -43.8093 -43.7941 -43.7941 -43.6839 -43.6839 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1087 -9.1087 -9.0244 -9.0244 3.3312 3.3312 4.0046 4.0046 7.0425 7.0425 8.7468 8.7468 8.8165 8.8165 9.1990 9.1990 9.2906 9.2906 9.9379 9.9379 9.9990 9.9990 10.3952 10.3952 10.5441 10.5441 10.5727 10.5727 10.6745 10.6745 12.6045 12.6045 12.6803 12.6803 12.8260 12.8260 15.1518 15.1518 15.4370 15.4370 16.3207 16.3207 k =-0.2828 0.5065 0.5801 ( 6200 PWs) bands (ev): -79.7948 -79.7948 -79.7927 -79.7927 -45.4859 -45.4859 -45.4785 -45.4785 -43.8081 -43.8081 -43.7953 -43.7953 -43.6837 -43.6837 -43.6819 -43.6819 -28.1013 -28.1013 -9.4576 -9.4576 -9.1095 -9.1095 -9.0241 -9.0241 3.3116 3.3116 4.0674 4.0674 7.0250 7.0250 8.7403 8.7403 8.8185 8.8185 9.1759 9.1759 9.3093 9.3093 9.9368 9.9368 10.0327 10.0327 10.3873 10.3873 10.5107 10.5107 10.5570 10.5570 10.6641 10.6641 12.5523 12.5523 12.6038 12.6038 12.8385 12.8385 15.2298 15.2298 15.3357 15.3357 16.2996 16.2996 k =-0.2767 0.4955 0.5675 ( 6204 PWs) bands (ev): -79.7948 -79.7948 -79.7929 -79.7929 -45.4852 -45.4852 -45.4792 -45.4792 -43.8069 -43.8069 -43.7965 -43.7965 -43.6835 -43.6835 -43.6821 -43.6821 -28.1012 -28.1012 -9.4582 -9.4582 -9.1101 -9.1101 -9.0237 -9.0237 3.2876 3.2876 4.1304 4.1304 7.0133 7.0133 8.7305 8.7305 8.8219 8.8219 9.1535 9.1535 9.3284 9.3284 9.9318 9.9318 10.0673 10.0673 10.3784 10.3784 10.4795 10.4795 10.5450 10.5450 10.6560 10.6560 12.4989 12.4989 12.5327 12.5327 12.8518 12.8518 15.2293 15.2293 15.3149 15.3149 16.2802 16.2802 k =-0.2705 0.4845 0.5549 ( 6188 PWs) bands (ev): -79.7944 -79.7944 -79.7927 -79.7927 -45.4844 -45.4844 -45.4799 -45.4799 -43.8056 -43.8056 -43.7977 -43.7977 -43.6833 -43.6833 -43.6822 -43.6822 -28.1011 -28.1011 -9.4588 -9.4588 -9.1106 -9.1106 -9.0234 -9.0234 3.2594 3.2594 4.1936 4.1936 7.0074 7.0074 8.7174 8.7174 8.8272 8.8272 9.1323 9.1323 9.3483 9.3483 9.9237 9.9237 10.1029 10.1029 10.3667 10.3667 10.4554 10.4554 10.5372 10.5372 10.6512 10.6512 12.4376 12.4376 12.4749 12.4749 12.8663 12.8663 15.1299 15.1299 15.3955 15.3955 16.2631 16.2631 k =-0.2644 0.4735 0.5423 ( 6187 PWs) bands (ev): -79.7941 -79.7941 -79.7929 -79.7929 -45.4837 -45.4837 -45.4806 -45.4806 -43.8044 -43.8044 -43.7988 -43.7988 -43.6831 -43.6831 -43.6824 -43.6824 -28.1011 -28.1011 -9.4592 -9.4592 -9.1110 -9.1110 -9.0231 -9.0231 3.2270 3.2270 4.2566 4.2566 7.0072 7.0072 8.7005 8.7005 8.8339 8.8339 9.1116 9.1116 9.3692 9.3692 9.9129 9.9129 10.1391 10.1391 10.3460 10.3460 10.4404 10.4404 10.5324 10.5324 10.6481 10.6481 12.3688 12.3688 12.4284 12.4284 12.8813 12.8813 15.0304 15.0304 15.4780 15.4780 16.2479 16.2479 k =-0.2582 0.4625 0.5297 ( 6179 PWs) bands (ev): -79.7938 -79.7938 -79.7930 -79.7930 -45.4830 -45.4830 -45.4812 -45.4812 -43.8032 -43.8032 -43.8000 -43.8000 -43.6829 -43.6829 -43.6825 -43.6825 -28.1010 -28.1010 -9.4594 -9.4594 -9.1112 -9.1112 -9.0229 -9.0229 3.1907 3.1907 4.3194 4.3194 7.0124 7.0124 8.6801 8.6801 8.8423 8.8423 9.0919 9.0919 9.3904 9.3904 9.8994 9.8994 10.1751 10.1751 10.3183 10.3183 10.4366 10.4366 10.5310 10.5310 10.6479 10.6479 12.2991 12.2991 12.3878 12.3878 12.8975 12.8975 14.9314 14.9314 15.5612 15.5612 16.2350 16.2350 k =-0.2521 0.4515 0.5171 ( 6183 PWs) bands (ev): -79.7935 -79.7935 -79.7934 -79.7934 -45.4824 -45.4824 -45.4819 -45.4819 -43.8021 -43.8021 -43.8012 -43.8012 -43.6828 -43.6828 -43.6827 -43.6827 -28.1010 -28.1010 -9.4595 -9.4595 -9.1113 -9.1113 -9.0227 -9.0227 3.1507 3.1507 4.3818 4.3818 7.0228 7.0228 8.6562 8.6562 8.8527 8.8527 9.0728 9.0728 9.4121 9.4121 9.8834 9.8834 10.2105 10.2105 10.2856 10.2856 10.4395 10.4395 10.5326 10.5326 10.6496 10.6496 12.2301 12.2301 12.3505 12.3505 12.9145 12.9145 14.8332 14.8332 15.6442 15.6442 16.2242 16.2242 k =-0.2459 0.4404 0.5045 ( 6181 PWs) bands (ev): -79.7937 -79.7937 -79.7931 -79.7931 -45.4825 -45.4825 -45.4817 -45.4817 -43.8024 -43.8024 -43.8009 -43.8009 -43.6828 -43.6828 -43.6826 -43.6826 -28.1010 -28.1010 -9.4594 -9.4594 -9.1113 -9.1113 -9.0226 -9.0226 3.1073 3.1073 4.4435 4.4435 7.0380 7.0380 8.6290 8.6290 8.8651 8.8651 9.0548 9.0548 9.4343 9.4343 9.8656 9.8656 10.2363 10.2363 10.2611 10.2611 10.4483 10.4483 10.5371 10.5371 10.6537 10.6537 12.1628 12.1628 12.3161 12.3161 12.9329 12.9329 14.7361 14.7361 15.7263 15.7263 16.2157 16.2157 k =-0.2398 0.4294 0.4918 ( 6189 PWs) bands (ev): -79.7939 -79.7939 -79.7932 -79.7932 -45.4833 -45.4833 -45.4810 -45.4810 -43.8037 -43.8037 -43.7997 -43.7997 -43.6830 -43.6830 -43.6824 -43.6824 -28.1011 -28.1011 -9.4592 -9.4592 -9.1111 -9.1111 -9.0225 -9.0225 3.0609 3.0609 4.5043 4.5043 7.0575 7.0575 8.5990 8.5990 8.8798 8.8798 9.0377 9.0377 9.4568 9.4568 9.8460 9.8460 10.2100 10.2100 10.2872 10.2872 10.4609 10.4609 10.5433 10.5433 10.6590 10.6590 12.0974 12.0974 12.2841 12.2841 12.9526 12.9526 14.6396 14.6396 15.8065 15.8065 16.2093 16.2093 k =-0.2336 0.4184 0.4792 ( 6193 PWs) bands (ev): -79.7942 -79.7942 -79.7931 -79.7931 -45.4840 -45.4840 -45.4803 -45.4803 -43.8049 -43.8049 -43.7985 -43.7985 -43.6832 -43.6832 -43.6823 -43.6823 -28.1011 -28.1011 -9.4589 -9.4589 -9.1108 -9.1108 -9.0225 -9.0225 3.0116 3.0116 4.5641 4.5641 7.0808 7.0808 8.5665 8.5665 8.8966 8.8966 9.0214 9.0214 9.4799 9.4799 9.8254 9.8254 10.1740 10.1740 10.3225 10.3225 10.4769 10.4769 10.5530 10.5530 10.6669 10.6669 12.0338 12.0338 12.2548 12.2548 12.9734 12.9734 14.5443 14.5443 15.8839 15.8839 16.2054 16.2054 k =-0.2275 0.4074 0.4666 ( 6181 PWs) bands (ev): -79.7944 -79.7944 -79.7924 -79.7924 -45.4846 -45.4846 -45.4796 -45.4796 -43.8060 -43.8060 -43.7973 -43.7973 -43.6832 -43.6832 -43.6821 -43.6821 -28.1012 -28.1012 -9.4584 -9.4584 -9.1103 -9.1103 -9.0224 -9.0224 2.9600 2.9600 4.6228 4.6228 7.1072 7.1072 8.5326 8.5326 8.9157 8.9157 9.0066 9.0066 9.5040 9.5040 9.8044 9.8044 10.1380 10.1380 10.3588 10.3588 10.4964 10.4964 10.5653 10.5653 10.6774 10.6774 11.9720 11.9720 12.2284 12.2284 12.9962 12.9962 14.4505 14.4505 15.9569 15.9569 16.2041 16.2041 k =-0.2213 0.3964 0.4540 ( 6181 PWs) bands (ev): -79.7946 -79.7946 -79.7922 -79.7922 -45.4853 -45.4853 -45.4789 -45.4789 -43.8072 -43.8072 -43.7961 -43.7961 -43.6834 -43.6834 -43.6819 -43.6819 -28.1012 -28.1012 -9.4577 -9.4577 -9.1097 -9.1097 -9.0225 -9.0225 2.9063 2.9063 4.6800 4.6800 7.1360 7.1360 8.4977 8.4977 8.9371 8.9371 8.9925 8.9925 9.5282 9.5282 9.7825 9.7825 10.1011 10.1011 10.3948 10.3948 10.5181 10.5181 10.5792 10.5792 10.6891 10.6891 11.9119 11.9119 12.2043 12.2043 13.0199 13.0199 14.3575 14.3575 16.0227 16.0227 16.2049 16.2049 k =-0.2152 0.3854 0.4414 ( 6177 PWs) bands (ev): -79.7948 -79.7948 -79.7919 -79.7919 -45.4859 -45.4859 -45.4783 -45.4783 -43.8083 -43.8083 -43.7949 -43.7949 -43.6836 -43.6836 -43.6817 -43.6817 -28.1013 -28.1013 -9.4569 -9.4569 -9.1090 -9.1090 -9.0225 -9.0225 2.8509 2.8509 4.7356 4.7356 7.1665 7.1665 8.4625 8.4625 8.9593 8.9593 8.9814 8.9814 9.5530 9.5530 9.7606 9.7606 10.0644 10.0644 10.4308 10.4308 10.5424 10.5424 10.5948 10.5948 10.7023 10.7023 11.8543 11.8543 12.1824 12.1824 13.0455 13.0455 14.2661 14.2661 16.0775 16.0775 16.2079 16.2079 k =-0.2090 0.3744 0.4288 ( 6187 PWs) bands (ev): -79.7952 -79.7952 -79.7918 -79.7918 -45.4866 -45.4866 -45.4776 -45.4776 -43.8095 -43.8095 -43.7938 -43.7938 -43.6838 -43.6838 -43.6816 -43.6816 -28.1015 -28.1015 -9.4560 -9.4560 -9.1081 -9.1081 -9.0226 -9.0226 2.7941 2.7941 4.7892 4.7892 7.1976 7.1976 8.4279 8.4279 8.9626 8.9626 8.9928 8.9928 9.5778 9.5778 9.7383 9.7383 10.0283 10.0283 10.4661 10.4661 10.5678 10.5678 10.6114 10.6114 10.7162 10.7162 11.7976 11.7976 12.1629 12.1629 13.0727 13.0727 14.1759 14.1759 16.1157 16.1157 16.2128 16.2128 k =-0.2029 0.3634 0.4162 ( 6197 PWs) bands (ev): -79.7956 -79.7956 -79.7918 -79.7918 -45.4873 -45.4873 -45.4770 -45.4770 -43.8107 -43.8107 -43.7927 -43.7927 -43.6840 -43.6840 -43.6815 -43.6815 -28.1016 -28.1016 -9.4550 -9.4550 -9.1071 -9.1071 -9.0228 -9.0228 2.7362 2.7362 4.8410 4.8410 7.2286 7.2286 8.3949 8.3949 8.9523 8.9523 9.0216 9.0216 9.6023 9.6023 9.7171 9.7171 9.9921 9.9921 10.5006 10.5006 10.5944 10.5944 10.6295 10.6295 10.7317 10.7317 11.7439 11.7439 12.1456 12.1456 13.1014 13.1014 14.0864 14.0864 16.1313 16.1313 16.2201 16.2201 k =-0.1967 0.3524 0.4036 ( 6199 PWs) bands (ev): -79.7956 -79.7956 -79.7918 -79.7918 -45.4880 -45.4880 -45.4763 -45.4763 -43.8118 -43.8118 -43.7915 -43.7915 -43.6842 -43.6842 -43.6813 -43.6813 -28.1017 -28.1017 -9.4538 -9.4538 -9.1059 -9.1059 -9.0230 -9.0230 2.6776 2.6776 4.8907 4.8907 7.2582 7.2582 8.3647 8.3647 8.9421 8.9421 9.0544 9.0544 9.6257 9.6257 9.6978 9.6978 9.9570 9.9570 10.5345 10.5345 10.6228 10.6228 10.6494 10.6494 10.7484 10.7484 11.6925 11.6925 12.1313 12.1313 13.1320 13.1320 13.9980 13.9980 16.1203 16.1203 16.2295 16.2295 k =-0.1906 0.3413 0.3910 ( 6207 PWs) bands (ev): -79.7957 -79.7957 -79.7921 -79.7921 -45.4888 -45.4888 -45.4756 -45.4756 -43.8131 -43.8131 -43.7903 -43.7903 -43.6845 -43.6845 -43.6811 -43.6811 -28.1019 -28.1019 -9.4526 -9.4526 -9.1047 -9.1047 -9.0232 -9.0232 2.6186 2.6186 4.9381 4.9381 7.2853 7.2853 8.3384 8.3384 8.9320 8.9320 9.0904 9.0904 9.6427 9.6427 9.6852 9.6852 9.9219 9.9219 10.5672 10.5672 10.6526 10.6526 10.6704 10.6704 10.7666 10.7666 11.6437 11.6437 12.1195 12.1195 13.1636 13.1636 13.9107 13.9107 16.0843 16.0843 16.2411 16.2411 k =-0.1845 0.3303 0.3783 ( 6203 PWs) bands (ev): -79.7959 -79.7959 -79.7918 -79.7918 -45.4894 -45.4894 -45.4750 -45.4750 -43.8141 -43.8141 -43.7892 -43.7892 -43.6846 -43.6846 -43.6809 -43.6809 -28.1020 -28.1020 -9.4512 -9.4512 -9.1033 -9.1033 -9.0234 -9.0234 2.5593 2.5593 4.9832 4.9832 7.3089 7.3089 8.3171 8.3171 8.9233 8.9233 9.1294 9.1294 9.6403 9.6403 9.6937 9.6937 9.8879 9.8879 10.5997 10.5997 10.6831 10.6831 10.6929 10.6929 10.7861 10.7861 11.5971 11.5971 12.1103 12.1103 13.1976 13.1976 13.8254 13.8254 16.0295 16.0295 16.2551 16.2551 k =-0.1783 0.3193 0.3657 ( 6205 PWs) bands (ev): -79.7961 -79.7961 -79.7916 -79.7916 -45.4900 -45.4900 -45.4744 -45.4744 -43.8152 -43.8152 -43.7881 -43.7881 -43.6848 -43.6848 -43.6808 -43.6808 -28.1022 -28.1022 -9.4498 -9.4498 -9.1018 -9.1018 -9.0237 -9.0237 2.5002 2.5002 5.0258 5.0258 7.3275 7.3275 8.3016 8.3016 8.9154 8.9154 9.1712 9.1712 9.6251 9.6251 9.7151 9.7151 9.8548 9.8548 10.6309 10.6309 10.7130 10.7130 10.7172 10.7172 10.8063 10.8063 11.5530 11.5530 12.1036 12.1036 13.2334 13.2334 13.7408 13.7408 15.9623 15.9623 16.2715 16.2715 k =-0.1722 0.3083 0.3531 ( 6209 PWs) bands (ev): -79.7965 -79.7965 -79.7914 -79.7914 -45.4906 -45.4906 -45.4738 -45.4738 -43.8162 -43.8162 -43.7870 -43.7870 -43.6849 -43.6849 -43.6807 -43.6807 -28.1024 -28.1024 -9.4483 -9.4483 -9.1001 -9.1001 -9.0240 -9.0240 2.4413 2.4413 5.0658 5.0658 7.3403 7.3403 8.2932 8.2932 8.9083 8.9083 9.2159 9.2159 9.6079 9.6079 9.7383 9.7383 9.8238 9.8238 10.6608 10.6608 10.7384 10.7384 10.7467 10.7467 10.8274 10.8274 11.5111 11.5111 12.0999 12.0999 13.2710 13.2710 13.6576 13.6576 15.8880 15.8880 16.2900 16.2900 k =-0.1660 0.2973 0.3405 ( 6209 PWs) bands (ev): -79.7967 -79.7967 -79.7912 -79.7912 -45.4912 -45.4912 -45.4732 -45.4732 -43.8172 -43.8172 -43.7860 -43.7860 -43.6851 -43.6851 -43.6805 -43.6805 -28.1026 -28.1026 -9.4467 -9.4467 -9.0984 -9.0984 -9.0243 -9.0243 2.3830 2.3830 5.1033 5.1033 7.3466 7.3466 8.2922 8.2922 8.9021 8.9021 9.2632 9.2632 9.5916 9.5916 9.7550 9.7550 9.8008 9.8008 10.6893 10.6893 10.7625 10.7625 10.7783 10.7783 10.8492 10.8492 11.4729 11.4729 12.0992 12.0992 13.3102 13.3102 13.5757 13.5757 15.8098 15.8098 16.3112 16.3112 k =-0.1599 0.2863 0.3279 ( 6213 PWs) bands (ev): -79.7970 -79.7970 -79.7910 -79.7910 -45.4918 -45.4918 -45.4727 -45.4727 -43.8183 -43.8183 -43.7850 -43.7850 -43.6852 -43.6852 -43.6804 -43.6804 -28.1028 -28.1028 -9.4451 -9.4451 -9.0966 -9.0966 -9.0246 -9.0246 2.3255 2.3255 5.1382 5.1382 7.3462 7.3462 8.2989 8.2989 8.8966 8.8966 9.3125 9.3125 9.5759 9.5759 9.7433 9.7433 9.8065 9.8065 10.7162 10.7162 10.7870 10.7870 10.8104 10.8104 10.8718 10.8718 11.4378 11.4378 12.1018 12.1018 13.3510 13.3510 13.4951 13.4951 15.7297 15.7297 16.3343 16.3343 k =-0.1537 0.2753 0.3153 ( 6221 PWs) bands (ev): -79.7975 -79.7975 -79.7908 -79.7908 -45.4924 -45.4924 -45.4722 -45.4722 -43.8192 -43.8192 -43.7840 -43.7840 -43.6853 -43.6853 -43.6802 -43.6802 -28.1030 -28.1030 -9.4435 -9.4435 -9.0947 -9.0947 -9.0250 -9.0250 2.2688 2.2688 5.1704 5.1704 7.3391 7.3391 8.3128 8.3128 8.8920 8.8920 9.3632 9.3632 9.5620 9.5620 9.7157 9.7157 9.8293 9.8293 10.7410 10.7410 10.8113 10.8113 10.8413 10.8413 10.8949 10.8949 11.4065 11.4065 12.1074 12.1074 13.3902 13.3902 13.4189 13.4189 15.6491 15.6491 16.3597 16.3597 k =-0.1476 0.2643 0.3027 ( 6225 PWs) bands (ev): -79.7975 -79.7975 -79.7909 -79.7909 -45.4930 -45.4930 -45.4715 -45.4715 -43.8203 -43.8203 -43.7830 -43.7830 -43.6855 -43.6855 -43.6801 -43.6801 -28.1032 -28.1032 -9.4418 -9.4418 -9.0926 -9.0926 -9.0254 -9.0254 2.2133 2.2133 5.2000 5.2000 7.3260 7.3260 8.3334 8.3334 8.8882 8.8882 9.4133 9.4133 9.5513 9.5513 9.6861 9.6861 9.8550 9.8550 10.7634 10.7634 10.8364 10.8364 10.8728 10.8728 10.9190 10.9190 11.3793 11.3793 12.1169 12.1169 13.3348 13.3348 13.4400 13.4400 15.5690 15.5690 16.3869 16.3869 k =-0.1414 0.2533 0.2901 ( 6215 PWs) bands (ev): -79.7974 -79.7974 -79.7907 -79.7907 -45.4936 -45.4936 -45.4709 -45.4709 -43.8212 -43.8212 -43.7819 -43.7819 -43.6856 -43.6856 -43.6799 -43.6799 -28.1035 -28.1035 -9.4402 -9.4402 -9.0906 -9.0906 -9.0257 -9.0257 2.1591 2.1591 5.2272 5.2272 7.3079 7.3079 8.3598 8.3598 8.8856 8.8856 9.4568 9.4568 9.5502 9.5502 9.6570 9.6570 9.8817 9.8817 10.7836 10.7836 10.8621 10.8621 10.9032 10.9032 10.9447 10.9447 11.3569 11.3569 12.1306 12.1306 13.2580 13.2580 13.4858 13.4858 15.4904 15.4904 16.4163 16.4163 k =-0.1353 0.2422 0.2775 ( 6209 PWs) bands (ev): -79.7976 -79.7976 -79.7903 -79.7903 -45.4940 -45.4940 -45.4704 -45.4704 -43.8220 -43.8220 -43.7810 -43.7810 -43.6857 -43.6857 -43.6798 -43.6798 -28.1037 -28.1037 -9.4385 -9.4385 -9.0884 -9.0884 -9.0261 -9.0261 2.1063 2.1063 5.2518 5.2518 7.2854 7.2854 8.3908 8.3908 8.8836 8.8836 9.4793 9.4793 9.5726 9.5726 9.6279 9.6279 9.9083 9.9083 10.8006 10.8006 10.8881 10.8881 10.9313 10.9313 10.9717 10.9717 11.3390 11.3390 12.1480 12.1480 13.1826 13.1826 13.5337 13.5337 15.4133 15.4133 16.4483 16.4483 k =-0.1291 0.2312 0.2648 ( 6211 PWs) bands (ev): -79.7978 -79.7978 -79.7901 -79.7901 -45.4945 -45.4945 -45.4699 -45.4699 -43.8229 -43.8229 -43.7801 -43.7801 -43.6858 -43.6858 -43.6796 -43.6796 -28.1039 -28.1039 -9.4368 -9.4368 -9.0862 -9.0862 -9.0265 -9.0265 2.0550 2.0550 5.2741 5.2741 7.2599 7.2599 8.4249 8.4249 8.8823 8.8823 9.4798 9.4798 9.5990 9.5990 9.6186 9.6186 9.9348 9.9348 10.8142 10.8142 10.9137 10.9137 10.9564 10.9564 11.0006 11.0006 11.3262 11.3262 12.1694 12.1694 13.1079 13.1079 13.5831 13.5831 15.3385 15.3385 16.4823 16.4823 k =-0.1230 0.2202 0.2522 ( 6201 PWs) bands (ev): -79.7977 -79.7977 -79.7898 -79.7898 -45.4949 -45.4949 -45.4693 -45.4693 -43.8237 -43.8237 -43.7792 -43.7792 -43.6859 -43.6859 -43.6795 -43.6795 -28.1041 -28.1041 -9.4352 -9.4352 -9.0840 -9.0840 -9.0268 -9.0268 2.0054 2.0054 5.2941 5.2941 7.2320 7.2320 8.4615 8.4615 8.8818 8.8818 9.4728 9.4728 9.5714 9.5714 9.6733 9.6733 9.9615 9.9615 10.8249 10.8249 10.9397 10.9397 10.9802 10.9802 11.0318 11.0318 11.3191 11.3191 12.1951 12.1951 13.0351 13.0351 13.6340 13.6340 15.2661 15.2661 16.5185 16.5185 k =-0.1168 0.2092 0.2396 ( 6209 PWs) bands (ev): -79.7983 -79.7983 -79.7895 -79.7895 -45.4954 -45.4954 -45.4690 -45.4690 -43.8245 -43.8245 -43.7784 -43.7784 -43.6860 -43.6860 -43.6794 -43.6794 -28.1044 -28.1044 -9.4336 -9.4336 -9.0817 -9.0817 -9.0272 -9.0272 1.9575 1.9575 5.3120 5.3120 7.2025 7.2025 8.4997 8.4997 8.8816 8.8816 9.4636 9.4636 9.5435 9.5435 9.7307 9.7307 9.9870 9.9870 10.8322 10.8322 10.9639 10.9639 11.0008 11.0008 11.0634 11.0634 11.3174 11.3174 12.2249 12.2249 12.9628 12.9628 13.6863 13.6863 15.1964 15.1964 16.5568 16.5568 k =-0.1107 0.1982 0.2270 ( 6209 PWs) bands (ev): -79.7985 -79.7985 -79.7894 -79.7894 -45.4958 -45.4958 -45.4685 -45.4685 -43.8252 -43.8252 -43.7777 -43.7777 -43.6861 -43.6861 -43.6793 -43.6793 -28.1046 -28.1046 -9.4321 -9.4321 -9.0795 -9.0795 -9.0275 -9.0275 1.9116 1.9116 5.3278 5.3278 7.1723 7.1723 8.5385 8.5385 8.8825 8.8825 9.4538 9.4538 9.5175 9.5175 9.7885 9.7885 10.0124 10.0124 10.8368 10.8368 10.9868 10.9868 11.0206 11.0206 11.0963 11.0963 11.3223 11.3223 12.2588 12.2588 12.8918 12.8918 13.7399 13.7399 15.1297 15.1297 16.5972 16.5972 k =-0.1045 0.1872 0.2144 ( 6205 PWs) bands (ev): -79.7986 -79.7986 -79.7891 -79.7891 -45.4962 -45.4962 -45.4681 -45.4681 -43.8259 -43.8259 -43.7769 -43.7769 -43.6861 -43.6861 -43.6792 -43.6792 -28.1048 -28.1048 -9.4306 -9.4306 -9.0772 -9.0772 -9.0279 -9.0279 1.8676 1.8676 5.3418 5.3418 7.1418 7.1418 8.5773 8.5773 8.8839 8.8839 9.4434 9.4434 9.4928 9.4928 9.8454 9.8454 10.0375 10.0375 10.8394 10.8394 11.0072 11.0072 11.0410 11.0410 11.1304 11.1304 11.3325 11.3325 12.2966 12.2966 12.8227 12.8227 13.7947 13.7947 15.0662 15.0662 16.6395 16.6395 k =-0.0984 0.1762 0.2018 ( 6207 PWs) bands (ev): -79.7987 -79.7987 -79.7891 -79.7891 -45.4966 -45.4966 -45.4677 -45.4677 -43.8266 -43.8266 -43.7762 -43.7762 -43.6862 -43.6862 -43.6790 -43.6790 -28.1050 -28.1050 -9.4291 -9.4291 -9.0750 -9.0750 -9.0282 -9.0282 1.8257 1.8257 5.3540 5.3540 7.1115 7.1115 8.6154 8.6154 8.8862 8.8862 9.4317 9.4317 9.4709 9.4709 9.9006 9.9006 10.0615 10.0615 10.8400 10.8400 11.0244 11.0244 11.0618 11.0618 11.1645 11.1645 11.3475 11.3475 12.3380 12.3380 12.7542 12.7542 13.8505 13.8505 15.0059 15.0059 16.6837 16.6837 k =-0.0922 0.1652 0.1892 ( 6211 PWs) bands (ev): -79.7988 -79.7988 -79.7891 -79.7891 -45.4970 -45.4970 -45.4673 -45.4673 -43.8273 -43.8273 -43.7755 -43.7755 -43.6864 -43.6864 -43.6789 -43.6789 -28.1052 -28.1052 -9.4278 -9.4278 -9.0729 -9.0729 -9.0285 -9.0285 1.7860 1.7860 5.3646 5.3646 7.0817 7.0817 8.6525 8.6525 8.8891 8.8891 9.4177 9.4177 9.4530 9.4530 9.9531 9.9531 10.0849 10.0849 10.8395 10.8395 11.0387 11.0387 11.0826 11.0826 11.1990 11.1990 11.3668 11.3668 12.3826 12.3826 12.6866 12.6866 13.9071 13.9071 14.9490 14.9490 16.7298 16.7298 k =-0.0861 0.1542 0.1766 ( 6219 PWs) bands (ev): -79.7991 -79.7991 -79.7891 -79.7891 -45.4974 -45.4974 -45.4670 -45.4670 -43.8280 -43.8280 -43.7748 -43.7748 -43.6865 -43.6865 -43.6789 -43.6789 -28.1055 -28.1055 -9.4265 -9.4265 -9.0708 -9.0708 -9.0287 -9.0287 1.7485 1.7485 5.3737 5.3737 7.0529 7.0529 8.6880 8.6880 8.8925 8.8925 9.4002 9.4002 9.4396 9.4396 10.0024 10.0024 10.1072 10.1072 10.8385 10.8385 11.0504 11.0504 11.1033 11.1033 11.2340 11.2340 11.3901 11.3901 12.4300 12.4300 12.6205 12.6205 13.9642 13.9642 14.8957 14.8957 16.7777 16.7777 k =-0.0799 0.1431 0.1639 ( 6223 PWs) bands (ev): -79.7992 -79.7992 -79.7892 -79.7892 -45.4978 -45.4978 -45.4666 -45.4666 -43.8286 -43.8286 -43.7742 -43.7742 -43.6866 -43.6866 -43.6788 -43.6788 -28.1057 -28.1057 -9.4252 -9.4252 -9.0687 -9.0687 -9.0289 -9.0289 1.7134 1.7134 5.3815 5.3815 7.0252 7.0252 8.7222 8.7222 8.8964 8.8964 9.3805 9.3805 9.4298 9.4298 10.0478 10.0478 10.1286 10.1286 10.8380 10.8380 11.0601 11.0601 11.1235 11.1235 11.2696 11.2696 11.4177 11.4177 12.4792 12.4792 12.5560 12.5560 14.0216 14.0216 14.8462 14.8462 16.8271 16.8271 k =-0.0738 0.1321 0.1513 ( 6223 PWs) bands (ev): -79.7993 -79.7993 -79.7891 -79.7891 -45.4981 -45.4981 -45.4663 -45.4663 -43.8291 -43.8291 -43.7736 -43.7736 -43.6867 -43.6867 -43.6787 -43.6787 -28.1058 -28.1058 -9.4241 -9.4241 -9.0668 -9.0668 -9.0291 -9.0291 1.6806 1.6806 5.3882 5.3882 6.9988 6.9988 8.7543 8.7543 8.9007 8.9007 9.3603 9.3603 9.4223 9.4223 10.0890 10.0890 10.1491 10.1491 10.8382 10.8382 11.0680 11.0680 11.1435 11.1435 11.3064 11.3064 11.4480 11.4480 12.4898 12.4898 12.5338 12.5338 14.0789 14.0789 14.8003 14.8003 16.8782 16.8782 k =-0.0676 0.1211 0.1387 ( 6223 PWs) bands (ev): -79.7995 -79.7995 -79.7888 -79.7888 -45.4984 -45.4984 -45.4660 -45.4660 -43.8296 -43.8296 -43.7731 -43.7731 -43.6867 -43.6867 -43.6787 -43.6787 -28.1060 -28.1060 -9.4230 -9.4230 -9.0650 -9.0650 -9.0293 -9.0293 1.6502 1.6502 5.3938 5.3938 6.9740 6.9740 8.7844 8.7844 8.9057 8.9057 9.3400 9.3400 9.4163 9.4163 10.1253 10.1253 10.1688 10.1688 10.8395 10.8395 11.0740 11.0740 11.1610 11.1610 11.3442 11.3442 11.4810 11.4810 12.4297 12.4297 12.5848 12.5848 14.1361 14.1361 14.7584 14.7584 16.9079 16.9079 k =-0.0615 0.1101 0.1261 ( 6219 PWs) bands (ev): -79.7996 -79.7996 -79.7886 -79.7886 -45.4986 -45.4986 -45.4657 -45.4657 -43.8300 -43.8300 -43.7726 -43.7726 -43.6868 -43.6868 -43.6786 -43.6786 -28.1062 -28.1062 -9.4220 -9.4220 -9.0633 -9.0633 -9.0294 -9.0294 1.6223 1.6223 5.3986 5.3986 6.9510 6.9510 8.8123 8.8123 8.9113 8.9113 9.3207 9.3207 9.4114 9.4114 10.1567 10.1567 10.1872 10.1872 10.8414 10.8414 11.0794 11.0794 11.1774 11.1774 11.3821 11.3821 11.5157 11.5157 12.3690 12.3690 12.6372 12.6372 14.1927 14.1927 14.7206 14.7206 16.8231 16.8231 k =-0.0553 0.0991 0.1135 ( 6235 PWs) bands (ev): -79.7997 -79.7997 -79.7891 -79.7891 -45.4990 -45.4990 -45.4655 -45.4655 -43.8305 -43.8305 -43.7722 -43.7722 -43.6870 -43.6870 -43.6785 -43.6785 -28.1063 -28.1063 -9.4212 -9.4212 -9.0618 -9.0618 -9.0294 -9.0294 1.5969 1.5969 5.4024 5.4024 6.9299 6.9299 8.8365 8.8365 8.9167 8.9167 9.3022 9.3022 9.4066 9.4066 10.1827 10.1827 10.2049 10.2049 10.8439 10.8439 11.0835 11.0835 11.1924 11.1924 11.4203 11.4203 11.5510 11.5510 12.3089 12.3089 12.6885 12.6885 14.2472 14.2472 14.6858 14.6858 16.7405 16.7405 k =-0.0492 0.0881 0.1009 ( 6231 PWs) bands (ev): -79.7996 -79.7996 -79.7890 -79.7890 -45.4992 -45.4992 -45.4652 -45.4652 -43.8309 -43.8309 -43.7718 -43.7718 -43.6870 -43.6870 -43.6784 -43.6784 -28.1065 -28.1065 -9.4204 -9.4204 -9.0604 -9.0604 -9.0295 -9.0295 1.5741 1.5741 5.4056 5.4056 6.9108 6.9108 8.8590 8.8590 8.9229 8.9229 9.2850 9.2850 9.4028 9.4028 10.2036 10.2036 10.2221 10.2221 10.8478 10.8478 11.0871 11.0871 11.2060 11.2060 11.4596 11.4596 11.5871 11.5871 12.2505 12.2505 12.7384 12.7384 14.3002 14.3002 14.6557 14.6557 16.6627 16.6627 k =-0.0430 0.0771 0.0883 ( 6231 PWs) bands (ev): -79.7995 -79.7995 -79.7891 -79.7891 -45.4995 -45.4995 -45.4650 -45.4650 -43.8313 -43.8313 -43.7714 -43.7714 -43.6871 -43.6871 -43.6784 -43.6784 -28.1066 -28.1066 -9.4197 -9.4197 -9.0592 -9.0592 -9.0295 -9.0295 1.5539 1.5539 5.4081 5.4081 6.8937 6.8937 8.8786 8.8786 8.9297 8.9297 9.2692 9.2692 9.3995 9.3995 10.2198 10.2198 10.2384 10.2384 10.8510 10.8510 11.0898 11.0898 11.2185 11.2185 11.4996 11.4996 11.6220 11.6220 12.1932 12.1932 12.7855 12.7855 14.3509 14.3509 14.6294 14.6294 16.5905 16.5905 k =-0.0369 0.0661 0.0757 ( 6231 PWs) bands (ev): -79.7994 -79.7994 -79.7892 -79.7892 -45.4997 -45.4997 -45.4648 -45.4648 -43.8316 -43.8316 -43.7710 -43.7710 -43.6872 -43.6872 -43.6783 -43.6783 -28.1067 -28.1067 -9.4190 -9.4190 -9.0581 -9.0581 -9.0295 -9.0295 1.5363 1.5363 5.4101 5.4101 6.8787 6.8787 8.8950 8.8950 8.9364 8.9364 9.2546 9.2546 9.3967 9.3967 10.2328 10.2328 10.2529 10.2529 10.8552 10.8552 11.0917 11.0917 11.2293 11.2293 11.5404 11.5404 11.6550 11.6550 12.1373 12.1373 12.8288 12.8288 14.3977 14.3977 14.6069 14.6069 16.5247 16.5247 k =-0.0307 0.0551 0.0631 ( 6239 PWs) bands (ev): -79.7996 -79.7996 -79.7893 -79.7893 -45.4999 -45.4999 -45.4647 -45.4647 -43.8319 -43.8319 -43.7708 -43.7708 -43.6872 -43.6872 -43.6783 -43.6783 -28.1068 -28.1068 -9.4185 -9.4185 -9.0572 -9.0572 -9.0294 -9.0294 1.5214 1.5214 5.4117 5.4117 6.8659 6.8659 8.9082 8.9082 8.9430 8.9430 9.2416 9.2416 9.3944 9.3944 10.2428 10.2428 10.2648 10.2648 10.8593 10.8593 11.0931 11.0931 11.2372 11.2372 11.5817 11.5817 11.6844 11.6844 12.0830 12.0830 12.8674 12.8674 14.4398 14.4398 14.5879 14.5879 16.4663 16.4663 k =-0.0246 0.0440 0.0504 ( 6249 PWs) bands (ev): -79.7999 -79.7999 -79.7894 -79.7894 -45.5000 -45.5000 -45.4646 -45.4646 -43.8321 -43.8321 -43.7707 -43.7707 -43.6873 -43.6873 -43.6783 -43.6783 -28.1069 -28.1069 -9.4181 -9.4181 -9.0565 -9.0565 -9.0294 -9.0294 1.5091 1.5091 5.4129 5.4129 6.8554 6.8554 8.9183 8.9183 8.9495 8.9495 9.2304 9.2304 9.3924 9.3924 10.2504 10.2504 10.2741 10.2741 10.8632 10.8632 11.0941 11.0941 11.2436 11.2436 11.6234 11.6234 11.7098 11.7098 12.0305 12.0305 12.9004 12.9004 14.4764 14.4764 14.5724 14.5724 16.4164 16.4164 k =-0.0184 0.0330 0.0378 ( 6243 PWs) bands (ev): -79.7998 -79.7998 -79.7892 -79.7892 -45.5001 -45.5001 -45.4645 -45.4645 -43.8322 -43.8322 -43.7705 -43.7705 -43.6872 -43.6872 -43.6782 -43.6782 -28.1069 -28.1069 -9.4178 -9.4178 -9.0559 -9.0559 -9.0293 -9.0293 1.4996 1.4996 5.4139 5.4139 6.8473 6.8473 8.9263 8.9263 8.9556 8.9556 9.2216 9.2216 9.3911 9.3911 10.2565 10.2565 10.2814 10.2814 10.8669 10.8669 11.0950 11.0950 11.2492 11.2492 11.6654 11.6654 11.7311 11.7311 11.9804 11.9804 12.9271 12.9271 14.5065 14.5065 14.5614 14.5614 16.3761 16.3761 k =-0.0123 0.0220 0.0252 ( 6239 PWs) bands (ev): -79.7999 -79.7999 -79.7891 -79.7891 -45.5001 -45.5001 -45.4644 -45.4644 -43.8323 -43.8323 -43.7704 -43.7704 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4175 -9.4175 -9.0555 -9.0555 -9.0293 -9.0293 1.4927 1.4927 5.4144 5.4144 6.8414 6.8414 8.9320 8.9320 8.9608 8.9608 9.2154 9.2154 9.3898 9.3898 10.2604 10.2604 10.2863 10.2863 10.8690 10.8690 11.0958 11.0958 11.2532 11.2532 11.7065 11.7065 11.7464 11.7464 11.9346 11.9346 12.9467 12.9467 14.5292 14.5292 14.5538 14.5538 16.3464 16.3464 k =-0.0061 0.0110 0.0126 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4174 -9.4174 -9.0553 -9.0553 -9.0293 -9.0293 1.4886 1.4886 5.4148 5.4148 6.8378 6.8378 8.9353 8.9353 8.9640 8.9640 9.2114 9.2114 9.3894 9.3894 10.2629 10.2629 10.2893 10.2893 10.8706 10.8706 11.0961 11.0961 11.2555 11.2555 11.7415 11.7415 11.7565 11.7565 11.8957 11.8957 12.9586 12.9586 14.5427 14.5427 14.5497 14.5497 16.3282 16.3282 k = 0.0000 0.0000 0.0000 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4173 -9.4173 -9.0552 -9.0552 -9.0293 -9.0293 1.4873 1.4873 5.4149 5.4149 6.8366 6.8366 8.9363 8.9363 8.9650 8.9650 9.2101 9.2101 9.3892 9.3892 10.2637 10.2637 10.2903 10.2903 10.8711 10.8711 11.0962 11.0962 11.2563 11.2563 11.7554 11.7554 11.7627 11.7627 11.8777 11.8777 12.9626 12.9626 14.5461 14.5461 14.5494 14.5494 16.3221 16.3221 k = 0.0000 0.0000 0.0000 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4173 -9.4173 -9.0552 -9.0552 -9.0293 -9.0293 1.4873 1.4873 5.4149 5.4149 6.8366 6.8366 8.9363 8.9363 8.9650 8.9650 9.2101 9.2101 9.3892 9.3892 10.2637 10.2637 10.2903 10.2903 10.8711 10.8711 11.0962 11.0962 11.2563 11.2563 11.7554 11.7554 11.7627 11.7627 11.8777 11.8777 12.9626 12.9626 14.5461 14.5461 14.5494 14.5494 16.3221 16.3221 k = 0.0156 0.0087-0.0000 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4173 -9.4173 -9.0552 -9.0552 -9.0293 -9.0293 1.4887 1.4887 5.4070 5.4070 6.8430 6.8430 8.9364 8.9364 8.9652 8.9652 9.2101 9.2101 9.3893 9.3893 10.2631 10.2631 10.2896 10.2896 10.8693 10.8693 11.0985 11.0985 11.2564 11.2564 11.7554 11.7554 11.7628 11.7628 11.8777 11.8777 12.9652 12.9652 14.5487 14.5487 14.5520 14.5520 16.3218 16.3218 k = 0.0312 0.0174-0.0000 ( 6235 PWs) bands (ev): -79.7999 -79.7999 -79.7889 -79.7889 -45.5001 -45.5001 -45.4644 -45.4644 -43.8324 -43.8324 -43.7703 -43.7703 -43.6872 -43.6872 -43.6782 -43.6782 -28.1070 -28.1070 -9.4174 -9.4174 -9.0552 -9.0552 -9.0293 -9.0293 1.4930 1.4930 5.3836 5.3836 6.8615 6.8615 8.9369 8.9369 8.9657 8.9657 9.2103 9.2103 9.3895 9.3895 10.2612 10.2612 10.2876 10.2876 10.8636 10.8636 11.1054 11.1054 11.2567 11.2567 11.7554 11.7554 11.7630 11.7630 11.8777 11.8777 12.9728 12.9728 14.5563 14.5563 14.5597 14.5597 16.3208 16.3208 k = 0.0469 0.0262-0.0000 ( 6255 PWs) bands (ev): -79.8000 -79.8000 -79.7895 -79.7895 -45.5003 -45.5003 -45.4644 -45.4644 -43.8325 -43.8325 -43.7703 -43.7703 -43.6873 -43.6873 -43.6782 -43.6782 -28.1070 -28.1070 -9.4174 -9.4174 -9.0552 -9.0552 -9.0295 -9.0295 1.5001 1.5001 5.3459 5.3459 6.8907 6.8907 8.9366 8.9366 8.9656 8.9656 9.2106 9.2106 9.3894 9.3894 10.2578 10.2578 10.2839 10.2839 10.8550 10.8550 11.1166 11.1166 11.2571 11.2571 11.7553 11.7553 11.7632 11.7632 11.8757 11.8757 12.9853 12.9853 14.5679 14.5679 14.5715 14.5715 16.3191 16.3191 k = 0.0625 0.0349-0.0000 ( 6247 PWs) bands (ev): -79.7997 -79.7997 -79.7895 -79.7895 -45.5003 -45.5003 -45.4643 -45.4643 -43.8325 -43.8325 -43.7702 -43.7702 -43.6873 -43.6873 -43.6782 -43.6782 -28.1070 -28.1070 -9.4174 -9.4174 -9.0552 -9.0552 -9.0296 -9.0296 1.5101 1.5101 5.2961 5.2961 6.9289 6.9289 8.9377 8.9377 8.9668 8.9668 9.2115 9.2115 9.3901 9.3901 10.2539 10.2539 10.2796 10.2796 10.8423 10.8423 11.1328 11.1328 11.2583 11.2583 11.7559 11.7559 11.7643 11.7643 11.8756 11.8756 13.0025 13.0025 14.5856 14.5856 14.5893 14.5893 16.3169 16.3169 k = 0.0781 0.0436-0.0000 ( 6247 PWs) bands (ev): -79.7997 -79.7997 -79.7895 -79.7895 -45.5003 -45.5003 -45.4643 -45.4643 -43.8325 -43.8325 -43.7702 -43.7702 -43.6873 -43.6873 -43.6782 -43.6782 -28.1070 -28.1070 -9.4175 -9.4175 -9.0552 -9.0552 -9.0298 -9.0298 1.5230 1.5230 5.2360 5.2360 6.9739 6.9739 8.9392 8.9392 8.9683 8.9683 9.2120 9.2120 9.3912 9.3912 10.2484 10.2484 10.2737 10.2737 10.8267 10.8267 11.1535 11.1535 11.2590 11.2590 11.7561 11.7561 11.7652 11.7652 11.8756 11.8756 13.0240 13.0240 14.6081 14.6081 14.6120 14.6120 16.3140 16.3140 k = 0.0938 0.0523-0.0000 ( 6215 PWs) bands (ev): -79.7994 -79.7994 -79.7887 -79.7887 -45.5001 -45.5001 -45.4642 -45.4642 -43.8324 -43.8324 -43.7702 -43.7702 -43.6871 -43.6871 -43.6780 -43.6780 -28.1070 -28.1070 -9.4176 -9.4176 -9.0552 -9.0552 -9.0300 -9.0300 1.5387 1.5387 5.1676 5.1676 7.0238 7.0238 8.9426 8.9426 8.9719 8.9719 9.2126 9.2126 9.3931 9.3931 10.2420 10.2420 10.2668 10.2668 10.8087 10.8087 11.1801 11.1801 11.2599 11.2599 11.7569 11.7569 11.7666 11.7666 11.8768 11.8768 13.0496 13.0496 14.6371 14.6371 14.6414 14.6414 16.3106 16.3106 k = 0.1094 0.0611-0.0000 ( 6215 PWs) bands (ev): -79.7994 -79.7994 -79.7887 -79.7887 -45.5001 -45.5001 -45.4642 -45.4642 -43.8324 -43.8324 -43.7702 -43.7702 -43.6871 -43.6871 -43.6780 -43.6780 -28.1070 -28.1070 -9.4177 -9.4177 -9.0552 -9.0552 -9.0303 -9.0303 1.5571 1.5571 5.0925 5.0925 7.0765 7.0765 8.9446 8.9446 8.9741 8.9741 9.2129 9.2129 9.3954 9.3954 10.2340 10.2340 10.2582 10.2582 10.7880 10.7880 11.2112 11.2112 11.2607 11.2607 11.7573 11.7573 11.7677 11.7677 11.8768 11.8768 13.0787 13.0787 14.6688 14.6688 14.6735 14.6735 16.3066 16.3066 k = 0.1250 0.0698-0.0000 ( 6219 PWs) bands (ev): -79.7996 -79.7996 -79.7887 -79.7887 -45.5001 -45.5001 -45.4643 -45.4643 -43.8324 -43.8324 -43.7702 -43.7702 -43.6871 -43.6871 -43.6780 -43.6780 -28.1070 -28.1070 -9.4178 -9.4178 -9.0552 -9.0552 -9.0306 -9.0306 1.5784 1.5784 5.0121 5.0121 7.1302 7.1302 8.9469 8.9469 8.9766 8.9766 9.2136 9.2136 9.3985 9.3985 10.2247 10.2247 10.2483 10.2483 10.7654 10.7654 11.2465 11.2465 11.2611 11.2611 11.7577 11.7577 11.7690 11.7690 11.8767 11.8767 13.1108 13.1108 14.7050 14.7050 14.7100 14.7100 16.3021 16.3021 k = 0.1406 0.0785-0.0000 ( 6219 PWs) bands (ev): -79.7996 -79.7996 -79.7887 -79.7887 -45.5001 -45.5001 -45.4643 -45.4643 -43.8324 -43.8324 -43.7702 -43.7702 -43.6871 -43.6871 -43.6781 -43.6781 -28.1070 -28.1070 -9.4179 -9.4179 -9.0551 -9.0551 -9.0309 -9.0309 1.6024 1.6024 4.9275 4.9275 7.1840 7.1840 8.9495 8.9495 8.9795 8.9795 9.2144 9.2144 9.4025 9.4025 10.2149 10.2149 10.2379 10.2379 10.7412 10.7412 11.2620 11.2620 11.2864 11.2864 11.7587 11.7587 11.7708 11.7708 11.8767 11.8767 13.1455 13.1455 14.7453 14.7453 14.7507 14.7507 16.2972 16.2972 k = 0.1562 0.0872-0.0000 ( 6215 PWs) bands (ev): -79.7997 -79.7997 -79.7884 -79.7884 -45.5000 -45.5000 -45.4643 -45.4643 -43.8324 -43.8324 -43.7703 -43.7703 -43.6870 -43.6870 -43.6781 -43.6781 -28.1070 -28.1070 -9.4180 -9.4180 -9.0551 -9.0551 -9.0313 -9.0313 1.6292 1.6292 4.8398 4.8398 7.2364 7.2364 8.9529 8.9529 8.9832 8.9832 9.2153 9.2153 9.4074 9.4074 10.2041 10.2041 10.2265 10.2265 10.7159 10.7159 11.2627 11.2627 11.3307 11.3307 11.7600 11.7600 11.7729 11.7729 11.8769 11.8769 13.1825 13.1825 14.7902 14.7902 14.7960 14.7960 16.2918 16.2918 k = 0.1719 0.0960-0.0000 ( 6215 PWs) bands (ev): -79.7997 -79.7997 -79.7884 -79.7884 -45.5000 -45.5000 -45.4643 -45.4643 -43.8324 -43.8324 -43.7703 -43.7703 -43.6870 -43.6870 -43.6781 -43.6781 -28.1069 -28.1069 -9.4182 -9.4182 -9.0551 -9.0551 -9.0317 -9.0317 1.6587 1.6587 4.7497 4.7497 7.2871 7.2871 8.9560 8.9560 8.9866 8.9866 9.2163 9.2163 9.4135 9.4135 10.1926 10.1926 10.2143 10.2143 10.6896 10.6896 11.2635 11.2635 11.3805 11.3805 11.7617 11.7617 11.7753 11.7753 11.8769 11.8769 13.2210 13.2210 14.8381 14.8381 14.8444 14.8444 16.2861 16.2861 k = 0.1875 0.1047-0.0000 ( 6231 PWs) bands (ev): -79.8003 -79.8003 -79.7884 -79.7884 -45.5000 -45.5000 -45.4645 -45.4645 -43.8324 -43.8324 -43.7704 -43.7704 -43.6870 -43.6870 -43.6782 -43.6782 -28.1069 -28.1069 -9.4183 -9.4183 -9.0551 -9.0551 -9.0321 -9.0321 1.6908 1.6908 4.6577 4.6577 7.3350 7.3350 8.9593 8.9593 8.9903 8.9903 9.2162 9.2162 9.4207 9.4207 10.1799 10.1799 10.2011 10.2011 10.6629 10.6629 11.2622 11.2622 11.4346 11.4346 11.7632 11.7632 11.7774 11.7774 11.8769 11.8769 13.2606 13.2606 14.8894 14.8894 14.8962 14.8962 16.2801 16.2801 k = 0.2031 0.1134-0.0000 ( 6227 PWs) bands (ev): -79.8002 -79.8002 -79.7884 -79.7884 -45.5000 -45.5000 -45.4645 -45.4645 -43.8324 -43.8324 -43.7704 -43.7704 -43.6870 -43.6870 -43.6782 -43.6782 -28.1069 -28.1069 -9.4185 -9.4185 -9.0551 -9.0551 -9.0325 -9.0325 1.7257 1.7257 4.5645 4.5645 7.3798 7.3798 8.9628 8.9628 8.9942 8.9942 9.2181 9.2181 9.4293 9.4293 10.1670 10.1670 10.1876 10.1876 10.6359 10.6359 11.2629 11.2629 11.4944 11.4944 11.7658 11.7658 11.7805 11.7805 11.8770 11.8770 13.3010 13.3010 14.9439 14.9439 14.9512 14.9512 16.2739 16.2739 k = 0.2188 0.1221-0.0000 ( 6223 PWs) bands (ev): -79.7997 -79.7997 -79.7887 -79.7887 -45.5001 -45.5001 -45.4643 -45.4643 -43.8324 -43.8324 -43.7703 -43.7703 -43.6871 -43.6871 -43.6781 -43.6781 -28.1069 -28.1069 -9.4186 -9.4186 -9.0551 -9.0551 -9.0329 -9.0329 1.7632 1.7632 4.4704 4.4704 7.4212 7.4212 8.9659 8.9659 8.9977 8.9977 9.2194 9.2194 9.4391 9.4391 10.1545 10.1545 10.1744 10.1744 10.6087 10.6087 11.2637 11.2637 11.5587 11.5587 11.7702 11.7702 11.7847 11.7847 11.8768 11.8768 13.3416 13.3416 15.0006 15.0006 15.0083 15.0083 16.2675 16.2675 k = 0.2344 0.1309-0.0000 ( 6231 PWs) bands (ev): -79.7996 -79.7996 -79.7892 -79.7892 -45.5002 -45.5002 -45.4643 -45.4643 -43.8324 -43.8324 -43.7703 -43.7703 -43.6873 -43.6873 -43.6780 -43.6780 -28.1069 -28.1069 -9.4188 -9.4188 -9.0551 -9.0551 -9.0334 -9.0334 1.8033 1.8033 4.3758 4.3758 7.4589 7.4589 8.9694 8.9694 9.0017 9.0017 9.2205 9.2205 9.4501 9.4501 10.1409 10.1409 10.1603 10.1603 10.5799 10.5799 11.2642 11.2642 11.6266 11.6266 11.7754 11.7754 11.7882 11.7882 11.8770 11.8770 13.3812 13.3812 15.0599 15.0599 15.0682 15.0682 16.2610 16.2610 k = 0.2500 0.1396-0.0000 ( 6211 PWs) bands (ev): -79.7996 -79.7996 -79.7884 -79.7884 -45.5000 -45.5000 -45.4643 -45.4643 -43.8323 -43.8323 -43.7703 -43.7703 -43.6871 -43.6871 -43.6780 -43.6780 -28.1069 -28.1069 -9.4189 -9.4189 -9.0551 -9.0551 -9.0338 -9.0338 1.8460 1.8460 4.2809 4.2809 7.4928 7.4928 8.9743 8.9743 9.0070 9.0070 9.2216 9.2216 9.4617 9.4617 10.1271 10.1271 10.1460 10.1460 10.5552 10.5552 11.2646 11.2646 11.6937 11.6937 11.7855 11.7855 11.7920 11.7920 11.8787 11.8787 13.4221 13.4221 15.1224 15.1224 15.1312 15.1312 16.2544 16.2544 k = 0.2656 0.1483-0.0000 ( 6207 PWs) bands (ev): -79.7995 -79.7995 -79.7885 -79.7885 -45.5000 -45.5000 -45.4643 -45.4643 -43.8323 -43.8323 -43.7703 -43.7703 -43.6871 -43.6871 -43.6780 -43.6780 -28.1069 -28.1069 -9.4191 -9.4191 -9.0551 -9.0551 -9.0342 -9.0342 1.8911 1.8911 4.1861 4.1861 7.5228 7.5228 8.9783 8.9783 9.0115 9.0115 9.2228 9.2228 9.4741 9.4741 10.1134 10.1134 10.1319 10.1319 10.5298 10.5298 11.2650 11.2650 11.7445 11.7445 11.7962 11.7962 11.8161 11.8161 11.8800 11.8800 13.4612 13.4612 15.1856 15.1856 15.1949 15.1949 16.2479 16.2479 k = 0.2812 0.1570-0.0000 ( 6215 PWs) bands (ev): -79.8001 -79.8001 -79.7882 -79.7882 -45.4999 -45.4999 -45.4644 -45.4644 -43.8322 -43.8322 -43.7704 -43.7704 -43.6871 -43.6871 -43.6782 -43.6782 -28.1068 -28.1068 -9.4192 -9.4192 -9.0551 -9.0551 -9.0347 -9.0347 1.9387 1.9387 4.0914 4.0914 7.5493 7.5493 8.9824 8.9824 9.0162 9.0162 9.2236 9.2236 9.4856 9.4856 10.0989 10.0989 10.1170 10.1170 10.5059 10.5059 11.2653 11.2653 11.7629 11.7629 11.7993 11.7993 11.8676 11.8676 11.8959 11.8959 13.4993 13.4993 15.2500 15.2500 15.2598 15.2598 16.2414 16.2414 k = 0.2969 0.1658-0.0000 ( 6211 PWs) bands (ev): -79.8001 -79.8001 -79.7880 -79.7880 -45.4999 -45.4999 -45.4644 -45.4644 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6782 -43.6782 -28.1068 -28.1068 -9.4194 -9.4194 -9.0551 -9.0551 -9.0351 -9.0351 1.9887 1.9887 3.9971 3.9971 7.5721 7.5721 8.9867 8.9867 9.0209 9.0209 9.2246 9.2246 9.4984 9.4984 10.0853 10.0853 10.1030 10.1030 10.4831 10.4831 11.2656 11.2656 11.7708 11.7708 11.8034 11.8034 11.8760 11.8760 11.9699 11.9699 13.5363 13.5363 15.3151 15.3151 15.3253 15.3253 16.2350 16.2350 k = 0.3125 0.1745-0.0000 ( 6203 PWs) bands (ev): -79.8001 -79.8001 -79.7878 -79.7878 -45.4998 -45.4998 -45.4645 -45.4645 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6782 -43.6782 -28.1068 -28.1068 -9.4196 -9.4196 -9.0551 -9.0551 -9.0355 -9.0355 2.0411 2.0411 3.9035 3.9035 7.5918 7.5918 8.9913 8.9913 9.0261 9.0261 9.2251 9.2251 9.5112 9.5112 10.0720 10.0720 10.0894 10.0894 10.4608 10.4608 11.2665 11.2665 11.7761 11.7761 11.8076 11.8076 11.8775 11.8775 12.0572 12.0572 13.5710 13.5710 15.3806 15.3806 15.3912 15.3912 16.2288 16.2288 k = 0.3281 0.1832-0.0000 ( 6215 PWs) bands (ev): -79.8006 -79.8006 -79.7878 -79.7878 -45.4998 -45.4998 -45.4646 -45.4646 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6784 -43.6784 -28.1068 -28.1068 -9.4197 -9.4197 -9.0551 -9.0551 -9.0359 -9.0359 2.0957 2.0957 3.8105 3.8105 7.6083 7.6083 8.9953 8.9953 9.0306 9.0306 9.2261 9.2261 9.5230 9.5230 10.0585 10.0585 10.0757 10.0757 10.4400 10.4400 11.2662 11.2662 11.7795 11.7795 11.8107 11.8107 11.8779 11.8779 12.1482 12.1482 13.6038 13.6038 15.4449 15.4449 15.4559 15.4559 16.2229 16.2229 k = 0.3438 0.1919-0.0000 ( 6218 PWs) bands (ev): -79.8007 -79.8007 -79.7878 -79.7878 -45.4998 -45.4998 -45.4646 -45.4646 -43.8322 -43.8322 -43.7705 -43.7705 -43.6870 -43.6870 -43.6784 -43.6784 -28.1068 -28.1068 -9.4198 -9.4198 -9.0551 -9.0551 -9.0363 -9.0363 2.1525 2.1525 3.7185 3.7185 7.6222 7.6222 8.9992 8.9992 9.0350 9.0350 9.2269 9.2269 9.5354 9.5354 10.0459 10.0459 10.0628 10.0628 10.4205 10.4205 11.2662 11.2662 11.7828 11.7828 11.8141 11.8141 11.8780 11.8780 12.2417 12.2417 13.6342 13.6342 15.5079 15.5079 15.5193 15.5193 16.2174 16.2174 k = 0.3594 0.2007-0.0000 ( 6210 PWs) bands (ev): -79.8004 -79.8004 -79.7878 -79.7878 -45.4998 -45.4998 -45.4646 -45.4646 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6784 -43.6784 -28.1068 -28.1068 -9.4200 -9.4200 -9.0550 -9.0550 -9.0366 -9.0366 2.2116 2.2116 3.6275 3.6275 7.6336 7.6336 9.0030 9.0030 9.0392 9.0392 9.2280 9.2280 9.5471 9.5471 10.0345 10.0345 10.0511 10.0511 10.4027 10.4027 11.2683 11.2683 11.7864 11.7864 11.8180 11.8180 11.8781 11.8781 12.3357 12.3357 13.6623 13.6623 15.5688 15.5688 15.5805 15.5805 16.2121 16.2121 k = 0.3750 0.2094-0.0000 ( 6210 PWs) bands (ev): -79.8005 -79.8005 -79.7878 -79.7878 -45.4998 -45.4998 -45.4646 -45.4646 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6784 -43.6784 -28.1068 -28.1068 -9.4201 -9.4201 -9.0550 -9.0550 -9.0370 -9.0370 2.2727 2.2727 3.5377 3.5377 7.6430 7.6430 9.0065 9.0065 9.0432 9.0432 9.2288 9.2288 9.5577 9.5577 10.0238 10.0238 10.0402 10.0402 10.3866 10.3866 11.2684 11.2684 11.7895 11.7895 11.8216 11.8216 11.8782 11.8782 12.4286 12.4286 13.6879 13.6879 15.6267 15.6267 15.6387 15.6387 16.2073 16.2073 k = 0.3906 0.2181-0.0000 ( 6210 PWs) bands (ev): -79.8005 -79.8005 -79.7878 -79.7878 -45.4998 -45.4998 -45.4646 -45.4646 -43.8322 -43.8322 -43.7704 -43.7704 -43.6870 -43.6870 -43.6784 -43.6784 -28.1068 -28.1068 -9.4202 -9.4202 -9.0550 -9.0550 -9.0373 -9.0373 2.3357 2.3357 3.4493 3.4493 7.6505 7.6505 9.0098 9.0098 9.0469 9.0469 9.2296 9.2296 9.5675 9.5675 10.0140 10.0140 10.0303 10.0303 10.3722 10.3722 11.2685 11.2685 11.7924 11.7924 11.8248 11.8248 11.8782 11.8782 12.5189 12.5189 13.7107 13.7107 15.6808 15.6808 15.6930 15.6930 16.2030 16.2030 k = 0.4062 0.2268-0.0000 ( 6202 PWs) bands (ev): -79.8005 -79.8005 -79.7875 -79.7875 -45.4997 -45.4997 -45.4646 -45.4646 -43.8321 -43.8321 -43.7704 -43.7704 -43.6869 -43.6869 -43.6784 -43.6784 -28.1067 -28.1067 -9.4203 -9.4203 -9.0550 -9.0550 -9.0375 -9.0375 2.4005 2.4005 3.3624 3.3624 7.6566 7.6566 9.0133 9.0133 9.0508 9.0508 9.2302 9.2302 9.5761 9.5761 10.0054 10.0054 10.0214 10.0214 10.3599 10.3599 11.2686 11.2686 11.7950 11.7950 11.8278 11.8278 11.8783 11.8783 12.6047 12.6047 13.7313 13.7313 15.7308 15.7308 15.7430 15.7430 16.1991 16.1991 k = 0.4219 0.2356-0.0000 ( 6202 PWs) bands (ev): -79.8005 -79.8005 -79.7875 -79.7875 -45.4997 -45.4997 -45.4646 -45.4646 -43.8321 -43.8321 -43.7704 -43.7704 -43.6869 -43.6869 -43.6784 -43.6784 -28.1067 -28.1067 -9.4204 -9.4204 -9.0550 -9.0550 -9.0377 -9.0377 2.4667 2.4667 3.2774 3.2774 7.6613 7.6613 9.0158 9.0158 9.0537 9.0537 9.2308 9.2308 9.5835 9.5835 9.9979 9.9979 10.0138 10.0138 10.3491 10.3491 11.2687 11.2687 11.7972 11.7972 11.8303 11.8303 11.8784 11.8784 12.6838 12.6838 13.7484 13.7484 15.7744 15.7744 15.7868 15.7868 16.1716 16.1716 k = 0.4375 0.2443-0.0000 ( 6190 PWs) bands (ev): -79.8005 -79.8005 -79.7870 -79.7870 -45.4996 -45.4996 -45.4646 -45.4646 -43.8320 -43.8320 -43.7704 -43.7704 -43.6868 -43.6868 -43.6784 -43.6784 -28.1067 -28.1067 -9.4204 -9.4204 -9.0550 -9.0550 -9.0379 -9.0379 2.5340 2.5340 3.1948 3.1948 7.6651 7.6651 9.0187 9.0187 9.0568 9.0568 9.2313 9.2313 9.5897 9.5897 9.9916 9.9916 10.0074 10.0074 10.3404 10.3404 11.2687 11.2687 11.7991 11.7991 11.8325 11.8325 11.8799 11.8799 12.7538 12.7538 13.7625 13.7625 15.8121 15.8121 15.8246 15.8246 16.0913 16.0913 k = 0.4531 0.2530-0.0000 ( 6186 PWs) bands (ev): -79.8007 -79.8007 -79.7867 -79.7867 -45.4995 -45.4995 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6867 -43.6867 -43.6785 -43.6785 -28.1067 -28.1067 -9.4205 -9.4205 -9.0550 -9.0550 -9.0381 -9.0381 2.6013 2.6013 3.1154 3.1154 7.6677 7.6677 9.0211 9.0211 9.0594 9.0594 9.2309 9.2309 9.5945 9.5945 9.9866 9.9866 10.0023 10.0023 10.3335 10.3335 11.2688 11.2688 11.8005 11.8005 11.8341 11.8341 11.8808 11.8808 12.8120 12.8120 13.7737 13.7737 15.8425 15.8425 15.8550 15.8550 16.0201 16.0201 k = 0.4688 0.2617-0.0000 ( 6194 PWs) bands (ev): -79.8007 -79.8007 -79.7870 -79.7870 -45.4996 -45.4996 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6869 -43.6869 -43.6785 -43.6785 -28.1067 -28.1067 -9.4205 -9.4205 -9.0550 -9.0550 -9.0382 -9.0382 2.6665 2.6665 3.0417 3.0417 7.6694 7.6694 9.0222 9.0222 9.0607 9.0607 9.2312 9.2312 9.5980 9.5980 9.9830 9.9830 9.9986 9.9986 10.3271 10.3271 11.2688 11.2688 11.8016 11.8016 11.8353 11.8353 11.8807 11.8807 12.8558 12.8558 13.7799 13.7799 15.8642 15.8642 15.8767 15.8767 15.9649 15.9649 k = 0.4844 0.2705-0.0000 ( 6190 PWs) bands (ev): -79.8007 -79.8007 -79.7869 -79.7869 -45.4996 -45.4996 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6868 -43.6868 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0550 -9.0550 -9.0383 -9.0383 2.7226 2.7226 2.9805 2.9805 7.6705 7.6705 9.0233 9.0233 9.0619 9.0619 9.2313 9.2313 9.6001 9.6001 9.9808 9.9808 9.9964 9.9964 10.3242 10.3242 11.2688 11.2688 11.8022 11.8022 11.8361 11.8361 11.8807 11.8807 12.8831 12.8831 13.7848 13.7848 15.8778 15.8778 15.8903 15.8903 15.9301 15.9301 k = 0.5000 0.2792-0.0000 ( 6198 PWs) bands (ev): -79.8007 -79.8007 -79.7872 -79.7872 -45.4996 -45.4996 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6869 -43.6869 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0550 -9.0550 -9.0383 -9.0383 2.7485 2.7485 2.9528 2.9528 7.6702 7.6702 9.0233 9.0233 9.0620 9.0620 9.2314 9.2314 9.6008 9.6008 9.9801 9.9801 9.9957 9.9957 10.3229 10.3229 11.2689 11.2689 11.8024 11.8024 11.8363 11.8363 11.8806 11.8806 12.8923 12.8923 13.7862 13.7862 15.8820 15.8820 15.8946 15.8946 15.9182 15.9182 k = 0.5000 0.2792-0.0000 ( 6198 PWs) bands (ev): -79.8007 -79.8007 -79.7872 -79.7872 -45.4996 -45.4996 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6869 -43.6869 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0550 -9.0550 -9.0383 -9.0383 2.7485 2.7485 2.9528 2.9528 7.6702 7.6702 9.0233 9.0233 9.0620 9.0620 9.2314 9.2314 9.6008 9.6008 9.9801 9.9801 9.9957 9.9957 10.3229 10.3229 11.2689 11.2689 11.8024 11.8024 11.8363 11.8363 11.8806 11.8806 12.8923 12.8923 13.7862 13.7862 15.8820 15.8820 15.8946 15.8946 15.9182 15.9182 k = 0.4938 0.2903 0.0127 ( 6190 PWs) bands (ev): -79.8007 -79.8007 -79.7869 -79.7869 -45.4995 -45.4995 -45.4647 -45.4647 -43.8319 -43.8319 -43.7705 -43.7705 -43.6868 -43.6868 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0551 -9.0551 -9.0383 -9.0383 2.7497 2.7497 2.9538 2.9538 7.6713 7.6713 9.0232 9.0232 9.0618 9.0618 9.2324 9.2324 9.6015 9.6015 9.9752 9.9752 9.9917 9.9917 10.3278 10.3278 11.2681 11.2681 11.7883 11.7883 11.8209 11.8209 11.9033 11.9033 12.8972 12.8972 13.7910 13.7910 15.8430 15.8430 15.8895 15.8895 15.9562 15.9562 k = 0.4876 0.3014 0.0255 ( 6190 PWs) bands (ev): -79.8007 -79.8007 -79.7869 -79.7869 -45.4995 -45.4995 -45.4647 -45.4647 -43.8319 -43.8319 -43.7705 -43.7705 -43.6868 -43.6868 -43.6785 -43.6785 -28.1067 -28.1067 -9.4207 -9.4207 -9.0553 -9.0553 -9.0383 -9.0383 2.7534 2.7534 2.9564 2.9564 7.6726 7.6726 9.0223 9.0223 9.0608 9.0608 9.2353 9.2353 9.6036 9.6036 9.9563 9.9563 9.9848 9.9848 10.3405 10.3405 11.2657 11.2657 11.7555 11.7555 11.7947 11.7947 11.9416 11.9416 12.9111 12.9111 13.8046 13.8046 15.7791 15.7791 15.8911 15.8911 15.9993 15.9993 k = 0.4814 0.3125 0.0382 ( 6202 PWs) bands (ev): -79.8007 -79.8007 -79.7874 -79.7874 -45.4996 -45.4996 -45.4648 -45.4648 -43.8319 -43.8319 -43.7707 -43.7707 -43.6869 -43.6869 -43.6785 -43.6785 -28.1066 -28.1066 -9.4210 -9.4210 -9.0557 -9.0557 -9.0383 -9.0383 2.7595 2.7595 2.9608 2.9608 7.6743 7.6743 9.0202 9.0202 9.0588 9.0588 9.2407 9.2407 9.6069 9.6069 9.9238 9.9238 9.9775 9.9775 10.3583 10.3583 11.2608 11.2608 11.7169 11.7169 11.7593 11.7593 11.9824 11.9824 12.9324 12.9324 13.8268 13.8268 15.7065 15.7065 15.8940 15.8940 16.0372 16.0372 k = 0.4752 0.3237 0.0509 ( 6210 PWs) bands (ev): -79.8006 -79.8006 -79.7877 -79.7877 -45.4996 -45.4996 -45.4649 -45.4649 -43.8318 -43.8318 -43.7708 -43.7708 -43.6869 -43.6869 -43.6785 -43.6785 -28.1066 -28.1066 -9.4213 -9.4213 -9.0563 -9.0563 -9.0383 -9.0383 2.7680 2.7680 2.9670 2.9670 7.6771 7.6771 9.0174 9.0174 9.0565 9.0565 9.2473 9.2473 9.6115 9.6115 9.8814 9.8814 9.9684 9.9684 10.3794 10.3794 11.2552 11.2552 11.6766 11.6766 11.7153 11.7153 12.0241 12.0241 12.9592 12.9592 13.8573 13.8573 15.6269 15.6269 15.8977 15.8977 16.0707 16.0707 k = 0.4690 0.3348 0.0637 ( 6210 PWs) bands (ev): -79.8005 -79.8005 -79.7879 -79.7879 -45.4995 -45.4995 -45.4650 -45.4650 -43.8316 -43.8316 -43.7710 -43.7710 -43.6869 -43.6869 -43.6785 -43.6785 -28.1065 -28.1065 -9.4217 -9.4217 -9.0571 -9.0571 -9.0382 -9.0382 2.7790 2.7790 2.9749 2.9749 7.6807 7.6807 9.0140 9.0140 9.0543 9.0543 9.2562 9.2562 9.6173 9.6173 9.8319 9.8319 9.9572 9.9572 10.4017 10.4017 11.2483 11.2483 11.6353 11.6353 11.6656 11.6656 12.0667 12.0667 12.9896 12.9896 13.8951 13.8951 15.5413 15.5413 15.9028 15.9028 16.0989 16.0989 k = 0.4628 0.3459 0.0764 ( 6206 PWs) bands (ev): -79.8004 -79.8004 -79.7878 -79.7878 -45.4993 -45.4993 -45.4651 -45.4651 -43.8313 -43.8313 -43.7713 -43.7713 -43.6869 -43.6869 -43.6786 -43.6786 -28.1064 -28.1064 -9.4222 -9.4222 -9.0580 -9.0580 -9.0382 -9.0382 2.7923 2.7923 2.9844 2.9844 7.6851 7.6851 9.0099 9.0099 9.0526 9.0526 9.2661 9.2661 9.6238 9.6238 9.7769 9.7769 9.9440 9.9440 10.4241 10.4241 11.2395 11.2395 11.5906 11.5906 11.6152 11.6152 12.1099 12.1099 13.0220 13.0220 13.9394 13.9394 15.4502 15.4502 15.9094 15.9094 16.0737 16.0737 k = 0.4566 0.3570 0.0891 ( 6208 PWs) bands (ev): -79.8004 -79.8004 -79.7878 -79.7878 -45.4991 -45.4991 -45.4653 -45.4653 -43.8310 -43.8310 -43.7716 -43.7716 -43.6868 -43.6868 -43.6786 -43.6786 -28.1063 -28.1063 -9.4227 -9.4227 -9.0591 -9.0591 -9.0381 -9.0381 2.8081 2.8081 2.9956 2.9956 7.6896 7.6896 9.0050 9.0050 9.0512 9.0512 9.2776 9.2776 9.6300 9.6300 9.7182 9.7182 9.9286 9.9286 10.4453 10.4453 11.2286 11.2286 11.5380 11.5380 11.5702 11.5702 12.1526 12.1526 13.0552 13.0552 13.9886 13.9886 15.3546 15.3546 15.9173 15.9173 16.0420 16.0420 k = 0.4503 0.3681 0.1018 ( 6214 PWs) bands (ev): -79.8003 -79.8003 -79.7881 -79.7881 -45.4990 -45.4990 -45.4655 -45.4655 -43.8307 -43.8307 -43.7719 -43.7719 -43.6868 -43.6868 -43.6787 -43.6787 -28.1062 -28.1062 -9.4234 -9.4234 -9.0604 -9.0604 -9.0379 -9.0379 2.8262 2.8262 3.0082 3.0082 7.6940 7.6940 8.9988 8.9988 9.0503 9.0503 9.2905 9.2905 9.6268 9.6268 9.6657 9.6657 9.9114 9.9114 10.4650 10.4650 11.2165 11.2165 11.4804 11.4804 11.5294 11.5294 12.1945 12.1945 13.0884 13.0884 14.0415 14.0415 15.2550 15.2550 15.9262 15.9262 16.0100 16.0100 k = 0.4441 0.3792 0.1146 ( 6214 PWs) bands (ev): -79.8002 -79.8002 -79.7882 -79.7882 -45.4988 -45.4988 -45.4657 -45.4657 -43.8303 -43.8303 -43.7723 -43.7723 -43.6868 -43.6868 -43.6787 -43.6787 -28.1060 -28.1060 -9.4241 -9.4241 -9.0619 -9.0619 -9.0377 -9.0377 2.8467 2.8467 3.0224 3.0224 7.6986 7.6986 8.9919 8.9919 9.0503 9.0503 9.3046 9.3046 9.5764 9.5764 9.6584 9.6584 9.8924 9.8924 10.4830 10.4830 11.2029 11.2029 11.4218 11.4218 11.4908 11.4908 12.2363 12.2363 13.1212 13.1212 14.0969 14.0969 15.1526 15.1526 15.9363 15.9363 15.9790 15.9790 k = 0.4379 0.3903 0.1273 ( 6216 PWs) bands (ev): -79.7999 -79.7999 -79.7885 -79.7885 -45.4986 -45.4986 -45.4659 -45.4659 -43.8300 -43.8300 -43.7727 -43.7727 -43.6868 -43.6868 -43.6788 -43.6788 -28.1059 -28.1059 -9.4250 -9.4250 -9.0635 -9.0635 -9.0375 -9.0375 2.8696 2.8696 3.0379 3.0379 7.7027 7.7027 8.9834 8.9834 9.0508 9.0508 9.3199 9.3199 9.5089 9.5089 9.6666 9.6666 9.8718 9.8718 10.4993 10.4993 11.1879 11.1879 11.3651 11.3651 11.4530 11.4530 12.2771 12.2771 13.1534 13.1534 14.1529 14.1529 15.0470 15.0470 15.9445 15.9445 15.9528 15.9528 k = 0.4317 0.4015 0.1400 ( 6218 PWs) bands (ev): -79.7998 -79.7998 -79.7887 -79.7887 -45.4983 -45.4983 -45.4662 -45.4662 -43.8295 -43.8295 -43.7732 -43.7732 -43.6867 -43.6867 -43.6788 -43.6788 -28.1057 -28.1057 -9.4259 -9.4259 -9.0653 -9.0653 -9.0371 -9.0371 2.8947 2.8947 3.0547 3.0547 7.7061 7.7061 8.9750 8.9750 9.0523 9.0523 9.3354 9.3354 9.4389 9.4389 9.6768 9.6768 9.8500 9.8500 10.5132 10.5132 11.1699 11.1699 11.3099 11.3099 11.4157 11.4157 12.3169 12.3169 13.1844 13.1844 14.2087 14.2087 14.9407 14.9407 15.9217 15.9217 15.9612 15.9612 k = 0.4255 0.4126 0.1528 ( 6216 PWs) bands (ev): -79.7997 -79.7997 -79.7887 -79.7887 -45.4980 -45.4980 -45.4665 -45.4665 -43.8290 -43.8290 -43.7738 -43.7738 -43.6866 -43.6866 -43.6789 -43.6789 -28.1056 -28.1056 -9.4269 -9.4269 -9.0672 -9.0672 -9.0368 -9.0368 2.9222 2.9222 3.0726 3.0726 7.7083 7.7083 8.9663 8.9663 9.0543 9.0543 9.3399 9.3399 9.3793 9.3793 9.6875 9.6875 9.8271 9.8271 10.5256 10.5256 11.1505 11.1505 11.2591 11.2591 11.3785 11.3785 12.3553 12.3553 13.2142 13.2142 14.2631 14.2631 14.8334 14.8334 15.8959 15.8959 15.9012 15.9012 k = 0.4193 0.4237 0.1655 ( 6216 PWs) bands (ev): -79.7996 -79.7996 -79.7888 -79.7888 -45.4977 -45.4977 -45.4668 -45.4668 -43.8285 -43.8285 -43.7744 -43.7744 -43.6865 -43.6865 -43.6790 -43.6790 -28.1054 -28.1054 -9.4279 -9.4279 -9.0692 -9.0692 -9.0364 -9.0364 2.9519 2.9519 3.0916 3.0916 7.7089 7.7089 8.9570 8.9570 9.0569 9.0569 9.2850 9.2850 9.3802 9.3802 9.6980 9.6980 9.8041 9.8041 10.5351 10.5351 11.1281 11.1281 11.2120 11.2120 11.3419 11.3419 12.3928 12.3928 13.2421 13.2421 14.3132 14.3132 14.7253 14.7253 15.8045 15.8045 15.8787 15.8787 k = 0.4131 0.4348 0.1782 ( 6222 PWs) bands (ev): -79.7996 -79.7996 -79.7890 -79.7890 -45.4974 -45.4974 -45.4672 -45.4672 -43.8279 -43.8279 -43.7750 -43.7750 -43.6865 -43.6865 -43.6791 -43.6791 -28.1052 -28.1052 -9.4291 -9.4291 -9.0713 -9.0713 -9.0359 -9.0359 2.9838 2.9838 3.1115 3.1115 7.7072 7.7072 8.9475 8.9475 9.0602 9.0602 9.2152 9.2152 9.3985 9.3985 9.7064 9.7064 9.7824 9.7824 10.5420 10.5420 11.1012 11.1012 11.1703 11.1703 11.3048 11.3048 12.4282 12.4282 13.2676 13.2676 14.3581 14.3581 14.6171 14.6171 15.7213 15.7213 15.8633 15.8633 k = 0.4069 0.4459 0.1910 ( 6222 PWs) bands (ev): -79.7993 -79.7993 -79.7893 -79.7893 -45.4971 -45.4971 -45.4675 -45.4675 -43.8273 -43.8273 -43.7757 -43.7757 -43.6864 -43.6864 -43.6792 -43.6792 -28.1050 -28.1050 -9.4303 -9.4303 -9.0735 -9.0735 -9.0354 -9.0354 3.0180 3.0180 3.1321 3.1321 7.7023 7.7023 8.9377 8.9377 9.0636 9.0636 9.1468 9.1468 9.4193 9.4193 9.7085 9.7085 9.7671 9.7671 10.5468 10.5468 11.0710 11.0710 11.1345 11.1345 11.2685 11.2685 12.4624 12.4624 13.2902 13.2902 14.3959 14.3959 14.5091 14.5091 15.6521 15.6521 15.8527 15.8527 k = 0.4007 0.4570 0.2037 ( 6214 PWs) bands (ev): -79.7989 -79.7989 -79.7894 -79.7894 -45.4967 -45.4967 -45.4678 -45.4678 -43.8267 -43.8267 -43.7763 -43.7763 -43.6863 -43.6863 -43.6792 -43.6792 -28.1048 -28.1048 -9.4316 -9.4316 -9.0758 -9.0758 -9.0349 -9.0349 3.0543 3.0543 3.1532 3.1532 7.6943 7.6943 8.9282 8.9282 9.0613 9.0613 9.0880 9.0880 9.4421 9.4421 9.6972 9.6972 9.7648 9.7648 10.5493 10.5493 11.0383 11.0383 11.1033 11.1033 11.2320 11.2320 12.4948 12.4948 13.3087 13.3087 14.3985 14.3985 14.4290 14.4290 15.5997 15.5997 15.8472 15.8472 k = 0.3945 0.4682 0.2164 ( 6214 PWs) bands (ev): -79.7986 -79.7986 -79.7896 -79.7896 -45.4963 -45.4963 -45.4682 -45.4682 -43.8260 -43.8260 -43.7770 -43.7770 -43.6862 -43.6862 -43.6793 -43.6793 -28.1046 -28.1046 -9.4329 -9.4329 -9.0780 -9.0780 -9.0343 -9.0343 3.0928 3.0928 3.1748 3.1748 7.6817 7.6817 8.9183 8.9183 9.0133 9.0133 9.0796 9.0796 9.4656 9.4656 9.6755 9.6755 9.7724 9.7724 10.5494 10.5494 11.0047 11.0047 11.0744 11.0744 11.1956 11.1956 12.5254 12.5254 13.3219 13.3219 14.2933 14.2933 14.4485 14.4485 15.5660 15.5660 15.8471 15.8471 k = 0.3883 0.4793 0.2292 ( 6198 PWs) bands (ev): -79.7983 -79.7983 -79.7893 -79.7893 -45.4957 -45.4957 -45.4686 -45.4686 -43.8251 -43.8251 -43.7777 -43.7777 -43.6860 -43.6860 -43.6794 -43.6794 -28.1043 -28.1043 -9.4343 -9.4343 -9.0803 -9.0803 -9.0337 -9.0337 3.1333 3.1333 3.1964 3.1964 7.6649 7.6649 8.9088 8.9088 8.9583 8.9583 9.0851 9.0851 9.4896 9.4896 9.6499 9.6499 9.7840 9.7840 10.5480 10.5480 10.9723 10.9723 11.0469 11.0469 11.1598 11.1598 12.5550 12.5550 13.3291 13.3291 14.1873 14.1873 14.4628 14.4628 15.5520 15.5520 15.8527 15.8527 k = 0.3821 0.4904 0.2419 ( 6198 PWs) bands (ev): -79.7982 -79.7982 -79.7894 -79.7894 -45.4953 -45.4953 -45.4691 -45.4691 -43.8243 -43.8243 -43.7786 -43.7786 -43.6859 -43.6859 -43.6795 -43.6795 -28.1041 -28.1041 -9.4358 -9.4358 -9.0827 -9.0827 -9.0331 -9.0331 3.1758 3.1758 3.2180 3.2180 7.6421 7.6421 8.8989 8.8989 8.9087 8.9087 9.0921 9.0921 9.5138 9.5138 9.6231 9.6231 9.7971 9.7971 10.5439 10.5439 10.9407 10.9407 11.0193 11.0193 11.1233 11.1233 12.5819 12.5819 13.3282 13.3282 14.0819 14.0819 14.4718 14.4718 15.5568 15.5568 15.8639 15.8639 k = 0.3759 0.5015 0.2546 ( 6194 PWs) bands (ev): -79.7980 -79.7980 -79.7894 -79.7894 -45.4947 -45.4947 -45.4695 -45.4695 -43.8235 -43.8235 -43.7794 -43.7794 -43.6858 -43.6858 -43.6796 -43.6796 -28.1039 -28.1039 -9.4373 -9.4373 -9.0849 -9.0849 -9.0325 -9.0325 3.2202 3.2202 3.2393 3.2393 7.6138 7.6138 8.8654 8.8654 8.8900 8.8900 9.1000 9.1000 9.5364 9.5364 9.5979 9.5979 9.8110 9.8110 10.5378 10.5378 10.9105 10.9105 10.9917 10.9917 11.0869 11.0869 12.6073 12.6073 13.3185 13.3185 13.9779 13.9779 14.4790 14.4790 15.5786 15.5786 15.8810 15.8810 k = 0.3697 0.5126 0.2674 ( 6202 PWs) bands (ev): -79.7980 -79.7980 -79.7897 -79.7897 -45.4943 -45.4943 -45.4701 -45.4701 -43.8226 -43.8226 -43.7803 -43.7803 -43.6857 -43.6857 -43.6798 -43.6798 -28.1037 -28.1037 -9.4388 -9.4388 -9.0872 -9.0872 -9.0318 -9.0318 3.2599 3.2599 3.2665 3.2665 7.5799 7.5799 8.8296 8.8296 8.8805 8.8805 9.1087 9.1087 9.5448 9.5448 9.5871 9.5871 9.8250 9.8250 10.5297 10.5297 10.8815 10.8815 10.9637 10.9637 11.0500 11.0500 12.6304 12.6304 13.2991 13.2991 13.8744 13.8744 14.4879 14.4879 15.6148 15.6148 15.9039 15.9039 k = 0.3635 0.5237 0.2801 ( 6194 PWs) bands (ev): -79.7977 -79.7977 -79.7897 -79.7897 -45.4937 -45.4937 -45.4706 -45.4706 -43.8217 -43.8217 -43.7812 -43.7812 -43.6855 -43.6855 -43.6799 -43.6799 -28.1034 -28.1034 -9.4404 -9.4404 -9.0894 -9.0894 -9.0312 -9.0312 3.2797 3.2797 3.3147 3.3147 7.5411 7.5411 8.8012 8.8012 8.8717 8.8717 9.1186 9.1186 9.5253 9.5253 9.6057 9.6057 9.8392 9.8392 10.5211 10.5211 10.8544 10.8544 10.9358 10.9358 11.0130 11.0130 12.6518 12.6518 13.2703 13.2703 13.7727 13.7727 14.5018 14.5018 15.6629 15.6629 15.9326 15.9326 k = 0.3572 0.5348 0.2928 ( 6194 PWs) bands (ev): -79.7974 -79.7974 -79.7900 -79.7900 -45.4932 -45.4932 -45.4711 -45.4711 -43.8209 -43.8209 -43.7821 -43.7821 -43.6854 -43.6854 -43.6800 -43.6800 -28.1032 -28.1032 -9.4420 -9.4420 -9.0916 -9.0916 -9.0305 -9.0305 3.2983 3.2983 3.3647 3.3647 7.4979 7.4979 8.7795 8.7795 8.8630 8.8630 9.1289 9.1289 9.4980 9.4980 9.6322 9.6322 9.8529 9.8529 10.5112 10.5112 10.8278 10.8278 10.9086 10.9086 10.9759 10.9759 12.6714 12.6714 13.2326 13.2326 13.6723 13.6723 14.5220 14.5220 15.7204 15.7204 15.9671 15.9671 k = 0.3510 0.5460 0.3055 ( 6198 PWs) bands (ev): -79.7974 -79.7974 -79.7902 -79.7902 -45.4927 -45.4927 -45.4717 -45.4717 -43.8199 -43.8199 -43.7832 -43.7832 -43.6852 -43.6852 -43.6802 -43.6802 -28.1030 -28.1030 -9.4435 -9.4435 -9.0937 -9.0937 -9.0299 -9.0299 3.3154 3.3154 3.4163 3.4163 7.4515 7.4515 8.7641 8.7641 8.8552 8.8552 9.1400 9.1400 9.4693 9.4693 9.6611 9.6611 9.8663 9.8663 10.5001 10.5001 10.8011 10.8011 10.8801 10.8801 10.9384 10.9384 12.6894 12.6894 13.1870 13.1870 13.5734 13.5734 14.5497 14.5497 15.7852 15.7852 16.0073 16.0073 k = 0.3448 0.5571 0.3183 ( 6202 PWs) bands (ev): -79.7974 -79.7974 -79.7903 -79.7903 -45.4921 -45.4921 -45.4723 -45.4723 -43.8190 -43.8190 -43.7842 -43.7842 -43.6851 -43.6851 -43.6803 -43.6803 -28.1028 -28.1028 -9.4451 -9.4451 -9.0957 -9.0957 -9.0293 -9.0293 3.3307 3.3307 3.4695 3.4695 7.4029 7.4029 8.7541 8.7541 8.8478 8.8478 9.1517 9.1517 9.4404 9.4404 9.6909 9.6909 9.8795 9.8795 10.4884 10.4884 10.7748 10.7748 10.8521 10.8521 10.9010 10.9010 12.7060 12.7060 13.1353 13.1353 13.4762 13.4762 14.5850 14.5850 15.8558 15.8558 16.0528 16.0528 k = 0.3386 0.5682 0.3310 ( 6202 PWs) bands (ev): -79.7971 -79.7971 -79.7906 -79.7906 -45.4915 -45.4915 -45.4729 -45.4729 -43.8179 -43.8179 -43.7852 -43.7852 -43.6850 -43.6850 -43.6805 -43.6805 -28.1026 -28.1026 -9.4466 -9.4466 -9.0976 -9.0976 -9.0286 -9.0286 3.3438 3.3438 3.5243 3.5243 7.3532 7.3532 8.7485 8.7485 8.8405 8.8405 9.1644 9.1644 9.4118 9.4118 9.7219 9.7219 9.8916 9.8916 10.4770 10.4770 10.7490 10.7490 10.8248 10.8248 10.8642 10.8642 12.7216 12.7216 13.0792 13.0792 13.3801 13.3801 14.6278 14.6278 15.9312 15.9313 16.1038 16.1038 k = 0.3324 0.5793 0.3437 ( 6206 PWs) bands (ev): -79.7966 -79.7966 -79.7912 -79.7912 -45.4911 -45.4911 -45.4734 -45.4734 -43.8170 -43.8170 -43.7862 -43.7862 -43.6849 -43.6849 -43.6806 -43.6806 -28.1024 -28.1024 -9.4482 -9.4482 -9.0994 -9.0994 -9.0280 -9.0280 3.3543 3.3543 3.5805 3.5805 7.3038 7.3038 8.7461 8.7461 8.8339 8.8339 9.1774 9.1774 9.3833 9.3833 9.7532 9.7532 9.9037 9.9037 10.4661 10.4661 10.7232 10.7232 10.7971 10.7971 10.8278 10.8278 12.7356 12.7356 13.0201 13.0201 13.2854 13.2854 14.6772 14.6772 16.0105 16.0105 16.1594 16.1594 k = 0.3262 0.5904 0.3565 ( 6208 PWs) bands (ev): -79.7963 -79.7963 -79.7916 -79.7916 -45.4905 -45.4905 -45.4740 -45.4740 -43.8160 -43.8160 -43.7873 -43.7873 -43.6848 -43.6848 -43.6807 -43.6807 -28.1022 -28.1022 -9.4496 -9.4496 -9.1011 -9.1011 -9.0274 -9.0274 3.3620 3.3620 3.6380 3.6380 7.2557 7.2557 8.7460 8.7460 8.8285 8.8285 9.1915 9.1915 9.3551 9.3551 9.7854 9.7854 9.9151 9.9151 10.4539 10.4539 10.6977 10.6977 10.7678 10.7678 10.7944 10.7944 12.7486 12.7486 12.9590 12.9590 13.1934 13.1934 14.7324 14.7324 16.0688 16.0688 16.0931 16.0931 k = 0.3200 0.6015 0.3692 ( 6206 PWs) bands (ev): -79.7961 -79.7961 -79.7918 -79.7918 -45.4899 -45.4899 -45.4746 -45.4746 -43.8150 -43.8150 -43.7884 -43.7884 -43.6847 -43.6847 -43.6809 -43.6809 -28.1020 -28.1020 -9.4510 -9.4510 -9.1027 -9.1027 -9.0269 -9.0269 3.3665 3.3665 3.6967 3.6967 7.2099 7.2099 8.7474 8.7474 8.8239 8.8239 9.2061 9.2061 9.3276 9.3276 9.8180 9.8180 9.9251 9.9251 10.4427 10.4427 10.6728 10.6728 10.7353 10.7353 10.7660 10.7660 12.7610 12.7610 12.8980 12.8980 13.1032 13.1032 14.7929 14.7929 15.9626 15.9626 16.1777 16.1777 k = 0.3138 0.6127 0.3819 ( 6194 PWs) bands (ev): -79.7957 -79.7957 -79.7916 -79.7916 -45.4892 -45.4892 -45.4752 -45.4752 -43.8138 -43.8138 -43.7894 -43.7894 -43.6845 -43.6845 -43.6810 -43.6810 -28.1019 -28.1019 -9.4524 -9.4524 -9.1041 -9.1041 -9.0263 -9.0263 3.3675 3.3675 3.7566 3.7566 7.1674 7.1674 8.7497 8.7497 8.8206 8.8206 9.2218 9.2218 9.3007 9.3007 9.8512 9.8512 9.9341 9.9341 10.4323 10.4323 10.6484 10.6484 10.7001 10.7001 10.7422 10.7422 12.7716 12.7716 12.8386 12.8386 13.0154 13.0154 14.8579 14.8579 15.8567 15.8567 16.2645 16.2645 k = 0.3076 0.6238 0.3947 ( 6198 PWs) bands (ev): -79.7955 -79.7955 -79.7920 -79.7920 -45.4886 -45.4886 -45.4758 -45.4758 -43.8127 -43.8127 -43.7906 -43.7906 -43.6843 -43.6843 -43.6812 -43.6812 -28.1017 -28.1017 -9.4536 -9.4536 -9.1055 -9.1055 -9.0258 -9.0258 3.3646 3.3646 3.8174 3.8174 7.1287 7.1287 8.7513 8.7513 8.8178 8.8178 9.2378 9.2378 9.2743 9.2743 9.8837 9.8837 9.9421 9.9421 10.4219 10.4219 10.6244 10.6244 10.6631 10.6631 10.7214 10.7214 12.7651 12.7651 12.7968 12.7968 12.9290 12.9290 14.9268 14.9268 15.7510 15.7510 16.3528 16.3529 k = 0.3014 0.6349 0.4074 ( 6198 PWs) bands (ev): -79.7953 -79.7953 -79.7922 -79.7922 -45.4879 -45.4879 -45.4765 -45.4765 -43.8116 -43.8116 -43.7917 -43.7917 -43.6842 -43.6842 -43.6814 -43.6814 -28.1016 -28.1016 -9.4548 -9.4548 -9.1067 -9.1067 -9.0253 -9.0253 3.3578 3.3578 3.8791 3.8791 7.0947 7.0947 8.7518 8.7518 8.8161 8.8161 9.2469 9.2469 9.2562 9.2562 9.9134 9.9134 9.9512 9.9512 10.4125 10.4125 10.6011 10.6011 10.6272 10.6272 10.7034 10.7034 12.7140 12.7140 12.8006 12.8006 12.8453 12.8453 14.9992 14.9992 15.6456 15.6456 16.3681 16.3681 k = 0.2952 0.6460 0.4201 ( 6204 PWs) bands (ev): -79.7952 -79.7952 -79.7925 -79.7925 -45.4873 -45.4873 -45.4772 -45.4772 -43.8104 -43.8104 -43.7929 -43.7929 -43.6841 -43.6841 -43.6815 -43.6815 -28.1015 -28.1015 -9.4558 -9.4558 -9.1078 -9.1078 -9.0249 -9.0249 3.3467 3.3467 3.9416 3.9416 7.0659 7.0659 8.7505 8.7505 8.8155 8.8155 9.2231 9.2231 9.2725 9.2725 9.9326 9.9326 9.9692 9.9692 10.4033 10.4033 10.5753 10.5753 10.5952 10.5952 10.6875 10.6875 12.6585 12.6585 12.7595 12.7595 12.8145 12.8145 15.0743 15.0743 15.5409 15.5409 16.3437 16.3437 k = 0.2890 0.6571 0.4329 ( 6200 PWs) bands (ev): -79.7950 -79.7950 -79.7925 -79.7925 -45.4866 -45.4866 -45.4778 -45.4778 -43.8093 -43.8093 -43.7941 -43.7941 -43.6839 -43.6839 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1087 -9.1087 -9.0244 -9.0244 3.3312 3.3312 4.0046 4.0046 7.0425 7.0425 8.7468 8.7468 8.8165 8.8165 9.1990 9.1990 9.2906 9.2906 9.9379 9.9379 9.9990 9.9990 10.3952 10.3952 10.5441 10.5441 10.5727 10.5727 10.6745 10.6745 12.6045 12.6045 12.6803 12.6803 12.8260 12.8260 15.1518 15.1518 15.4370 15.4370 16.3207 16.3207 k = 0.2890 0.6571 0.4329 ( 6200 PWs) bands (ev): -79.7950 -79.7950 -79.7925 -79.7925 -45.4866 -45.4866 -45.4778 -45.4778 -43.8093 -43.8093 -43.7941 -43.7941 -43.6839 -43.6839 -43.6817 -43.6817 -28.1013 -28.1013 -9.4568 -9.4568 -9.1087 -9.1087 -9.0244 -9.0244 3.3312 3.3312 4.0046 4.0046 7.0425 7.0425 8.7468 8.7468 8.8165 8.8165 9.1990 9.1990 9.2906 9.2906 9.9379 9.9379 9.9990 9.9990 10.3952 10.3952 10.5441 10.5441 10.5727 10.5727 10.6745 10.6745 12.6045 12.6045 12.6803 12.6803 12.8260 12.8260 15.1518 15.1518 15.4370 15.4370 16.3207 16.3207 k = 0.2729 0.6532 0.4373 ( 6202 PWs) bands (ev): -79.7949 -79.7949 -79.7927 -79.7927 -45.4863 -45.4863 -45.4781 -45.4781 -43.8089 -43.8089 -43.7945 -43.7945 -43.6838 -43.6838 -43.6818 -43.6818 -28.1013 -28.1013 -9.4571 -9.4571 -9.1090 -9.1090 -9.0243 -9.0243 3.3233 3.3233 4.0282 4.0282 7.0377 7.0377 8.7263 8.7263 8.8338 8.8338 9.1894 9.1894 9.2986 9.2986 9.9369 9.9369 10.0106 10.0106 10.3929 10.3929 10.5322 10.5322 10.5667 10.5667 10.6712 10.6712 12.5226 12.5226 12.7186 12.7186 12.8305 12.8305 15.1718 15.1718 15.4022 15.4022 16.3136 16.3136 k = 0.2569 0.6494 0.4417 ( 6201 PWs) bands (ev): -79.7949 -79.7949 -79.7927 -79.7927 -45.4861 -45.4861 -45.4783 -45.4783 -43.8084 -43.8084 -43.7950 -43.7950 -43.6837 -43.6837 -43.6818 -43.6818 -28.1013 -28.1013 -9.4573 -9.4573 -9.1093 -9.1093 -9.0242 -9.0242 3.3125 3.3125 4.0544 4.0544 7.0377 7.0377 8.6877 8.6877 8.8661 8.8661 9.1783 9.1783 9.3085 9.3085 9.9328 9.9328 10.0225 10.0225 10.3912 10.3912 10.5205 10.5205 10.5616 10.5616 10.6700 10.6700 12.4163 12.4163 12.7865 12.7865 12.8360 12.8360 15.1768 15.1768 15.3699 15.3699 16.3102 16.3102 k = 0.2408 0.6455 0.4462 ( 6201 PWs) bands (ev): -79.7948 -79.7948 -79.7928 -79.7928 -45.4859 -45.4859 -45.4786 -45.4786 -43.8080 -43.8080 -43.7954 -43.7954 -43.6837 -43.6837 -43.6819 -43.6819 -28.1013 -28.1013 -9.4576 -9.4576 -9.1095 -9.1095 -9.0240 -9.0240 3.2998 3.2998 4.0819 4.0819 7.0426 7.0426 8.6431 8.6431 8.9010 8.9010 9.1665 9.1665 9.3192 9.3192 9.9260 9.9260 10.0348 10.0348 10.3899 10.3899 10.5089 10.5089 10.5568 10.5568 10.6707 10.6707 12.3121 12.3121 12.8358 12.8358 12.8639 12.8639 15.1672 15.1672 15.3406 15.3406 16.3130 16.3130 k = 0.2248 0.6416 0.4506 ( 6198 PWs) bands (ev): -79.7946 -79.7946 -79.7928 -79.7928 -45.4856 -45.4856 -45.4788 -45.4788 -43.8076 -43.8076 -43.7958 -43.7958 -43.6837 -43.6837 -43.6819 -43.6819 -28.1012 -28.1012 -9.4578 -9.4578 -9.1097 -9.1097 -9.0239 -9.0239 3.2860 3.2860 4.1098 4.1098 7.0526 7.0526 8.5946 8.5946 8.9362 8.9362 9.1547 9.1547 9.3304 9.3304 9.9169 9.9169 10.0475 10.0475 10.3887 10.3887 10.4977 10.4977 10.5526 10.5526 10.6744 10.6744 12.2118 12.2118 12.8422 12.8422 12.9364 12.9364 15.1441 15.1441 15.3143 15.3143 16.3228 16.3228 k = 0.2087 0.6377 0.4551 ( 6188 PWs) bands (ev): -79.7944 -79.7944 -79.7927 -79.7927 -45.4853 -45.4853 -45.4789 -45.4789 -43.8071 -43.8071 -43.7962 -43.7962 -43.6836 -43.6836 -43.6819 -43.6819 -28.1012 -28.1012 -9.4581 -9.4581 -9.1100 -9.1100 -9.0237 -9.0237 3.2716 3.2716 4.1374 4.1374 7.0676 7.0676 8.5429 8.5429 8.9712 8.9712 9.1435 9.1435 9.3417 9.3417 9.9053 9.9053 10.0607 10.0607 10.3874 10.3874 10.4878 10.4878 10.5483 10.5483 10.6808 10.6808 12.1161 12.1161 12.8470 12.8470 13.0126 13.0126 15.1089 15.1089 15.2911 15.2911 16.3020 16.3020 k = 0.1926 0.6339 0.4595 ( 6194 PWs) bands (ev): -79.7945 -79.7945 -79.7928 -79.7928 -45.4851 -45.4851 -45.4793 -45.4793 -43.8067 -43.8067 -43.7966 -43.7966 -43.6835 -43.6835 -43.6820 -43.6820 -28.1012 -28.1012 -9.4583 -9.4583 -9.1102 -9.1102 -9.0236 -9.0236 3.2572 3.2572 4.1641 4.1641 7.0876 7.0876 8.4883 8.4883 9.0054 9.0054 9.1323 9.1323 9.3523 9.3523 9.8915 9.8915 10.0735 10.0735 10.3848 10.3848 10.4782 10.4782 10.5432 10.5432 10.6895 10.6895 12.0247 12.0247 12.8506 12.8506 13.0903 13.0903 15.0634 15.0634 15.2708 15.2708 16.2437 16.2437 k = 0.1766 0.6300 0.4639 ( 6204 PWs) bands (ev): -79.7946 -79.7946 -79.7930 -79.7930 -45.4849 -45.4849 -45.4796 -45.4796 -43.8063 -43.8063 -43.7971 -43.7971 -43.6835 -43.6835 -43.6821 -43.6821 -28.1012 -28.1012 -9.4585 -9.4585 -9.1104 -9.1104 -9.0235 -9.0235 3.2430 3.2430 4.1895 4.1895 7.1126 7.1126 8.4312 8.4312 9.0386 9.0386 9.1219 9.1219 9.3623 9.3623 9.8760 9.8760 10.0861 10.0861 10.3807 10.3807 10.4703 10.4703 10.5380 10.5380 10.7004 10.7004 11.9383 11.9383 12.8540 12.8540 13.1690 13.1690 15.0090 15.0090 15.2535 15.2535 16.1876 16.1876 k = 0.1605 0.6261 0.4684 ( 6200 PWs) bands (ev): -79.7944 -79.7944 -79.7932 -79.7932 -45.4847 -45.4847 -45.4797 -45.4797 -43.8059 -43.8059 -43.7975 -43.7975 -43.6835 -43.6835 -43.6822 -43.6822 -28.1011 -28.1011 -9.4587 -9.4587 -9.1105 -9.1105 -9.0233 -9.0233 3.2295 3.2295 4.2131 4.2131 7.1423 7.1423 8.3718 8.3718 9.0708 9.0708 9.1128 9.1128 9.3722 9.3722 9.8596 9.8596 10.0993 10.0993 10.3756 10.3756 10.4645 10.4645 10.5327 10.5327 10.7144 10.7144 11.8571 11.8571 12.8575 12.8575 13.2489 13.2489 14.9480 14.9480 15.2395 15.2395 16.1345 16.1345 k = 0.1445 0.6222 0.4728 ( 6201 PWs) bands (ev): -79.7944 -79.7944 -79.7932 -79.7932 -45.4844 -45.4844 -45.4800 -45.4800 -43.8055 -43.8055 -43.7979 -43.7979 -43.6834 -43.6834 -43.6823 -43.6823 -28.1011 -28.1011 -9.4588 -9.4588 -9.1107 -9.1107 -9.0232 -9.0232 3.2168 3.2168 4.2348 4.2348 7.1766 7.1766 8.3105 8.3105 9.0990 9.0990 9.1070 9.1070 9.3813 9.3813 9.8419 9.8419 10.1124 10.1124 10.3686 10.3686 10.4603 10.4603 10.5274 10.5274 10.7301 10.7301 11.7815 11.7815 12.8605 12.8605 13.3299 13.3299 14.8814 14.8814 15.2283 15.2283 16.0845 16.0845 k = 0.1284 0.6183 0.4773 ( 6201 PWs) bands (ev): -79.7944 -79.7944 -79.7932 -79.7932 -45.4841 -45.4841 -45.4803 -45.4803 -43.8050 -43.8050 -43.7983 -43.7983 -43.6833 -43.6833 -43.6823 -43.6823 -28.1011 -28.1011 -9.4590 -9.4590 -9.1108 -9.1108 -9.0231 -9.0231 3.2051 3.2051 4.2545 4.2545 7.2153 7.2153 8.2475 8.2475 9.0953 9.0953 9.1324 9.1324 9.3897 9.3897 9.8238 9.8238 10.1254 10.1254 10.3603 10.3603 10.4583 10.4583 10.5216 10.5216 10.7479 10.7479 11.7111 11.7111 12.8630 12.8630 13.4115 13.4115 14.8106 14.8106 15.2196 15.2196 16.0380 16.0380 k = 0.1124 0.6145 0.4817 ( 6203 PWs) bands (ev): -79.7942 -79.7942 -79.7934 -79.7934 -45.4840 -45.4840 -45.4805 -45.4805 -43.8047 -43.8047 -43.7987 -43.7987 -43.6833 -43.6833 -43.6824 -43.6824 -28.1011 -28.1011 -9.4591 -9.4591 -9.1110 -9.1110 -9.0230 -9.0230 3.1945 3.1945 4.2718 4.2718 7.2579 7.2579 8.1832 8.1832 9.0884 9.0884 9.1601 9.1601 9.3976 9.3976 9.8059 9.8059 10.1384 10.1384 10.3506 10.3506 10.4572 10.4572 10.5157 10.5157 10.7667 10.7667 11.6461 11.6461 12.8651 12.8651 13.4934 13.4934 14.7368 14.7368 15.2136 15.2136 15.9954 15.9954 k = 0.0963 0.6106 0.4861 ( 6202 PWs) bands (ev): -79.7942 -79.7942 -79.7934 -79.7934 -45.4837 -45.4837 -45.4807 -45.4807 -43.8042 -43.8042 -43.7992 -43.7992 -43.6832 -43.6832 -43.6824 -43.6824 -28.1011 -28.1011 -9.4592 -9.4592 -9.1111 -9.1111 -9.0229 -9.0229 3.1852 3.1852 4.2869 4.2869 7.3039 7.3039 8.1183 8.1183 9.0824 9.0824 9.1860 9.1860 9.4048 9.4048 9.7882 9.7882 10.1510 10.1510 10.3406 10.3406 10.4575 10.4575 10.5098 10.5098 10.7859 10.7859 11.5872 11.5872 12.8671 12.8671 13.5757 13.5757 14.6609 14.6609 15.2095 15.2095 15.9572 15.9572 k = 0.0803 0.6067 0.4906 ( 6205 PWs) bands (ev): -79.7942 -79.7942 -79.7935 -79.7935 -45.4834 -45.4834 -45.4810 -45.4810 -43.8038 -43.8038 -43.7996 -43.7996 -43.6831 -43.6831 -43.6825 -43.6825 -28.1011 -28.1011 -9.4593 -9.4593 -9.1111 -9.1111 -9.0228 -9.0228 3.1772 3.1772 4.2997 4.2997 7.3528 7.3528 8.0534 8.0534 9.0773 9.0773 9.2092 9.2092 9.4110 9.4110 9.7711 9.7711 10.1632 10.1632 10.3304 10.3304 10.4590 10.4590 10.5036 10.5036 10.8051 10.8051 11.5349 11.5349 12.8688 12.8688 13.6569 13.6569 14.5837 14.5837 15.2070 15.2070 15.9237 15.9237 k = 0.0642 0.6028 0.4950 ( 6205 PWs) bands (ev): -79.7941 -79.7941 -79.7936 -79.7936 -45.4832 -45.4832 -45.4812 -45.4812 -43.8034 -43.8034 -43.8000 -43.8000 -43.6831 -43.6831 -43.6826 -43.6826 -28.1011 -28.1011 -9.4594 -9.4594 -9.1112 -9.1112 -9.0228 -9.0228 3.1705 3.1705 4.3101 4.3101 7.4034 7.4034 7.9896 7.9896 9.0731 9.0731 9.2292 9.2292 9.4165 9.4165 9.7558 9.7558 10.1747 10.1747 10.3204 10.3204 10.4614 10.4614 10.4981 10.4981 10.8231 10.8231 11.4899 11.4899 12.8702 12.8702 13.7364 13.7364 14.5072 14.5072 15.2059 15.2059 15.8954 15.8954 k = 0.0482 0.5990 0.4995 ( 6202 PWs) bands (ev): -79.7942 -79.7942 -79.7934 -79.7934 -45.4829 -45.4829 -45.4815 -45.4815 -43.8029 -43.8029 -43.8004 -43.8004 -43.6830 -43.6830 -43.6827 -43.6827 -28.1010 -28.1010 -9.4594 -9.4594 -9.1113 -9.1113 -9.0227 -9.0227 3.1653 3.1653 4.3182 4.3182 7.4541 7.4541 7.9288 7.9288 9.0701 9.0701 9.2456 9.2456 9.4208 9.4208 9.7426 9.7426 10.1848 10.1848 10.3115 10.3115 10.4646 10.4646 10.4926 10.4926 10.8396 10.8396 11.4532 11.4532 12.8714 12.8714 13.8126 13.8126 14.4330 14.4330 15.2054 15.2054 15.8726 15.8726 k = 0.0321 0.5951 0.5039 ( 6202 PWs) bands (ev): -79.7940 -79.7940 -79.7936 -79.7936 -45.4827 -45.4827 -45.4817 -45.4817 -43.8025 -43.8025 -43.8008 -43.8008 -43.6830 -43.6830 -43.6827 -43.6827 -28.1010 -28.1010 -9.4595 -9.4595 -9.1113 -9.1113 -9.0227 -9.0227 3.1616 3.1616 4.3240 4.3240 7.5018 7.5018 7.8738 7.8738 9.0676 9.0676 9.2579 9.2579 9.4241 9.4241 9.7327 9.7327 10.1931 10.1931 10.3036 10.3036 10.4684 10.4684 10.4871 10.4871 10.8527 10.8527 11.4254 11.4254 12.8721 12.8721 13.8815 13.8815 14.3656 14.3656 15.2055 15.2055 15.8561 15.8561 k = 0.0161 0.5912 0.5084 ( 6202 PWs) bands (ev): -79.7939 -79.7939 -79.7937 -79.7937 -45.4825 -45.4825 -45.4820 -45.4820 -43.8021 -43.8021 -43.8013 -43.8013 -43.6829 -43.6829 -43.6828 -43.6828 -28.1010 -28.1010 -9.4595 -9.4595 -9.1113 -9.1113 -9.0227 -9.0227 3.1593 3.1593 4.3275 4.3275 7.5395 7.5395 7.8316 7.8316 9.0662 9.0662 9.2654 9.2654 9.4262 9.4262 9.7264 9.7264 10.1988 10.1988 10.2984 10.2984 10.4724 10.4724 10.4819 10.4819 10.8611 10.8611 11.4084 11.4084 12.8726 12.8726 13.9346 13.9346 14.3132 14.3132 15.2057 15.2057 15.8460 15.8460 k = 0.0000 0.5873 0.5128 ( 6206 PWs) bands (ev): -79.7939 -79.7939 -79.7939 -79.7939 -45.4822 -45.4822 -45.4822 -45.4822 -43.8017 -43.8017 -43.8017 -43.8017 -43.6829 -43.6829 -43.6829 -43.6829 -28.1010 -28.1010 -9.4595 -9.4595 -9.1113 -9.1113 -9.0227 -9.0227 3.1585 3.1585 4.3286 4.3286 7.5549 7.5549 7.8147 7.8147 9.0655 9.0655 9.2679 9.2679 9.4270 9.4270 9.7241 9.7241 10.2010 10.2010 10.2960 10.2960 10.4763 10.4763 10.4773 10.4773 10.8638 10.8638 11.4026 11.4026 12.8725 12.8725 13.9558 13.9558 14.2920 14.2920 15.2059 15.2059 15.8427 15.8427 k = 0.0000 0.5873 0.5128 ( 6206 PWs) bands (ev): -79.7939 -79.7939 -79.7939 -79.7939 -45.4822 -45.4822 -45.4822 -45.4822 -43.8017 -43.8017 -43.8017 -43.8017 -43.6829 -43.6829 -43.6829 -43.6829 -28.1010 -28.1010 -9.4595 -9.4595 -9.1113 -9.1113 -9.0227 -9.0227 3.1585 3.1585 4.3286 4.3286 7.5549 7.5549 7.8147 7.8147 9.0655 9.0655 9.2679 9.2679 9.4270 9.4270 9.7241 9.7241 10.2010 10.2010 10.2960 10.2960 10.4763 10.4763 10.4773 10.4773 10.8638 10.8638 11.4026 11.4026 12.8725 12.8725 13.9558 13.9558 14.2920 14.2920 15.2059 15.2059 15.8427 15.8427 k = 0.0061 0.5764 0.5253 ( 6204 PWs) bands (ev): -79.7938 -79.7938 -79.7938 -79.7938 -45.4822 -45.4822 -45.4822 -45.4822 -43.8017 -43.8017 -43.8017 -43.8017 -43.6829 -43.6829 -43.6829 -43.6829 -28.1010 -28.1010 -9.4595 -9.4595 -9.1114 -9.1114 -9.0227 -9.0227 3.1591 3.1591 4.3298 4.3298 7.5553 7.5553 7.8145 7.8145 9.0619 9.0619 9.2718 9.2718 9.4266 9.4266 9.7245 9.7245 10.1989 10.1989 10.2943 10.2943 10.4754 10.4754 10.4830 10.4830 10.8629 10.8629 11.4026 11.4026 12.8679 12.8679 13.9546 13.9546 14.2908 14.2908 15.1941 15.1941 15.8452 15.8452 k = 0.0122 0.5655 0.5378 ( 6204 PWs) bands (ev): -79.7938 -79.7938 -79.7938 -79.7938 -45.4822 -45.4822 -45.4822 -45.4822 -43.8017 -43.8017 -43.8017 -43.8017 -43.6829 -43.6829 -43.6828 -43.6828 -28.1010 -28.1010 -9.4596 -9.4596 -9.1115 -9.1115 -9.0228 -9.0228 3.1607 3.1607 4.3332 4.3332 7.5564 7.5564 7.8138 7.8138 9.0513 9.0513 9.2825 9.2825 9.4258 9.4258 9.7251 9.7251 10.1933 10.1933 10.2887 10.2887 10.4785 10.4785 10.4930 10.4930 10.8598 10.8598 11.4029 11.4029 12.8542 12.8542 13.9505 13.9505 14.2865 14.2865 15.1605 15.1605 15.8530 15.8530 k = 0.0183 0.5546 0.5503 ( 6214 PWs) bands (ev): -79.7940 -79.7940 -79.7940 -79.7940 -45.4823 -45.4823 -45.4823 -45.4823 -43.8018 -43.8018 -43.8018 -43.8018 -43.6829 -43.6829 -43.6828 -43.6828 -28.1010 -28.1010 -9.4596 -9.4596 -9.1117 -9.1117 -9.0231 -9.0231 3.1633 3.1633 4.3388 4.3388 7.5581 7.5581 7.8126 7.8126 9.0356 9.0356 9.2980 9.2980 9.4243 9.4243 9.7259 9.7259 10.1844 10.1844 10.2798 10.2798 10.4856 10.4856 10.5056 10.5056 10.8544 10.8544 11.4032 11.4032 12.8315 12.8315 13.9429 13.9429 14.2786 14.2786 15.1094 15.1094 15.8662 15.8662 k = 0.0244 0.5436 0.5628 ( 6216 PWs) bands (ev): -79.7941 -79.7941 -79.7941 -79.7941 -45.4823 -45.4823 -45.4823 -45.4823 -43.8018 -43.8018 -43.8018 -43.8018 -43.6828 -43.6828 -43.6828 -43.6828 -28.1009 -28.1009 -9.4597 -9.4597 -9.1119 -9.1119 -9.0234 -9.0234 3.1669 3.1669 4.3467 4.3467 7.5605 7.5605 7.8108 7.8108 9.0172 9.0172 9.3163 9.3163 9.4231 9.4231 9.7273 9.7273 10.1734 10.1734 10.2693 10.2693 10.4964 10.4964 10.5205 10.5205 10.8473 10.8473 11.4038 11.4038 12.8013 12.8013 13.9315 13.9315 14.2660 14.2660 15.0472 15.0472 15.8854 15.8854 k = 0.0305 0.5327 0.5753 ( 6214 PWs) bands (ev): -79.7940 -79.7940 -79.7940 -79.7940 -45.4823 -45.4823 -45.4823 -45.4823 -43.8019 -43.8019 -43.8018 -43.8018 -43.6828 -43.6828 -43.6827 -43.6827 -28.1008 -28.1008 -9.4599 -9.4599 -9.1122 -9.1122 -9.0237 -9.0237 3.1716 3.1716 4.3568 4.3568 7.5635 7.5635 7.8083 7.8083 8.9973 8.9973 9.3357 9.3357 9.4227 9.4227 9.7290 9.7290 10.1609 10.1609 10.2579 10.2579 10.5100 10.5100 10.5370 10.5370 10.8383 10.8383 11.4043 11.4043 12.7644 12.7644 13.9154 13.9154 14.2471 14.2471 14.9802 14.9802 15.9109 15.9109 k = 0.0366 0.5218 0.5878 ( 6218 PWs) bands (ev): -79.7941 -79.7941 -79.7941 -79.7941 -45.4823 -45.4823 -45.4823 -45.4823 -43.8020 -43.8020 -43.8019 -43.8019 -43.6827 -43.6827 -43.6827 -43.6827 -28.1008 -28.1008 -9.4600 -9.4600 -9.1126 -9.1126 -9.0242 -9.0242 3.1773 3.1773 4.3691 4.3691 7.5669 7.5669 7.8050 7.8050 8.9772 8.9772 9.3535 9.3535 9.4237 9.4237 9.7307 9.7307 10.1467 10.1467 10.2460 10.2460 10.5254 10.5254 10.5545 10.5545 10.8273 10.8273 11.4049 11.4049 12.7221 12.7221 13.8940 13.8940 14.2191 14.2191 14.9139 14.9139 15.9426 15.9426 k = 0.0427 0.5109 0.6003 ( 6216 PWs) bands (ev): -79.7940 -79.7940 -79.7940 -79.7940 -45.4824 -45.4824 -45.4823 -45.4823 -43.8020 -43.8020 -43.8019 -43.8019 -43.6827 -43.6827 -43.6826 -43.6826 -28.1007 -28.1007 -9.4602 -9.4602 -9.1131 -9.1131 -9.0247 -9.0247 3.1839 3.1839 4.3836 4.3836 7.5708 7.5708 7.8009 7.8009 8.9574 8.9574 9.3674 9.3674 9.4291 9.4291 9.7323 9.7323 10.1325 10.1325 10.2343 10.2343 10.5415 10.5415 10.5727 10.5727 10.8151 10.8151 11.4057 11.4057 12.6755 12.6755 13.8668 13.8668 14.1799 14.1799 14.8545 14.8545 15.9810 15.9810 k = 0.0488 0.5000 0.6129 ( 6218 PWs) bands (ev): -79.7941 -79.7941 -79.7941 -79.7941 -45.4824 -45.4824 -45.4823 -45.4823 -43.8021 -43.8021 -43.8020 -43.8020 -43.6826 -43.6826 -43.6825 -43.6825 -28.1005 -28.1005 -9.4604 -9.4604 -9.1137 -9.1137 -9.0252 -9.0252 3.1915 3.1915 4.4003 4.4003 7.5749 7.5749 7.7956 7.7956 8.9385 8.9385 9.3750 9.3750 9.4404 9.4404 9.7335 9.7335 10.1182 10.1182 10.2232 10.2232 10.5580 10.5580 10.5906 10.5906 10.8014 10.8014 11.4065 11.4065 12.6252 12.6252 13.8336 13.8336 14.1277 14.1277 14.8060 14.8060 16.0257 16.0257 k = 0.0549 0.4890 0.6254 ( 6222 PWs) bands (ev): -79.7942 -79.7942 -79.7942 -79.7942 -45.4824 -45.4824 -45.4824 -45.4824 -43.8022 -43.8022 -43.8021 -43.8021 -43.6826 -43.6826 -43.6825 -43.6825 -28.1004 -28.1004 -9.4607 -9.4607 -9.1143 -9.1143 -9.0258 -9.0258 3.2001 3.2001 4.4190 4.4190 7.5791 7.5791 7.7892 7.7892 8.9209 8.9209 9.3771 9.3771 9.4568 9.4568 9.7344 9.7344 10.1042 10.1042 10.2125 10.2125 10.5741 10.5741 10.6083 10.6083 10.7864 10.7864 11.4071 11.4071 12.5723 12.5723 13.7947 13.7947 14.0626 14.0626 14.7700 14.7700 16.0763 16.0763 k = 0.0610 0.4781 0.6379 ( 6222 PWs) bands (ev): -79.7942 -79.7942 -79.7942 -79.7942 -45.4824 -45.4824 -45.4824 -45.4824 -43.8023 -43.8023 -43.8022 -43.8022 -43.6825 -43.6825 -43.6824 -43.6824 -28.1003 -28.1003 -9.4610 -9.4610 -9.1150 -9.1150 -9.0264 -9.0264 3.2095 3.2095 4.4399 4.4399 7.5833 7.5833 7.7814 7.7814 8.9052 8.9052 9.3761 9.3761 9.4758 9.4758 9.7345 9.7345 10.0908 10.0908 10.2037 10.2037 10.5892 10.5892 10.6258 10.6258 10.7715 10.7715 11.4076 11.4076 12.5180 12.5180 13.7501 13.7501 13.9858 13.9858 14.7464 14.7464 16.1323 16.1323 k = 0.0671 0.4672 0.6504 ( 6218 PWs) bands (ev): -79.7941 -79.7941 -79.7941 -79.7941 -45.4824 -45.4824 -45.4824 -45.4824 -43.8024 -43.8024 -43.8023 -43.8023 -43.6824 -43.6824 -43.6822 -43.6822 -28.1001 -28.1001 -9.4613 -9.4613 -9.1158 -9.1158 -9.0271 -9.0271 3.2198 3.2198 4.4628 4.4628 7.5873 7.5873 7.7722 7.7722 8.8917 8.8917 9.3738 9.3738 9.4953 9.4953 9.7340 9.7340 10.0782 10.0782 10.1964 10.1964 10.6025 10.6025 10.6426 10.6426 10.7576 10.7576 11.4086 11.4086 12.4627 12.4627 13.7006 13.7006 13.9005 13.9005 14.7336 14.7336 16.1930 16.1930 k = 0.0732 0.4563 0.6629 ( 6208 PWs) bands (ev): -79.7939 -79.7939 -79.7939 -79.7939 -45.4824 -45.4824 -45.4824 -45.4824 -43.8025 -43.8025 -43.8023 -43.8023 -43.6822 -43.6822 -43.6821 -43.6821 -28.0999 -28.0999 -9.4617 -9.4617 -9.1167 -9.1167 -9.0277 -9.0277 3.2309 3.2309 4.4877 4.4877 7.5909 7.5909 7.7613 7.7613 8.8808 8.8808 9.3712 9.3712 9.5146 9.5146 9.7331 9.7331 10.0667 10.0667 10.1906 10.1906 10.6119 10.6119 10.6589 10.6589 10.7464 10.7464 11.4090 11.4090 12.4070 12.4070 13.6468 13.6468 13.8095 13.8095 14.7294 14.7294 16.2574 16.2574 k = 0.0793 0.4454 0.6754 ( 6202 PWs) bands (ev): -79.7938 -79.7938 -79.7938 -79.7938 -45.4824 -45.4824 -45.4824 -45.4824 -43.8025 -43.8025 -43.8024 -43.8024 -43.6821 -43.6821 -43.6820 -43.6820 -28.0998 -28.0998 -9.4621 -9.4621 -9.1176 -9.1176 -9.0283 -9.0283 3.2427 3.2427 4.5146 4.5146 7.5939 7.5939 7.7488 7.7488 8.8723 8.8723 9.3686 9.3686 9.5330 9.5330 9.7311 9.7311 10.0563 10.0563 10.1861 10.1861 10.6147 10.6147 10.6736 10.6736 10.7405 10.7405 11.4095 11.4095 12.3509 12.3509 13.5888 13.5888 13.7155 13.7155 14.7319 14.7319 16.3247 16.3247 k = 0.0854 0.4344 0.6879 ( 6210 PWs) bands (ev): -79.7939 -79.7939 -79.7939 -79.7939 -45.4825 -45.4825 -45.4824 -45.4824 -43.8027 -43.8027 -43.8026 -43.8026 -43.6820 -43.6820 -43.6819 -43.6819 -28.0996 -28.0996 -9.4625 -9.4625 -9.1186 -9.1186 -9.0290 -9.0290 3.2552 3.2552 4.5433 4.5433 7.5959 7.5959 7.7345 7.7345 8.8665 8.8665 9.3662 9.3662 9.5495 9.5495 9.7280 9.7280 10.0467 10.0467 10.1828 10.1828 10.6087 10.6087 10.6871 10.6871 10.7411 10.7411 11.4092 11.4092 12.2950 12.2950 13.5270 13.5270 13.6197 13.6197 14.7392 14.7392 16.3938 16.3938 k = 0.0915 0.4235 0.7004 ( 6200 PWs) bands (ev): -79.7938 -79.7938 -79.7938 -79.7938 -45.4824 -45.4824 -45.4824 -45.4824 -43.8028 -43.8028 -43.8026 -43.8026 -43.6818 -43.6818 -43.6817 -43.6817 -28.0994 -28.0994 -9.4630 -9.4630 -9.1197 -9.1197 -9.0295 -9.0295 3.2684 3.2684 4.5738 4.5738 7.5970 7.5970 7.7184 7.7184 8.8639 8.8639 9.3647 9.3647 9.5651 9.5651 9.7246 9.7246 10.0392 10.0392 10.1814 10.1814 10.5954 10.5954 10.7006 10.7006 10.7480 10.7480 11.4088 11.4088 12.2402 12.2402 13.4626 13.4626 13.5258 13.5258 14.7504 14.7504 16.4638 16.4638 k = 0.0976 0.4126 0.7129 ( 6194 PWs) bands (ev): -79.7936 -79.7936 -79.7936 -79.7936 -45.4824 -45.4824 -45.4824 -45.4824 -43.8029 -43.8029 -43.8027 -43.8027 -43.6817 -43.6817 -43.6816 -43.6816 -28.0992 -28.0992 -9.4635 -9.4635 -9.1209 -9.1209 -9.0301 -9.0301 3.2822 3.2822 4.6061 4.6061 7.5970 7.5970 7.7005 7.7005 8.8643 8.8643 9.3635 9.3635 9.5788 9.5788 9.7203 9.7203 10.0332 10.0332 10.1811 10.1811 10.5765 10.5765 10.7136 10.7136 10.7583 10.7583 11.4079 11.4079 12.1860 12.1860 13.3946 13.3946 13.4351 13.4351 14.7642 14.7642 16.5333 16.5333 k = 0.1037 0.4017 0.7254 ( 6190 PWs) bands (ev): -79.7936 -79.7936 -79.7936 -79.7936 -45.4824 -45.4824 -45.4824 -45.4824 -43.8030 -43.8030 -43.8028 -43.8028 -43.6816 -43.6816 -43.6814 -43.6814 -28.0990 -28.0990 -9.4640 -9.4640 -9.1221 -9.1221 -9.0306 -9.0306 3.2966 3.2966 4.6400 4.6400 7.5955 7.5955 7.6809 7.6809 8.8679 8.8679 9.3635 9.3635 9.5904 9.5904 9.7157 9.7157 10.0287 10.0287 10.1817 10.1817 10.5541 10.5541 10.7257 10.7257 10.7706 10.7706 11.4064 11.4064 12.1326 12.1326 13.3206 13.3206 13.3513 13.3513 14.7800 14.7800 16.6016 16.6016 k = 0.1098 0.3908 0.7379 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4825 -45.4825 -45.4824 -45.4824 -43.8031 -43.8031 -43.8029 -43.8029 -43.6815 -43.6815 -43.6813 -43.6813 -28.0988 -28.0988 -9.4646 -9.4646 -9.1234 -9.1234 -9.0311 -9.0311 3.3113 3.3113 4.6755 4.6755 7.5923 7.5923 7.6597 7.6597 8.8744 8.8744 9.3643 9.3643 9.6002 9.6002 9.7104 9.7104 10.0259 10.0259 10.1831 10.1831 10.5296 10.5296 10.7372 10.7372 10.7836 10.7836 11.4044 11.4044 12.0802 12.0802 13.2400 13.2400 13.2768 13.2768 14.7968 14.7968 16.6676 16.6676 k = 0.1159 0.3798 0.7504 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4825 -45.4825 -45.4824 -45.4824 -43.8032 -43.8032 -43.8030 -43.8030 -43.6813 -43.6813 -43.6812 -43.6812 -28.0986 -28.0986 -9.4652 -9.4652 -9.1247 -9.1247 -9.0315 -9.0315 3.3265 3.3265 4.7124 4.7124 7.5874 7.5874 7.6371 7.6371 8.8837 8.8837 9.3664 9.3664 9.6078 9.6078 9.7043 9.7043 10.0247 10.0247 10.1848 10.1848 10.5037 10.5037 10.7480 10.7480 10.7966 10.7966 11.4016 11.4016 12.0290 12.0290 13.1586 13.1586 13.2069 13.2069 14.8140 14.8140 16.7303 16.7303 k = 0.1220 0.3689 0.7629 ( 6184 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4825 -45.4825 -45.4824 -45.4824 -43.8033 -43.8033 -43.8031 -43.8031 -43.6812 -43.6812 -43.6810 -43.6810 -28.0984 -28.0984 -9.4659 -9.4659 -9.1261 -9.1261 -9.0319 -9.0319 3.3420 3.3420 4.7506 4.7506 7.5806 7.5806 7.6133 7.6133 8.8960 8.8960 9.3697 9.3697 9.6135 9.6135 9.6983 9.6983 10.0253 10.0253 10.1870 10.1870 10.4771 10.4771 10.7579 10.7579 10.8092 10.8092 11.3983 11.3983 11.9785 11.9785 13.0798 13.0798 13.1392 13.1392 14.8312 14.8312 16.7893 16.7893 k = 0.1280 0.3580 0.7754 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4825 -45.4825 -45.4825 -45.4825 -43.8035 -43.8035 -43.8033 -43.8033 -43.6811 -43.6811 -43.6809 -43.6809 -28.0981 -28.0981 -9.4665 -9.4665 -9.1275 -9.1275 -9.0323 -9.0323 3.3577 3.3577 4.7900 4.7900 7.5713 7.5713 7.5885 7.5885 8.9109 8.9109 9.3740 9.3740 9.6173 9.6173 9.6919 9.6919 10.0265 10.0265 10.1892 10.1892 10.4502 10.4502 10.7677 10.7677 10.8216 10.8216 11.3941 11.3941 11.9293 11.9293 13.0044 13.0044 13.0728 13.0728 14.8475 14.8475 16.8441 16.8441 k = 0.1341 0.3471 0.7880 ( 6190 PWs) bands (ev): -79.7936 -79.7936 -79.7936 -79.7936 -45.4826 -45.4826 -45.4825 -45.4825 -43.8036 -43.8036 -43.8034 -43.8034 -43.6810 -43.6810 -43.6808 -43.6808 -28.0979 -28.0979 -9.4672 -9.4672 -9.1289 -9.1289 -9.0325 -9.0325 3.3735 3.3735 4.8305 4.8305 7.5583 7.5583 7.5647 7.5647 8.9284 8.9284 9.3796 9.3796 9.6196 9.6196 9.6855 9.6855 10.0286 10.0286 10.1910 10.1910 10.4234 10.4234 10.7770 10.7770 10.8331 10.8331 11.3889 11.3889 11.8810 11.8810 12.9338 12.9338 13.0084 13.0084 14.8623 14.8623 16.8948 16.8948 k = 0.1402 0.3362 0.8005 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4826 -45.4826 -45.4825 -45.4825 -43.8037 -43.8037 -43.8035 -43.8035 -43.6809 -43.6809 -43.6806 -43.6806 -28.0977 -28.0977 -9.4679 -9.4679 -9.1303 -9.1303 -9.0328 -9.0328 3.3894 3.3894 4.8719 4.8719 7.5350 7.5350 7.5485 7.5485 8.9483 8.9483 9.3866 9.3866 9.6204 9.6204 9.6792 9.6792 10.0316 10.0316 10.1925 10.1925 10.3971 10.3971 10.7862 10.7862 10.8444 10.8444 11.3832 11.3832 11.8337 11.8337 12.8684 12.8684 12.9462 12.9462 14.8753 14.8753 16.9416 16.9416 k = 0.1463 0.3252 0.8130 ( 6190 PWs) bands (ev): -79.7936 -79.7936 -79.7936 -79.7936 -45.4827 -45.4827 -45.4826 -45.4826 -43.8038 -43.8038 -43.8036 -43.8036 -43.6808 -43.6808 -43.6805 -43.6805 -28.0975 -28.0975 -9.4687 -9.4687 -9.1317 -9.1317 -9.0330 -9.0330 3.4052 3.4052 4.9140 4.9140 7.5086 7.5086 7.5329 7.5329 8.9703 8.9703 9.3945 9.3945 9.6200 9.6200 9.6729 9.6729 10.0348 10.0348 10.1932 10.1932 10.3713 10.3713 10.7950 10.7950 10.8549 10.8549 11.3762 11.3762 11.7865 11.7865 12.8079 12.8079 12.8864 12.8864 14.8857 14.8857 16.9325 16.9325 k = 0.1524 0.3143 0.8255 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4827 -45.4827 -45.4826 -45.4826 -43.8039 -43.8039 -43.8038 -43.8038 -43.6806 -43.6806 -43.6804 -43.6804 -28.0973 -28.0973 -9.4694 -9.4694 -9.1331 -9.1331 -9.0331 -9.0331 3.4209 3.4209 4.9566 4.9566 7.4818 7.4818 7.5155 7.5155 8.9943 8.9943 9.4035 9.4035 9.6189 9.6189 9.6670 9.6670 10.0380 10.0380 10.1932 10.1932 10.3467 10.3467 10.8047 10.8047 10.8654 10.8654 11.3685 11.3685 11.7406 11.7406 12.7521 12.7521 12.8292 12.8292 14.8933 14.8933 16.8912 16.8912 k = 0.1585 0.3034 0.8380 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4827 -45.4827 -45.4826 -45.4826 -43.8041 -43.8041 -43.8039 -43.8039 -43.6805 -43.6805 -43.6803 -43.6803 -28.0971 -28.0971 -9.4701 -9.4701 -9.1344 -9.1344 -9.0332 -9.0332 3.4363 3.4363 4.9995 4.9995 7.4551 7.4551 7.4963 7.4963 9.0198 9.0198 9.4133 9.4133 9.6168 9.6168 9.6612 9.6612 10.0408 10.0408 10.1923 10.1923 10.3234 10.3234 10.8146 10.8146 10.8752 10.8752 11.3596 11.3596 11.6951 11.6951 12.7012 12.7012 12.7750 12.7750 14.8976 14.8976 16.8596 16.8596 k = 0.1646 0.2925 0.8505 ( 6186 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4827 -45.4827 -45.4827 -45.4827 -43.8042 -43.8042 -43.8040 -43.8040 -43.6804 -43.6804 -43.6802 -43.6802 -28.0969 -28.0969 -9.4709 -9.4709 -9.1357 -9.1357 -9.0333 -9.0333 3.4514 3.4514 5.0424 5.0424 7.4289 7.4289 7.4753 7.4753 9.0468 9.0468 9.4239 9.4239 9.6143 9.6143 9.6555 9.6555 10.0429 10.0429 10.1902 10.1902 10.3016 10.3016 10.8252 10.8252 10.8847 10.8847 11.3496 11.3496 11.6501 11.6501 12.6551 12.6551 12.7243 12.7243 14.8985 14.8985 16.8381 16.8381 k = 0.1707 0.2816 0.8630 ( 6180 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4827 -45.4827 -45.4827 -45.4827 -43.8043 -43.8043 -43.8041 -43.8041 -43.6803 -43.6803 -43.6800 -43.6800 -28.0967 -28.0967 -9.4716 -9.4716 -9.1370 -9.1370 -9.0334 -9.0334 3.4661 3.4661 5.0851 5.0851 7.4032 7.4032 7.4529 7.4529 9.0751 9.0751 9.4350 9.4350 9.6115 9.6115 9.6503 9.6503 10.0441 10.0441 10.1872 10.1872 10.2814 10.2814 10.8370 10.8370 10.8945 10.8945 11.3387 11.3387 11.6059 11.6059 12.6139 12.6139 12.6775 12.6775 14.8958 14.8958 16.8271 16.8271 k = 0.1768 0.2706 0.8755 ( 6174 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4827 -45.4827 -45.4826 -45.4826 -43.8044 -43.8044 -43.8041 -43.8041 -43.6801 -43.6801 -43.6799 -43.6799 -28.0966 -28.0966 -9.4723 -9.4723 -9.1382 -9.1382 -9.0334 -9.0334 3.4802 3.4802 5.1273 5.1273 7.3784 7.3784 7.4293 7.4293 9.1041 9.1041 9.4465 9.4465 9.6086 9.6086 9.6453 9.6453 10.0445 10.0445 10.1828 10.1828 10.2628 10.2628 10.8494 10.8494 10.9046 10.9046 11.3267 11.3267 11.5620 11.5620 12.5771 12.5771 12.6346 12.6346 14.8902 14.8902 16.8264 16.8264 k = 0.1829 0.2597 0.8880 ( 6176 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4827 -45.4827 -45.4827 -45.4827 -43.8045 -43.8045 -43.8042 -43.8042 -43.6800 -43.6800 -43.6798 -43.6798 -28.0964 -28.0964 -9.4730 -9.4730 -9.1393 -9.1393 -9.0334 -9.0334 3.4936 3.4936 5.1685 5.1685 7.3547 7.3547 7.4048 7.4048 9.1336 9.1336 9.4582 9.4582 9.6055 9.6055 9.6404 9.6404 10.0433 10.0433 10.1772 10.1772 10.2462 10.2462 10.8628 10.8628 10.9149 10.9149 11.3131 11.3131 11.5186 11.5186 12.5440 12.5440 12.5950 12.5950 14.8815 14.8815 16.8359 16.8359 k = 0.1890 0.2488 0.9005 ( 6172 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4827 -45.4827 -45.4827 -45.4827 -43.8045 -43.8045 -43.8043 -43.8043 -43.6800 -43.6800 -43.6797 -43.6797 -28.0962 -28.0962 -9.4737 -9.4737 -9.1404 -9.1404 -9.0334 -9.0334 3.5063 3.5063 5.2085 5.2085 7.3323 7.3323 7.3799 7.3799 9.1633 9.1633 9.4699 9.4699 9.6024 9.6024 9.6358 9.6358 10.0412 10.0412 10.1708 10.1708 10.2314 10.2314 10.8770 10.8770 10.9262 10.9262 11.2986 11.2986 11.4757 11.4757 12.5154 12.5154 12.5600 12.5600 14.8705 14.8705 16.8552 16.8552 k = 0.1951 0.2379 0.9130 ( 6172 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4827 -45.4827 -45.4827 -45.4827 -43.8046 -43.8046 -43.8044 -43.8044 -43.6799 -43.6799 -43.6796 -43.6796 -28.0961 -28.0961 -9.4743 -9.4743 -9.1413 -9.1413 -9.0333 -9.0333 3.5182 3.5182 5.2468 5.2468 7.3114 7.3114 7.3549 7.3549 9.1928 9.1928 9.4813 9.4813 9.5994 9.5994 9.6312 9.6312 10.0382 10.0382 10.1634 10.1634 10.2181 10.2181 10.8921 10.8921 10.9386 10.9386 11.2832 11.2832 11.4335 11.4335 12.4900 12.4900 12.5284 12.5284 14.8579 14.8579 16.8835 16.8835 k = 0.2012 0.2270 0.9255 ( 6172 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4828 -45.4828 -45.4827 -45.4827 -43.8047 -43.8047 -43.8045 -43.8045 -43.6798 -43.6798 -43.6796 -43.6796 -28.0960 -28.0960 -9.4748 -9.4748 -9.1422 -9.1422 -9.0333 -9.0333 3.5290 3.5290 5.2830 5.2830 7.2922 7.2922 7.3304 7.3304 9.2216 9.2216 9.4923 9.4923 9.5963 9.5963 9.6267 9.6267 10.0347 10.0347 10.1558 10.1558 10.2064 10.2064 10.9079 10.9079 10.9521 10.9521 11.2666 11.2666 11.3924 11.3924 12.4683 12.4683 12.5007 12.5007 14.8441 14.8441 16.9204 16.9204 k = 0.2073 0.2160 0.9380 ( 6174 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4828 -45.4828 -45.4827 -45.4827 -43.8047 -43.8047 -43.8045 -43.8045 -43.6797 -43.6797 -43.6795 -43.6795 -28.0959 -28.0959 -9.4754 -9.4754 -9.1430 -9.1430 -9.0332 -9.0332 3.5389 3.5389 5.3166 5.3166 7.2747 7.2747 7.3070 7.3070 9.2493 9.2493 9.5025 9.5025 9.5934 9.5934 9.6224 9.6224 10.0308 10.0308 10.1478 10.1478 10.1961 10.1961 10.9246 10.9246 10.9668 10.9668 11.2490 11.2490 11.3525 11.3525 12.4494 12.4494 12.4764 12.4764 14.8301 14.8301 16.9650 16.9650 k = 0.2134 0.2051 0.9505 ( 6184 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4829 -45.4829 -45.4828 -45.4828 -43.8048 -43.8048 -43.8046 -43.8046 -43.6797 -43.6797 -43.6795 -43.6795 -28.0958 -28.0958 -9.4758 -9.4758 -9.1437 -9.1437 -9.0332 -9.0332 3.5476 3.5476 5.3471 5.3471 7.2592 7.2592 7.2850 7.2850 9.2752 9.2752 9.5119 9.5119 9.5904 9.5904 9.6182 9.6182 10.0266 10.0266 10.1398 10.1398 10.1870 10.1870 10.9418 10.9418 10.9824 10.9824 11.2302 11.2302 11.3141 11.3141 12.4331 12.4331 12.4555 12.4555 14.8161 14.8161 17.0165 17.0165 k = 0.2195 0.1942 0.9631 ( 6182 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4829 -45.4829 -45.4828 -45.4828 -43.8049 -43.8049 -43.8047 -43.8047 -43.6797 -43.6797 -43.6794 -43.6794 -28.0957 -28.0957 -9.4762 -9.4762 -9.1443 -9.1443 -9.0332 -9.0332 3.5551 3.5551 5.3740 5.3740 7.2458 7.2458 7.2653 7.2653 9.2990 9.2990 9.5203 9.5203 9.5876 9.5876 9.6143 9.6143 10.0232 10.0232 10.1324 10.1324 10.1791 10.1791 10.9604 10.9604 10.9997 10.9997 11.2111 11.2111 11.2780 11.2780 12.4201 12.4201 12.4387 12.4387 14.8033 14.8033 17.0743 17.0743 k = 0.2256 0.1833 0.9756 ( 6180 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4829 -45.4829 -45.4828 -45.4828 -43.8049 -43.8049 -43.8047 -43.8047 -43.6796 -43.6796 -43.6794 -43.6794 -28.0956 -28.0956 -9.4766 -9.4766 -9.1448 -9.1448 -9.0331 -9.0331 3.5613 3.5613 5.3968 5.3968 7.2347 7.2347 7.2484 7.2484 9.3199 9.3199 9.5274 9.5274 9.5851 9.5851 9.6109 9.6109 10.0203 10.0203 10.1258 10.1258 10.1724 10.1724 10.9799 10.9799 11.0175 11.0175 11.1915 11.1915 11.2441 11.2441 12.4097 12.4097 12.4253 12.4253 14.7921 14.7921 17.1373 17.1373 k = 0.2317 0.1724 0.9881 ( 6178 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4828 -45.4828 -45.4828 -45.4828 -43.8049 -43.8049 -43.8047 -43.8047 -43.6796 -43.6796 -43.6793 -43.6793 -28.0955 -28.0955 -9.4768 -9.4768 -9.1452 -9.1452 -9.0331 -9.0331 3.5662 3.5662 5.4152 5.4152 7.2258 7.2258 7.2348 7.2348 9.3373 9.3373 9.5334 9.5334 9.5827 9.5827 9.6080 9.6080 10.0183 10.0183 10.1200 10.1200 10.1669 10.1669 10.9999 10.9999 11.0352 11.0352 11.1716 11.1716 11.2135 11.2135 12.4017 12.4017 12.4151 12.4151 14.7831 14.7831 17.2045 17.2045 k = 0.2378 0.1614 1.0006 ( 6174 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4828 -45.4828 -45.4828 -45.4828 -43.8049 -43.8049 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4770 -9.4770 -9.1455 -9.1455 -9.0331 -9.0331 3.5698 3.5698 5.4286 5.4286 7.2190 7.2190 7.2251 7.2251 9.3504 9.3504 9.5378 9.5378 9.5808 9.5808 9.6058 9.6058 10.0168 10.0168 10.1158 10.1158 10.1632 10.1632 11.0199 11.0199 11.0510 11.0510 11.1532 11.1532 11.1869 11.1869 12.3960 12.3960 12.4081 12.4081 14.7763 14.7763 17.2746 17.2746 k = 0.2439 0.1505 1.0131 ( 6174 PWs) bands (ev): -79.7933 -79.7933 -79.7933 -79.7933 -45.4828 -45.4828 -45.4828 -45.4828 -43.8049 -43.8049 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1456 -9.1456 -9.0331 -9.0331 3.5719 3.5719 5.4367 5.4367 7.2145 7.2145 7.2196 7.2196 9.3586 9.3586 9.5405 9.5405 9.5794 9.5794 9.6043 9.6043 10.0161 10.0161 10.1128 10.1128 10.1605 10.1605 11.0378 11.0378 11.0612 11.0612 11.1399 11.1399 11.1663 11.1663 12.3927 12.3927 12.4040 12.4040 14.7723 14.7723 17.3446 17.3446 k = 0.2500 0.1396 1.0256 ( 6184 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8048 -43.8048 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5726 3.5726 5.4394 5.4394 7.2127 7.2127 7.2177 7.2177 9.3614 9.3614 9.5411 9.5411 9.5787 9.5787 9.6037 9.6037 10.0153 10.0153 10.1115 10.1115 10.1595 10.1595 11.0469 11.0469 11.0632 11.0632 11.1357 11.1357 11.1572 11.1572 12.3911 12.3911 12.4022 12.4022 14.7704 14.7704 17.3928 17.3928 k = 0.2500 0.1396 1.0256 ( 6184 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8048 -43.8048 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5726 3.5726 5.4394 5.4394 7.2127 7.2127 7.2177 7.2177 9.3614 9.3614 9.5411 9.5411 9.5787 9.5787 9.6037 9.6037 10.0153 10.0153 10.1115 10.1115 10.1595 10.1595 11.0469 11.0469 11.0632 11.0632 11.1357 11.1357 11.1572 11.1572 12.3911 12.3911 12.4022 12.4022 14.7704 14.7704 17.3928 17.3928 k = 0.2632 0.1469 1.0172 ( 6178 PWs) bands (ev): -79.7934 -79.7934 -79.7933 -79.7933 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5725 3.5725 5.4389 5.4389 7.2074 7.2074 7.2242 7.2242 9.3588 9.3588 9.5415 9.5415 9.5694 9.5694 9.6150 9.6150 10.0156 10.0156 10.1106 10.1106 10.1609 10.1609 11.0441 11.0441 11.0627 11.0627 11.1238 11.1238 11.1736 11.1736 12.3885 12.3885 12.4055 12.4055 14.7727 14.7727 17.3833 17.3833 k = 0.2763 0.1543 1.0088 ( 6178 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1456 -9.1456 -9.0331 -9.0331 3.5720 3.5720 5.4370 5.4370 7.2003 7.2003 7.2341 7.2341 9.3509 9.3509 9.5369 9.5369 9.5615 9.5615 9.6336 9.6336 10.0153 10.0153 10.1074 10.1074 10.1647 10.1647 11.0373 11.0373 11.0612 11.0612 11.1070 11.1070 11.2023 11.2023 12.3829 12.3829 12.4113 12.4113 14.7786 14.7786 17.3353 17.3353 k = 0.2895 0.1616 1.0003 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7934 -79.7934 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4771 -9.4771 -9.1456 -9.1456 -9.0331 -9.0331 3.5714 3.5714 5.4334 5.4334 7.1940 7.1940 7.2457 7.2457 9.3384 9.3384 9.5224 9.5224 9.5659 9.5659 9.6531 9.6531 10.0145 10.0145 10.1021 10.1021 10.1699 10.1699 11.0286 11.0286 11.0593 11.0593 11.0920 11.0920 11.2350 11.2350 12.3767 12.3767 12.4187 12.4187 14.7880 14.7880 17.2735 17.2735 k = 0.3026 0.1690 0.9919 ( 6182 PWs) bands (ev): -79.7935 -79.7935 -79.7934 -79.7934 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4771 -9.4771 -9.1455 -9.1455 -9.0331 -9.0331 3.5706 3.5706 5.4281 5.4281 7.1886 7.1886 7.2589 7.2589 9.3220 9.3220 9.5049 9.5049 9.5759 9.5759 9.6727 9.6727 10.0137 10.0137 10.0957 10.0957 10.1758 10.1758 11.0185 11.0185 11.0561 11.0561 11.0797 11.0797 11.2705 11.2705 12.3700 12.3700 12.4267 12.4267 14.8010 14.8010 17.2113 17.2113 k = 0.3158 0.1763 0.9835 ( 6178 PWs) bands (ev): -79.7936 -79.7936 -79.7931 -79.7931 -45.4830 -45.4830 -45.4827 -45.4827 -43.8051 -43.8051 -43.8046 -43.8046 -43.6795 -43.6795 -43.6794 -43.6794 -28.0955 -28.0955 -9.4770 -9.4770 -9.1454 -9.1454 -9.0331 -9.0331 3.5699 3.5699 5.4208 5.4208 7.1840 7.1840 7.2738 7.2738 9.3024 9.3024 9.4869 9.4869 9.5883 9.5883 9.6923 9.6923 10.0125 10.0125 10.0885 10.0885 10.1827 10.1827 11.0083 11.0083 11.0512 11.0512 11.0714 11.0714 11.3085 11.3085 12.3629 12.3629 12.4363 12.4363 14.8170 14.8170 17.1493 17.1493 k = 0.3289 0.1837 0.9751 ( 6174 PWs) bands (ev): -79.7935 -79.7935 -79.7932 -79.7932 -45.4830 -45.4830 -45.4826 -45.4826 -43.8051 -43.8051 -43.8045 -43.8045 -43.6795 -43.6795 -43.6794 -43.6794 -28.0955 -28.0955 -9.4769 -9.4769 -9.1452 -9.1452 -9.0331 -9.0331 3.5692 3.5692 5.4113 5.4113 7.1806 7.1806 7.2906 7.2906 9.2803 9.2803 9.4696 9.4696 9.6020 9.6020 9.7116 9.7116 10.0113 10.0113 10.0809 10.0809 10.1889 10.1889 10.9984 10.9984 11.0443 11.0443 11.0666 11.0666 11.3475 11.3475 12.3557 12.3557 12.4461 12.4461 14.8359 14.8359 17.0882 17.0882 k = 0.3421 0.1910 0.9667 ( 6171 PWs) bands (ev): -79.7934 -79.7934 -79.7931 -79.7931 -45.4830 -45.4830 -45.4826 -45.4826 -43.8052 -43.8052 -43.8044 -43.8044 -43.6795 -43.6795 -43.6794 -43.6794 -28.0955 -28.0955 -9.4768 -9.4768 -9.1451 -9.1451 -9.0331 -9.0331 3.5686 3.5686 5.3996 5.3996 7.1780 7.1780 7.3092 7.3092 9.2563 9.2563 9.4528 9.4528 9.6162 9.6162 9.7307 9.7307 10.0092 10.0092 10.0733 10.0733 10.1942 10.1942 10.9891 10.9891 11.0370 11.0370 11.0640 11.0640 11.3879 11.3879 12.3488 12.3488 12.4568 12.4568 14.8569 14.8569 17.0288 17.0288 k = 0.3553 0.1984 0.9583 ( 6173 PWs) bands (ev): -79.7934 -79.7934 -79.7931 -79.7931 -45.4831 -45.4831 -45.4825 -45.4825 -43.8052 -43.8052 -43.8043 -43.8043 -43.6795 -43.6795 -43.6795 -43.6795 -28.0956 -28.0956 -9.4766 -9.4766 -9.1449 -9.1449 -9.0332 -9.0332 3.5681 3.5681 5.3856 5.3856 7.1764 7.1764 7.3295 7.3295 9.2309 9.2309 9.4366 9.4366 9.6310 9.6310 9.7491 9.7491 10.0067 10.0067 10.0650 10.0650 10.1989 10.1989 10.9800 10.9800 11.0306 11.0306 11.0624 11.0624 11.4291 11.4291 12.3411 12.3411 12.4680 12.4680 14.8797 14.8797 16.9715 16.9715 k = 0.3684 0.2057 0.9499 ( 6178 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4831 -45.4831 -45.4825 -45.4825 -43.8053 -43.8053 -43.8042 -43.8042 -43.6795 -43.6795 -43.6795 -43.6795 -28.0956 -28.0956 -9.4765 -9.4765 -9.1447 -9.1447 -9.0332 -9.0332 3.5679 3.5679 5.3692 5.3692 7.1758 7.1758 7.3516 7.3516 9.2044 9.2044 9.4211 9.4211 9.6457 9.6457 9.7673 9.7673 10.0034 10.0034 10.0566 10.0566 10.2025 10.2025 10.9711 10.9711 11.0266 11.0266 11.0608 11.0608 11.4712 11.4712 12.3338 12.3338 12.4793 12.4793 14.9035 14.9035 16.9166 16.9166 k = 0.3816 0.2131 0.9414 ( 6172 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4831 -45.4831 -45.4824 -45.4824 -43.8054 -43.8054 -43.8041 -43.8041 -43.6795 -43.6795 -43.6795 -43.6795 -28.0956 -28.0956 -9.4763 -9.4763 -9.1444 -9.1444 -9.0332 -9.0332 3.5679 3.5679 5.3506 5.3506 7.1763 7.1763 7.3753 7.3753 9.1772 9.1772 9.4065 9.4065 9.6604 9.6604 9.7853 9.7853 9.9997 9.9997 10.0484 10.0484 10.2057 10.2057 10.9625 10.9625 11.0259 11.0259 11.0597 11.0597 11.5142 11.5142 12.3268 12.3268 12.4916 12.4916 14.9282 14.9282 16.8647 16.8647 k = 0.3947 0.2204 0.9330 ( 6171 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4832 -45.4832 -45.4823 -45.4823 -43.8055 -43.8055 -43.8040 -43.8040 -43.6795 -43.6795 -43.6795 -43.6795 -28.0957 -28.0957 -9.4761 -9.4761 -9.1442 -9.1442 -9.0333 -9.0333 3.5681 3.5681 5.3298 5.3298 7.1779 7.1779 7.4003 7.4003 9.1496 9.1496 9.3927 9.3927 9.6749 9.6749 9.8026 9.8026 9.9954 9.9954 10.0399 10.0399 10.2077 10.2077 10.9526 10.9526 11.0287 11.0287 11.0589 11.0589 11.5570 11.5570 12.3196 12.3196 12.5044 12.5044 14.9530 14.9530 16.8160 16.8160 k = 0.4079 0.2278 0.9246 ( 6164 PWs) bands (ev): -79.7932 -79.7932 -79.7930 -79.7930 -45.4832 -45.4832 -45.4822 -45.4822 -43.8055 -43.8055 -43.8038 -43.8038 -43.6796 -43.6796 -43.6794 -43.6794 -28.0957 -28.0957 -9.4759 -9.4759 -9.1439 -9.1439 -9.0333 -9.0333 3.5685 3.5685 5.3069 5.3069 7.1806 7.1806 7.4267 7.4267 9.1220 9.1220 9.3800 9.3800 9.6891 9.6891 9.8194 9.8194 9.9904 9.9904 10.0316 10.0316 10.2087 10.2087 10.9424 10.9424 11.0352 11.0352 11.0589 11.0589 11.5997 11.5997 12.3127 12.3127 12.5182 12.5182 14.9773 14.9773 16.7710 16.7710 k = 0.4211 0.2351 0.9162 ( 6170 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4833 -45.4833 -45.4822 -45.4822 -43.8056 -43.8056 -43.8037 -43.8037 -43.6796 -43.6796 -43.6795 -43.6795 -28.0958 -28.0958 -9.4757 -9.4757 -9.1436 -9.1436 -9.0333 -9.0333 3.5692 3.5692 5.2822 5.2822 7.1844 7.1844 7.4539 7.4539 9.0945 9.0945 9.3683 9.3683 9.7028 9.7028 9.8352 9.8352 9.9846 9.9846 10.0234 10.0234 10.2079 10.2079 10.9310 10.9310 11.0445 11.0445 11.0582 11.0582 11.6417 11.6417 12.3060 12.3060 12.5317 12.5317 15.0002 15.0002 16.7299 16.7299 k = 0.4342 0.2425 0.9078 ( 6171 PWs) bands (ev): -79.7933 -79.7933 -79.7932 -79.7932 -45.4834 -45.4834 -45.4821 -45.4821 -43.8057 -43.8057 -43.8035 -43.8035 -43.6797 -43.6797 -43.6795 -43.6795 -28.0958 -28.0958 -9.4755 -9.4755 -9.1432 -9.1432 -9.0334 -9.0334 3.5700 3.5700 5.2557 5.2557 7.1894 7.1894 7.4816 7.4816 9.0674 9.0674 9.3577 9.3577 9.7160 9.7160 9.8503 9.8503 9.9780 9.9780 10.0156 10.0156 10.2069 10.2069 10.9192 10.9192 11.0528 11.0528 11.0626 11.0626 11.6831 11.6831 12.2996 12.2996 12.5459 12.5459 15.0210 15.0210 16.6929 16.6929 k = 0.4474 0.2498 0.8994 ( 6174 PWs) bands (ev): -79.7934 -79.7934 -79.7932 -79.7932 -45.4835 -45.4835 -45.4820 -45.4820 -43.8059 -43.8059 -43.8034 -43.8034 -43.6797 -43.6797 -43.6795 -43.6795 -28.0959 -28.0959 -9.4752 -9.4752 -9.1429 -9.1429 -9.0335 -9.0335 3.5709 3.5709 5.2278 5.2278 7.1955 7.1955 7.5096 7.5096 9.0408 9.0408 9.3482 9.3482 9.7281 9.7281 9.8644 9.8644 9.9708 9.9708 10.0086 10.0086 10.2049 10.2049 10.9074 10.9074 11.0539 11.0539 11.0766 11.0766 11.7232 11.7232 12.2943 12.2943 12.5609 12.5609 15.0392 15.0392 16.6602 16.6602 k = 0.4605 0.2571 0.8910 ( 6183 PWs) bands (ev): -79.7936 -79.7936 -79.7933 -79.7933 -45.4836 -45.4836 -45.4820 -45.4820 -43.8060 -43.8060 -43.8032 -43.8032 -43.6798 -43.6798 -43.6796 -43.6796 -28.0959 -28.0959 -9.4750 -9.4750 -9.1425 -9.1425 -9.0335 -9.0335 3.5719 3.5719 5.1987 5.1987 7.2027 7.2027 7.5376 7.5376 9.0151 9.0151 9.3400 9.3400 9.7392 9.7392 9.8766 9.8766 9.9631 9.9631 10.0026 10.0026 10.2021 10.2021 10.8949 10.8949 11.0528 11.0528 11.0946 11.0946 11.7616 11.7616 12.2898 12.2898 12.5767 12.5767 15.0538 15.0538 16.6319 16.6319 k = 0.4737 0.2645 0.8825 ( 6177 PWs) bands (ev): -79.7936 -79.7936 -79.7931 -79.7931 -45.4836 -45.4836 -45.4819 -45.4819 -43.8061 -43.8061 -43.8030 -43.8030 -43.6798 -43.6798 -43.6796 -43.6796 -28.0960 -28.0960 -9.4747 -9.4747 -9.1421 -9.1421 -9.0336 -9.0336 3.5728 3.5728 5.1688 5.1688 7.2112 7.2112 7.5653 7.5653 8.9904 8.9904 9.3336 9.3336 9.7497 9.7497 9.8864 9.8864 9.9564 9.9564 9.9986 9.9986 10.1992 10.1992 10.8830 10.8830 11.0522 11.0522 11.1156 11.1156 11.7981 11.7981 12.2864 12.2864 12.5936 12.5936 15.0649 15.0649 16.6086 16.6086 k = 0.4868 0.2718 0.8741 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4838 -45.4838 -45.4817 -45.4817 -43.8063 -43.8063 -43.8028 -43.8028 -43.6799 -43.6799 -43.6795 -43.6795 -28.0960 -28.0960 -9.4744 -9.4744 -9.1416 -9.1416 -9.0336 -9.0336 3.5735 3.5735 5.1382 5.1382 7.2209 7.2209 7.5921 7.5921 8.9668 8.9668 9.3284 9.3284 9.7590 9.7590 9.8918 9.8918 9.9505 9.9505 9.9960 9.9960 10.1962 10.1962 10.8701 10.8701 11.0525 11.0525 11.1380 11.1380 11.8317 11.8317 12.2835 12.2835 12.6119 12.6119 15.0714 15.0714 16.5897 16.5897 k = 0.5000 0.2792 0.8657 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4839 -45.4839 -45.4816 -45.4816 -43.8065 -43.8065 -43.8026 -43.8026 -43.6800 -43.6800 -43.6795 -43.6795 -28.0961 -28.0961 -9.4741 -9.4741 -9.1412 -9.1412 -9.0337 -9.0337 3.5739 3.5739 5.1074 5.1074 7.2318 7.2318 7.6177 7.6177 8.9444 8.9444 9.3251 9.3251 9.7663 9.7663 9.8914 9.8914 9.9476 9.9476 9.9969 9.9969 10.1932 10.1932 10.8580 10.8580 11.0520 11.0520 11.1620 11.1620 11.8623 11.8623 12.2826 12.2826 12.6308 12.6308 15.0732 15.0732 16.5762 16.5762 k = 0.5000 0.2792 0.8657 ( 6180 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4839 -45.4839 -45.4816 -45.4816 -43.8065 -43.8065 -43.8026 -43.8026 -43.6800 -43.6800 -43.6795 -43.6795 -28.0961 -28.0961 -9.4741 -9.4741 -9.1412 -9.1412 -9.0337 -9.0337 3.5739 3.5739 5.1074 5.1074 7.2318 7.2318 7.6177 7.6177 8.9444 8.9444 9.3251 9.3251 9.7663 9.7663 9.8914 9.8914 9.9476 9.9476 9.9969 9.9969 10.1932 10.1932 10.8580 10.8580 11.0520 11.0520 11.1620 11.1620 11.8623 11.8623 12.2826 12.2826 12.6308 12.6308 15.0732 15.0732 16.5762 16.5762 k = 0.5000 0.2792 0.8477 ( 6180 PWs) bands (ev): -79.7937 -79.7937 -79.7931 -79.7931 -45.4841 -45.4841 -45.4814 -45.4814 -43.8068 -43.8068 -43.8021 -43.8021 -43.6801 -43.6801 -43.6796 -43.6796 -28.0963 -28.0963 -9.4733 -9.4733 -9.1401 -9.1401 -9.0339 -9.0339 3.5741 3.5741 5.0398 5.0398 7.2577 7.2577 7.6719 7.6719 8.8970 8.8970 9.3197 9.3197 9.7810 9.7810 9.8834 9.8834 9.9429 9.9429 10.0043 10.0043 10.1855 10.1855 10.8337 10.8337 11.0499 11.0499 11.2170 11.2170 11.9259 11.9259 12.2835 12.2835 12.6749 12.6749 15.0719 15.0719 16.5518 16.5518 k = 0.5000 0.2792 0.8296 ( 6190 PWs) bands (ev): -79.7939 -79.7939 -79.7933 -79.7933 -45.4844 -45.4844 -45.4811 -45.4811 -43.8072 -43.8072 -43.8016 -43.8016 -43.6803 -43.6803 -43.6796 -43.6796 -28.0964 -28.0964 -9.4725 -9.4725 -9.1389 -9.1389 -9.0340 -9.0340 3.5740 3.5740 4.9695 4.9695 7.2863 7.2863 7.7272 7.7272 8.8481 8.8481 9.3135 9.3135 9.7966 9.7966 9.8743 9.8743 9.9354 9.9354 10.0142 10.0142 10.1769 10.1769 10.8106 10.8106 11.0485 11.0485 11.2751 11.2751 11.9910 11.9910 12.2838 12.2838 12.7243 12.7243 15.0704 15.0704 16.5263 16.5263 k = 0.5000 0.2792 0.8116 ( 6202 PWs) bands (ev): -79.7941 -79.7941 -79.7935 -79.7935 -45.4848 -45.4848 -45.4809 -45.4809 -43.8077 -43.8077 -43.8010 -43.8010 -43.6806 -43.6806 -43.6796 -43.6796 -28.0966 -28.0966 -9.4717 -9.4717 -9.1377 -9.1377 -9.0342 -9.0342 3.5735 3.5735 4.8971 4.8971 7.3174 7.3174 7.7828 7.7828 8.7981 8.7981 9.3069 9.3069 9.8108 9.8108 9.8661 9.8661 9.9262 9.9262 10.0262 10.0262 10.1679 10.1679 10.7907 10.7907 11.0462 11.0462 11.3365 11.3365 12.0582 12.0582 12.2842 12.2842 12.7783 12.7783 15.0692 15.0692 16.4997 16.4997 k = 0.5000 0.2792 0.7936 ( 6210 PWs) bands (ev): -79.7942 -79.7942 -79.7937 -79.7937 -45.4851 -45.4851 -45.4805 -45.4805 -43.8081 -43.8081 -43.8004 -43.8004 -43.6808 -43.6808 -43.6797 -43.6797 -28.0968 -28.0968 -9.4707 -9.4707 -9.1363 -9.1363 -9.0344 -9.0344 3.5725 3.5725 4.8232 4.8232 7.3512 7.3512 7.8387 7.8387 8.7476 8.7476 9.3011 9.3011 9.8191 9.8191 9.8624 9.8624 9.9164 9.9164 10.0386 10.0386 10.1588 10.1588 10.7735 10.7735 11.0442 11.0442 11.4021 11.4021 12.1270 12.1270 12.2840 12.2840 12.8386 12.8386 15.0684 15.0684 16.4715 16.4715 k = 0.5000 0.2792 0.7755 ( 6218 PWs) bands (ev): -79.7946 -79.7946 -79.7936 -79.7936 -45.4854 -45.4854 -45.4802 -45.4802 -43.8086 -43.8086 -43.7998 -43.7998 -43.6810 -43.6810 -43.6797 -43.6797 -28.0970 -28.0970 -9.4697 -9.4697 -9.1348 -9.1348 -9.0346 -9.0346 3.5709 3.5709 4.7481 4.7481 7.3876 7.3876 7.8939 7.8939 8.6968 8.6968 9.2956 9.2956 9.8151 9.8151 9.8676 9.8676 9.9075 9.9075 10.0530 10.0530 10.1491 10.1491 10.7597 10.7597 11.0417 11.0417 11.4706 11.4706 12.1977 12.1977 12.2849 12.2849 12.9043 12.9043 15.0681 15.0681 16.4429 16.4429 k = 0.5000 0.2792 0.7575 ( 6222 PWs) bands (ev): -79.7947 -79.7947 -79.7937 -79.7937 -45.4858 -45.4858 -45.4799 -45.4799 -43.8091 -43.8091 -43.7991 -43.7991 -43.6813 -43.6813 -43.6797 -43.6797 -28.0972 -28.0972 -9.4686 -9.4686 -9.1332 -9.1332 -9.0348 -9.0348 3.5685 3.5685 4.6723 4.6723 7.4263 7.4263 7.9481 7.9481 8.6461 8.6461 9.2905 9.2905 9.8029 9.8029 9.8729 9.8729 9.9064 9.9064 10.0687 10.0687 10.1392 10.1392 10.7494 10.7494 11.0399 11.0399 11.5416 11.5416 12.2676 12.2676 12.2879 12.2879 12.9747 12.9747 15.0681 15.0681 16.4133 16.4133 k = 0.5000 0.2792 0.7395 ( 6222 PWs) bands (ev): -79.7948 -79.7948 -79.7936 -79.7936 -45.4862 -45.4862 -45.4795 -45.4795 -43.8097 -43.8097 -43.7983 -43.7983 -43.6815 -43.6815 -43.6798 -43.6798 -28.0975 -28.0975 -9.4675 -9.4675 -9.1316 -9.1316 -9.0350 -9.0350 3.5653 3.5653 4.5961 4.5961 7.4677 7.4677 8.0016 8.0016 8.5958 8.5958 9.2863 9.2863 9.7863 9.7863 9.8659 9.8659 9.9205 9.9205 10.0855 10.0855 10.1293 10.1293 10.7418 10.7418 11.0373 11.0373 11.6153 11.6153 12.2840 12.2840 12.3465 12.3465 13.0515 13.0515 15.0688 15.0688 16.3828 16.3828 k = 0.5000 0.2792 0.7214 ( 6218 PWs) bands (ev): -79.7948 -79.7948 -79.7935 -79.7935 -45.4865 -45.4865 -45.4790 -45.4790 -43.8102 -43.8102 -43.7975 -43.7975 -43.6817 -43.6817 -43.6797 -43.6797 -28.0977 -28.0977 -9.4663 -9.4663 -9.1298 -9.1298 -9.0352 -9.0352 3.5613 3.5613 4.5199 4.5199 7.5114 7.5114 8.0537 8.0537 8.5462 8.5462 9.2831 9.2831 9.7672 9.7672 9.8530 9.8530 9.9423 9.9423 10.1033 10.1033 10.1194 10.1194 10.7373 10.7373 11.0352 11.0352 11.6914 11.6914 12.2853 12.2853 12.4219 12.4219 13.1336 13.1336 15.0702 15.0702 16.3492 16.3492 k = 0.5000 0.2792 0.7034 ( 6210 PWs) bands (ev): -79.7947 -79.7947 -79.7932 -79.7932 -45.4869 -45.4869 -45.4785 -45.4785 -43.8107 -43.8107 -43.7967 -43.7967 -43.6819 -43.6819 -43.6797 -43.6797 -28.0980 -28.0980 -9.4651 -9.4651 -9.1279 -9.1279 -9.0354 -9.0354 3.5562 3.5562 4.4439 4.4439 7.5577 7.5577 8.1045 8.1045 8.4974 8.4974 9.2810 9.2810 9.7464 9.7464 9.8382 9.8382 9.9665 9.9665 10.1090 10.1090 10.1227 10.1227 10.7356 10.7356 11.0330 11.0330 11.7700 11.7700 12.2864 12.2864 12.4993 12.4993 13.2212 13.2212 15.0725 15.0725 16.2604 16.2604 k = 0.5000 0.2792 0.6854 ( 6206 PWs) bands (ev): -79.7952 -79.7952 -79.7926 -79.7926 -45.4871 -45.4871 -45.4782 -45.4782 -43.8112 -43.8112 -43.7959 -43.7959 -43.6820 -43.6820 -43.6797 -43.6797 -28.0982 -28.0982 -9.4638 -9.4638 -9.1260 -9.1260 -9.0356 -9.0356 3.5501 3.5501 4.3683 4.3683 7.6062 7.6062 8.1534 8.1534 8.4497 8.4497 9.2804 9.2804 9.7240 9.7240 9.8219 9.8219 9.9903 9.9903 10.1004 10.1004 10.1429 10.1429 10.7353 10.7353 11.0310 11.0310 11.8506 11.8506 12.2878 12.2878 12.5789 12.5789 13.3139 13.3139 15.0757 15.0757 16.1680 16.1680 k = 0.5000 0.2792 0.6673 ( 6218 PWs) bands (ev): -79.7953 -79.7953 -79.7929 -79.7929 -45.4877 -45.4877 -45.4777 -45.4777 -43.8120 -43.8120 -43.7951 -43.7951 -43.6824 -43.6824 -43.6797 -43.6797 -28.0985 -28.0985 -9.4624 -9.4624 -9.1240 -9.1240 -9.0358 -9.0358 3.5428 3.5428 4.2933 4.2933 7.6569 7.6569 8.2003 8.2003 8.4031 8.4031 9.2803 9.2803 9.7000 9.7000 9.8041 9.8041 10.0117 10.0117 10.0956 10.0956 10.1632 10.1632 10.7385 10.7385 11.0290 11.0290 11.9319 11.9319 12.2886 12.2886 12.6588 12.6588 13.4111 13.4111 15.0793 15.0793 16.0751 16.0751 k = 0.5000 0.2792 0.6493 ( 6216 PWs) bands (ev): -79.7955 -79.7955 -79.7927 -79.7927 -45.4880 -45.4880 -45.4773 -45.4773 -43.8126 -43.8126 -43.7942 -43.7942 -43.6826 -43.6826 -43.6797 -43.6797 -28.0988 -28.0988 -9.4611 -9.4611 -9.1219 -9.1219 -9.0360 -9.0360 3.5343 3.5343 4.2190 4.2190 7.7099 7.7099 8.2454 8.2454 8.3582 8.3582 9.2825 9.2825 9.6755 9.6755 9.7859 9.7859 10.0249 10.0249 10.1001 10.1001 10.1847 10.1847 10.7441 10.7441 11.0271 11.0271 12.0157 12.0157 12.2902 12.2902 12.7408 12.7408 13.5133 13.5133 15.0842 15.0842 15.9820 15.9820 k = 0.5000 0.2792 0.6312 ( 6208 PWs) bands (ev): -79.7955 -79.7955 -79.7924 -79.7924 -45.4884 -45.4884 -45.4767 -45.4767 -43.8132 -43.8132 -43.7932 -43.7932 -43.6828 -43.6828 -43.6797 -43.6797 -28.0990 -28.0990 -9.4596 -9.4596 -9.1197 -9.1197 -9.0362 -9.0362 3.5246 3.5246 4.1458 4.1458 7.7650 7.7650 8.2879 8.2879 8.3156 8.3156 9.2862 9.2862 9.6505 9.6505 9.7673 9.7673 10.0258 10.0258 10.1186 10.1186 10.2069 10.2069 10.7525 10.7525 11.0259 11.0259 12.1001 12.1001 12.2928 12.2928 12.8247 12.8247 13.6204 13.6204 15.0902 15.0902 15.8894 15.8894 k = 0.5000 0.2792 0.6132 ( 6208 PWs) bands (ev): -79.7956 -79.7956 -79.7923 -79.7923 -45.4889 -45.4889 -45.4763 -45.4763 -43.8139 -43.8139 -43.7923 -43.7923 -43.6830 -43.6830 -43.6797 -43.6797 -28.0993 -28.0993 -9.4582 -9.4582 -9.1175 -9.1175 -9.0365 -9.0365 3.5136 3.5136 4.0735 4.0735 7.8221 7.8221 8.2717 8.2717 8.3315 8.3315 9.2916 9.2916 9.6245 9.6245 9.7482 9.7482 10.0184 10.0184 10.1463 10.1463 10.2298 10.2298 10.7621 10.7621 11.0244 11.0244 12.1829 12.1829 12.2979 12.2979 12.9095 12.9095 13.7319 13.7319 15.0974 15.0974 15.7973 15.7973 k = 0.5000 0.2792 0.5952 ( 6212 PWs) bands (ev): -79.7959 -79.7959 -79.7921 -79.7921 -45.4893 -45.4893 -45.4758 -45.4758 -43.8146 -43.8146 -43.7914 -43.7914 -43.6832 -43.6832 -43.6797 -43.6797 -28.0996 -28.0996 -9.4567 -9.4567 -9.1152 -9.1152 -9.0367 -9.0367 3.5013 3.5013 4.0025 4.0025 7.8812 7.8812 8.2317 8.2317 8.3710 8.3710 9.2987 9.2987 9.5981 9.5981 9.7286 9.7286 10.0069 10.0069 10.1787 10.1787 10.2533 10.2533 10.7735 10.7735 11.0228 11.0228 12.2512 12.2512 12.3186 12.3186 12.9956 12.9956 13.8471 13.8471 15.1061 15.1061 15.7062 15.7062 k = 0.5000 0.2792 0.5771 ( 6204 PWs) bands (ev): -79.7961 -79.7961 -79.7917 -79.7917 -45.4897 -45.4897 -45.4753 -45.4753 -43.8153 -43.8153 -43.7904 -43.7904 -43.6834 -43.6834 -43.6797 -43.6797 -28.0999 -28.0999 -9.4552 -9.4552 -9.1128 -9.1128 -9.0369 -9.0369 3.4877 3.4877 3.9328 3.9328 7.9422 7.9422 8.1932 8.1932 8.4091 8.4091 9.3078 9.3078 9.5716 9.5716 9.7091 9.7091 9.9940 9.9940 10.2144 10.2144 10.2784 10.2784 10.7864 10.7864 11.0219 11.0219 12.2762 12.2762 12.3845 12.3845 13.0836 13.0836 13.9664 13.9664 15.1167 15.1167 15.6167 15.6167 k = 0.5000 0.2792 0.5591 ( 6204 PWs) bands (ev): -79.7962 -79.7962 -79.7915 -79.7915 -45.4902 -45.4902 -45.4748 -45.4748 -43.8160 -43.8160 -43.7894 -43.7894 -43.6836 -43.6836 -43.6797 -43.6797 -28.1002 -28.1002 -9.4536 -9.4536 -9.1104 -9.1104 -9.0371 -9.0371 3.4729 3.4729 3.8645 3.8645 8.0051 8.0051 8.1563 8.1563 8.4455 8.4455 9.3188 9.3188 9.5447 9.5447 9.6891 9.6891 9.9800 9.9800 10.2525 10.2525 10.3028 10.3028 10.8002 10.8002 11.0219 11.0219 12.2816 12.2816 12.4700 12.4700 13.1725 13.1725 14.0886 14.0886 15.1293 15.1293 15.5292 15.5292 k = 0.5000 0.2792 0.5411 ( 6204 PWs) bands (ev): -79.7964 -79.7964 -79.7914 -79.7914 -45.4906 -45.4906 -45.4742 -45.4742 -43.8168 -43.8168 -43.7885 -43.7885 -43.6838 -43.6838 -43.6797 -43.6797 -28.1005 -28.1005 -9.4520 -9.4520 -9.1080 -9.1080 -9.0372 -9.0372 3.4568 3.4568 3.7978 3.7978 8.0696 8.0696 8.1213 8.1213 8.4803 8.4803 9.3319 9.3319 9.5175 9.5175 9.6689 9.6689 9.9656 9.9656 10.2921 10.2921 10.3275 10.3275 10.8155 10.8155 11.0225 11.0225 12.2836 12.2836 12.5598 12.5598 13.2625 13.2625 14.2129 14.2129 15.1445 15.1445 15.4440 15.4440 k = 0.5000 0.2792 0.5230 ( 6194 PWs) bands (ev): -79.7966 -79.7966 -79.7908 -79.7908 -45.4910 -45.4910 -45.4738 -45.4738 -43.8174 -43.8174 -43.7875 -43.7875 -43.6840 -43.6840 -43.6797 -43.6797 -28.1009 -28.1009 -9.4505 -9.4505 -9.1055 -9.1055 -9.0374 -9.0374 3.4395 3.4395 3.7326 3.7326 8.0875 8.0875 8.1364 8.1364 8.5137 8.5137 9.3470 9.3470 9.4913 9.4913 9.6487 9.6487 9.9507 9.9507 10.3329 10.3329 10.3540 10.3540 10.8321 10.8321 11.0232 11.0232 12.2846 12.2846 12.6510 12.6510 13.3548 13.3548 14.3388 14.3388 15.1632 15.1632 15.3617 15.3617 k = 0.5000 0.2792 0.5050 ( 6194 PWs) bands (ev): -79.7969 -79.7969 -79.7905 -79.7905 -45.4914 -45.4914 -45.4733 -45.4733 -43.8181 -43.8181 -43.7866 -43.7866 -43.6842 -43.6842 -43.6797 -43.6797 -28.1012 -28.1012 -9.4489 -9.4489 -9.1030 -9.1030 -9.0376 -9.0376 3.4212 3.4212 3.6691 3.6691 8.0559 8.0559 8.2040 8.2040 8.5454 8.5454 9.3634 9.3634 9.4654 9.4654 9.6278 9.6278 9.9355 9.9355 10.3697 10.3697 10.3848 10.3848 10.8494 10.8494 11.0257 11.0257 12.2847 12.2847 12.7419 12.7419 13.4481 13.4481 14.4643 14.4643 15.1861 15.1861 15.2829 15.2829 k = 0.5000 0.2792 0.4870 ( 6202 PWs) bands (ev): -79.7969 -79.7969 -79.7908 -79.7908 -45.4920 -45.4920 -45.4727 -45.4727 -43.8190 -43.8190 -43.7856 -43.7856 -43.6845 -43.6845 -43.6796 -43.6796 -28.1015 -28.1015 -9.4473 -9.4473 -9.1005 -9.1005 -9.0377 -9.0377 3.4017 3.4017 3.6073 3.6073 8.0256 8.0256 8.2730 8.2730 8.5755 8.5755 9.3810 9.3810 9.4397 9.4397 9.6075 9.6075 9.9202 9.9202 10.3957 10.3957 10.4267 10.4267 10.8681 10.8681 11.0295 11.0295 12.2832 12.2832 12.8318 12.8318 13.5421 13.5421 14.5876 14.5876 15.2062 15.2062 15.2179 15.2179 k = 0.5000 0.2792 0.4689 ( 6204 PWs) bands (ev): -79.7969 -79.7969 -79.7908 -79.7908 -45.4925 -45.4925 -45.4722 -45.4722 -43.8198 -43.8198 -43.7846 -43.7846 -43.6847 -43.6847 -43.6796 -43.6796 -28.1018 -28.1018 -9.4457 -9.4457 -9.0980 -9.0980 -9.0379 -9.0379 3.3814 3.3814 3.5474 3.5474 7.9968 7.9968 8.3435 8.3435 8.6045 8.6045 9.3958 9.3958 9.4190 9.4190 9.5878 9.5878 9.9049 9.9049 10.4191 10.4191 10.4726 10.4726 10.8872 10.8872 11.0347 11.0347 12.2821 12.2821 12.9200 12.9200 13.6376 13.6376 14.7057 14.7057 15.1382 15.1382 15.2555 15.2555 k = 0.5000 0.2792 0.4509 ( 6198 PWs) bands (ev): -79.7970 -79.7970 -79.7906 -79.7906 -45.4929 -45.4929 -45.4717 -45.4717 -43.8205 -43.8205 -43.7836 -43.7836 -43.6849 -43.6849 -43.6795 -43.6795 -28.1021 -28.1021 -9.4442 -9.4442 -9.0955 -9.0955 -9.0380 -9.0380 3.3603 3.3603 3.4893 3.4893 7.9698 7.9698 8.4152 8.4152 8.6324 8.6324 9.3835 9.3835 9.4278 9.4278 9.5682 9.5682 9.8894 9.8894 10.4421 10.4421 10.5217 10.5217 10.9058 10.9058 11.0417 11.0417 12.2811 12.2811 13.0061 13.0061 13.7343 13.7343 14.8139 14.8139 15.0750 15.0750 15.3081 15.3081 k = 0.5000 0.2792 0.4329 ( 6192 PWs) bands (ev): -79.7971 -79.7971 -79.7903 -79.7903 -45.4934 -45.4934 -45.4711 -45.4711 -43.8212 -43.8212 -43.7827 -43.7827 -43.6850 -43.6850 -43.6795 -43.6795 -28.1024 -28.1024 -9.4426 -9.4426 -9.0929 -9.0929 -9.0381 -9.0381 3.3384 3.3384 3.4332 3.4332 7.9443 7.9443 8.4879 8.4879 8.6592 8.6592 9.3605 9.3605 9.4491 9.4491 9.5499 9.5499 9.8739 9.8739 10.4627 10.4627 10.5720 10.5720 10.9251 10.9251 11.0503 11.0503 12.2793 12.2793 13.0886 13.0886 13.8325 13.8325 14.9071 14.9071 15.0190 15.0190 15.3794 15.3794 k = 0.5000 0.2792 0.4148 ( 6190 PWs) bands (ev): -79.7974 -79.7974 -79.7899 -79.7899 -45.4938 -45.4938 -45.4707 -45.4707 -43.8219 -43.8219 -43.7818 -43.7818 -43.6852 -43.6852 -43.6795 -43.6795 -28.1027 -28.1027 -9.4410 -9.4410 -9.0904 -9.0904 -9.0382 -9.0382 3.3160 3.3160 3.3789 3.3789 7.9203 7.9203 8.5615 8.5615 8.6850 8.6850 9.3373 9.3373 9.4705 9.4705 9.5337 9.5337 9.8579 9.8579 10.4820 10.4820 10.6234 10.6234 10.9447 10.9447 11.0610 11.0610 12.2776 12.2776 13.1655 13.1655 13.9320 13.9320 14.9690 14.9690 14.9852 14.9852 15.4196 15.4196 k = 0.5000 0.2792 0.3968 ( 6194 PWs) bands (ev): -79.7975 -79.7975 -79.7899 -79.7899 -45.4943 -45.4943 -45.4702 -45.4702 -43.8227 -43.8227 -43.7809 -43.7809 -43.6854 -43.6854 -43.6794 -43.6794 -28.1030 -28.1030 -9.4395 -9.4395 -9.0879 -9.0879 -9.0383 -9.0383 3.2932 3.2932 3.3268 3.3268 7.8973 7.8973 8.6357 8.6357 8.7102 8.7102 9.3134 9.3134 9.4841 9.4841 9.5273 9.5273 9.8424 9.8424 10.4987 10.4987 10.6767 10.6767 10.9645 10.9645 11.0739 11.0739 12.2745 12.2745 13.2351 13.2351 14.0317 14.0317 14.9343 14.9343 15.0425 15.0425 15.3297 15.3297 k = 0.5000 0.2792 0.3787 ( 6200 PWs) bands (ev): -79.7979 -79.7979 -79.7898 -79.7898 -45.4947 -45.4947 -45.4698 -45.4698 -43.8235 -43.8235 -43.7800 -43.7800 -43.6855 -43.6855 -43.6794 -43.6794 -28.1033 -28.1033 -9.4380 -9.4380 -9.0855 -9.0855 -9.0384 -9.0384 3.2700 3.2700 3.2767 3.2767 7.8759 7.8759 8.7087 8.7087 8.7360 8.7360 9.2908 9.2908 9.4780 9.4780 9.5416 9.5416 9.8269 9.8269 10.5132 10.5132 10.7309 10.7309 10.9843 10.9843 11.0889 11.0889 12.2712 12.2712 13.2957 13.2957 14.1327 14.1327 14.9103 14.9103 15.0890 15.0890 15.2371 15.2371 k = 0.5000 0.2792 0.3607 ( 6192 PWs) bands (ev): -79.7979 -79.7979 -79.7895 -79.7895 -45.4951 -45.4951 -45.4693 -45.4693 -43.8241 -43.8241 -43.7792 -43.7792 -43.6856 -43.6856 -43.6793 -43.6793 -28.1036 -28.1036 -9.4366 -9.4366 -9.0830 -9.0830 -9.0384 -9.0384 3.2285 3.2285 3.2468 3.2468 7.8558 7.8558 8.7533 8.7533 8.7900 8.7900 9.2694 9.2694 9.4631 9.4631 9.5666 9.5666 9.8117 9.8117 10.5256 10.5256 10.7873 10.7873 11.0054 11.0054 11.1071 11.1071 12.2677 12.2677 13.3455 13.3455 14.2351 14.2351 14.9008 14.9008 15.1237 15.1237 15.1465 15.1465 k = 0.5000 0.2792 0.3427 ( 6192 PWs) bands (ev): -79.7980 -79.7980 -79.7894 -79.7894 -45.4955 -45.4955 -45.4688 -45.4688 -43.8248 -43.8248 -43.7784 -43.7784 -43.6858 -43.6858 -43.6792 -43.6792 -28.1038 -28.1038 -9.4352 -9.4352 -9.0807 -9.0807 -9.0385 -9.0385 3.1827 3.1827 3.2236 3.2236 7.8368 7.8368 8.7767 8.7767 8.8646 8.8646 9.2483 9.2483 9.4459 9.4459 9.5947 9.5947 9.7966 9.7966 10.5350 10.5350 10.8458 10.8458 11.0262 11.0262 11.1267 11.1267 12.2629 12.2629 13.3826 13.3826 14.3377 14.3377 14.9075 14.9075 15.0439 15.0439 15.1644 15.1644 k = 0.5000 0.2792 0.3246 ( 6198 PWs) bands (ev): -79.7985 -79.7985 -79.7892 -79.7892 -45.4959 -45.4959 -45.4685 -45.4685 -43.8255 -43.8255 -43.7777 -43.7777 -43.6859 -43.6859 -43.6792 -43.6792 -28.1041 -28.1041 -9.4338 -9.4338 -9.0783 -9.0783 -9.0385 -9.0385 3.1389 3.1389 3.2005 3.2005 7.8192 7.8192 8.7984 8.7984 8.9404 8.9404 9.2282 9.2282 9.4288 9.4288 9.6233 9.6233 9.7819 9.7819 10.5415 10.5415 10.9037 10.9037 11.0465 11.0465 11.1481 11.1481 12.2579 12.2579 13.4060 13.4060 14.4410 14.4410 14.9288 14.9288 14.9487 14.9487 15.1964 15.1964 k = 0.5000 0.2792 0.3066 ( 6198 PWs) bands (ev): -79.7987 -79.7987 -79.7891 -79.7891 -45.4963 -45.4963 -45.4681 -45.4681 -43.8262 -43.8262 -43.7769 -43.7769 -43.6860 -43.6860 -43.6791 -43.6791 -28.1044 -28.1044 -9.4325 -9.4325 -9.0761 -9.0761 -9.0385 -9.0385 3.0974 3.0974 3.1777 3.1777 7.8023 7.8023 8.8193 8.8193 9.0162 9.0162 9.2087 9.2087 9.4121 9.4121 9.6521 9.6521 9.7681 9.7681 10.5457 10.5457 10.9626 10.9626 11.0690 11.0690 11.1727 11.1727 12.2515 12.2515 13.4155 13.4155 14.5446 14.5446 14.8482 14.8482 14.9723 14.9723 15.2277 15.2277 k = 0.5000 0.2792 0.2886 ( 6194 PWs) bands (ev): -79.7988 -79.7988 -79.7888 -79.7888 -45.4966 -45.4966 -45.4677 -45.4677 -43.8268 -43.8268 -43.7762 -43.7762 -43.6861 -43.6861 -43.6790 -43.6790 -28.1046 -28.1046 -9.4312 -9.4312 -9.0739 -9.0739 -9.0386 -9.0386 3.0581 3.0581 3.1554 3.1554 7.7870 7.7870 8.8393 8.8393 9.0915 9.0915 9.1908 9.1908 9.3959 9.3959 9.6798 9.6798 9.7559 9.7559 10.5470 10.5470 11.0209 11.0209 11.0931 11.0931 11.1997 11.1997 12.2439 12.2439 13.4124 13.4124 14.6480 14.6480 14.7517 14.7517 15.0288 15.0288 15.2584 15.2584 k = 0.5000 0.2792 0.2705 ( 6208 PWs) bands (ev): -79.7992 -79.7992 -79.7889 -79.7889 -45.4971 -45.4971 -45.4674 -45.4674 -43.8274 -43.8274 -43.7755 -43.7755 -43.6863 -43.6863 -43.6790 -43.6790 -28.1049 -28.1049 -9.4300 -9.4300 -9.0718 -9.0718 -9.0386 -9.0386 3.0210 3.0210 3.1336 3.1336 7.7724 7.7724 8.8585 8.8585 9.1619 9.1619 9.1774 9.1774 9.3802 9.3802 9.7018 9.7018 9.7488 9.7488 10.5449 10.5449 11.0733 11.0733 11.1220 11.1220 11.2286 11.2286 12.2343 12.2343 13.3973 13.3973 14.6526 14.6526 14.7545 14.7545 15.0993 15.0993 15.2894 15.2894 k = 0.5000 0.2792 0.2525 ( 6224 PWs) bands (ev): -79.7999 -79.7999 -79.7888 -79.7888 -45.4974 -45.4974 -45.4672 -45.4672 -43.8280 -43.8280 -43.7751 -43.7751 -43.6864 -43.6864 -43.6790 -43.6790 -28.1051 -28.1051 -9.4288 -9.4288 -9.0698 -9.0698 -9.0386 -9.0386 2.9862 2.9862 3.1126 3.1126 7.7590 7.7590 8.8769 8.8769 9.1555 9.1555 9.2412 9.2412 9.3645 9.3645 9.7077 9.7077 9.7577 9.7577 10.5404 10.5404 11.1099 11.1099 11.1654 11.1654 11.2600 11.2600 12.2240 12.2240 13.3731 13.3731 14.5587 14.5587 14.8577 14.8577 15.1819 15.1819 15.3207 15.3207 k = 0.5000 0.2792 0.2345 ( 6232 PWs) bands (ev): -79.8003 -79.8003 -79.7887 -79.7887 -45.4977 -45.4977 -45.4670 -45.4670 -43.8286 -43.8286 -43.7745 -43.7745 -43.6865 -43.6865 -43.6790 -43.6790 -28.1053 -28.1053 -9.4277 -9.4277 -9.0679 -9.0679 -9.0385 -9.0385 2.9537 2.9537 3.0924 3.0924 7.7466 7.7466 8.8947 8.8947 9.1406 9.1406 9.3099 9.3099 9.3535 9.3535 9.7001 9.7001 9.7802 9.7802 10.5333 10.5333 11.1342 11.1342 11.2216 11.2216 11.2942 11.2942 12.2121 12.2121 13.3414 13.3414 14.4667 14.4667 14.9612 14.9612 15.2739 15.2739 15.3531 15.3531 k = 0.5000 0.2792 0.2164 ( 6228 PWs) bands (ev): -79.8004 -79.8004 -79.7885 -79.7885 -45.4980 -45.4980 -45.4667 -45.4667 -43.8291 -43.8291 -43.7739 -43.7739 -43.6865 -43.6865 -43.6790 -43.6790 -28.1055 -28.1055 -9.4267 -9.4267 -9.0661 -9.0661 -9.0385 -9.0385 2.9235 2.9235 3.0732 3.0732 7.7352 7.7352 8.9121 8.9121 9.1269 9.1269 9.3289 9.3289 9.3924 9.3924 9.6894 9.6894 9.8060 9.8060 10.5241 10.5241 11.1543 11.1543 11.2811 11.2811 11.3320 11.3320 12.1987 12.1987 13.3042 13.3042 14.3779 14.3779 15.0642 15.0642 15.3719 15.3719 15.3881 15.3881 k = 0.5000 0.2792 0.1984 ( 6224 PWs) bands (ev): -79.8004 -79.8004 -79.7884 -79.7884 -45.4983 -45.4983 -45.4663 -45.4663 -43.8296 -43.8296 -43.7734 -43.7734 -43.6866 -43.6866 -43.6789 -43.6789 -28.1057 -28.1057 -9.4258 -9.4258 -9.0644 -9.0644 -9.0385 -9.0385 2.8958 2.8958 3.0551 3.0551 7.7247 7.7247 8.9286 8.9286 9.1139 9.1139 9.3177 9.3177 9.4604 9.4604 9.6785 9.6785 9.8318 9.8318 10.5124 10.5124 11.1725 11.1725 11.3393 11.3393 11.3746 11.3746 12.1832 12.1832 13.2630 13.2630 14.2928 14.2928 15.1655 15.1655 15.4206 15.4206 15.4783 15.4783 k = 0.5000 0.2792 0.1804 ( 6220 PWs) bands (ev): -79.8003 -79.8003 -79.7883 -79.7883 -45.4986 -45.4986 -45.4660 -45.4660 -43.8300 -43.8300 -43.7728 -43.7728 -43.6867 -43.6867 -43.6788 -43.6788 -28.1059 -28.1059 -9.4249 -9.4249 -9.0628 -9.0628 -9.0385 -9.0385 2.8704 2.8704 3.0382 3.0382 7.7150 7.7150 8.9444 8.9444 9.1025 9.1025 9.3060 9.3060 9.5275 9.5275 9.6685 9.6685 9.8566 9.8566 10.4982 10.4982 11.1890 11.1890 11.3917 11.3917 11.4247 11.4247 12.1657 12.1657 13.2190 13.2190 14.2117 14.2117 15.2651 15.2651 15.4569 15.4569 15.5845 15.5845 k = 0.5000 0.2792 0.1623 ( 6216 PWs) bands (ev): -79.8004 -79.8004 -79.7881 -79.7881 -45.4988 -45.4988 -45.4658 -45.4658 -43.8304 -43.8304 -43.7724 -43.7724 -43.6867 -43.6867 -43.6787 -43.6787 -28.1060 -28.1060 -9.4241 -9.4241 -9.0614 -9.0614 -9.0385 -9.0385 2.8473 2.8473 3.0226 3.0226 7.7065 7.7065 8.9595 8.9595 9.0919 9.0919 9.2940 9.2940 9.5903 9.5903 9.6617 9.6617 9.8798 9.8798 10.4822 10.4822 11.2040 11.2040 11.4384 11.4384 11.4804 11.4804 12.1464 12.1464 13.1736 13.1736 14.1362 14.1362 15.3615 15.3615 15.4946 15.4946 15.6908 15.6908 k = 0.5000 0.2792 0.1443 ( 6222 PWs) bands (ev): -79.8006 -79.8006 -79.7881 -79.7881 -45.4990 -45.4990 -45.4656 -45.4656 -43.8308 -43.8308 -43.7720 -43.7720 -43.6868 -43.6868 -43.6787 -43.6787 -28.1062 -28.1062 -9.4234 -9.4234 -9.0601 -9.0601 -9.0384 -9.0384 2.8266 2.8266 3.0084 3.0084 7.6987 7.6987 8.9732 8.9732 9.0826 9.0826 9.2824 9.2824 9.6295 9.6295 9.6765 9.6765 9.9009 9.9009 10.4641 10.4641 11.2170 11.2170 11.4830 11.4830 11.5370 11.5370 12.1240 12.1240 13.1277 13.1277 14.0666 14.0666 15.4541 15.4541 15.5335 15.5335 15.7939 15.7939 k = 0.5000 0.2792 0.1262 ( 6216 PWs) bands (ev): -79.8007 -79.8007 -79.7878 -79.7878 -45.4991 -45.4991 -45.4654 -45.4654 -43.8310 -43.8310 -43.7717 -43.7717 -43.6868 -43.6868 -43.6787 -43.6787 -28.1063 -28.1063 -9.4227 -9.4227 -9.0589 -9.0589 -9.0384 -9.0384 2.8083 2.8083 2.9957 2.9957 7.6921 7.6921 8.9858 8.9858 9.0749 9.0749 9.2719 9.2719 9.6297 9.6297 9.7282 9.7282 9.9204 9.9204 10.4448 10.4448 11.2287 11.2287 11.5284 11.5284 11.5927 11.5927 12.0996 12.0996 13.0828 13.0828 14.0036 14.0036 15.5417 15.5417 15.5744 15.5744 15.8907 15.8907 k = 0.5000 0.2792 0.1082 ( 6212 PWs) bands (ev): -79.8006 -79.8006 -79.7878 -79.7878 -45.4993 -45.4993 -45.4652 -45.4652 -43.8313 -43.8313 -43.7713 -43.7713 -43.6869 -43.6869 -43.6786 -43.6786 -28.1064 -28.1064 -9.4222 -9.4222 -9.0579 -9.0579 -9.0384 -9.0384 2.7925 2.7925 2.9845 2.9845 7.6863 7.6863 8.9970 8.9970 9.0685 9.0685 9.2629 9.2629 9.6236 9.6236 9.7839 9.7839 9.9379 9.9379 10.4237 10.4237 11.2389 11.2389 11.5735 11.5735 11.6457 11.6457 12.0721 12.0721 13.0397 13.0397 13.9476 13.9476 15.6127 15.6127 15.6271 15.6271 15.9772 15.9772 k = 0.5000 0.2792 0.0902 ( 6216 PWs) bands (ev): -79.8007 -79.8007 -79.7879 -79.7879 -45.4995 -45.4995 -45.4650 -45.4650 -43.8316 -43.8316 -43.7711 -43.7711 -43.6869 -43.6869 -43.6786 -43.6786 -28.1065 -28.1065 -9.4217 -9.4217 -9.0570 -9.0570 -9.0383 -9.0383 2.7791 2.7791 2.9749 2.9749 7.6811 7.6811 9.0063 9.0063 9.0638 9.0638 9.2542 9.2542 9.6171 9.6171 9.8364 9.8364 9.9530 9.9530 10.4014 10.4014 11.2475 11.2475 11.6186 11.6186 11.6942 11.6942 12.0417 12.0417 12.9996 12.9996 13.8991 13.8991 15.6581 15.6581 15.6991 15.6991 16.0499 16.0499 k = 0.5000 0.2792 0.0721 ( 6212 PWs) bands (ev): -79.8007 -79.8007 -79.7877 -79.7877 -45.4996 -45.4996 -45.4649 -45.4649 -43.8318 -43.8318 -43.7708 -43.7708 -43.6869 -43.6869 -43.6785 -43.6785 -28.1066 -28.1066 -9.4213 -9.4213 -9.0563 -9.0563 -9.0383 -9.0383 2.7681 2.7681 2.9671 2.9671 7.6774 7.6774 9.0134 9.0134 9.0609 9.0609 9.2463 9.2463 9.6114 9.6114 9.8842 9.8842 9.9656 9.9656 10.3794 10.3794 11.2552 11.2552 11.6640 11.6640 11.7369 11.7369 12.0094 12.0094 12.9640 12.9640 13.8590 13.8590 15.7034 15.7034 15.7632 15.7632 16.1064 16.1064 k = 0.5000 0.2792 0.0541 ( 6200 PWs) bands (ev): -79.8006 -79.8006 -79.7874 -79.7874 -45.4996 -45.4996 -45.4648 -45.4648 -43.8319 -43.8319 -43.7706 -43.7706 -43.6869 -43.6869 -43.6785 -43.6785 -28.1066 -28.1066 -9.4210 -9.4210 -9.0557 -9.0557 -9.0383 -9.0383 2.7595 2.7595 2.9609 2.9609 7.6745 7.6745 9.0188 9.0188 9.0604 9.0604 9.2402 9.2402 9.6070 9.6070 9.9252 9.9252 9.9759 9.9759 10.3584 10.3584 11.2617 11.2617 11.7087 11.7087 11.7729 11.7729 11.9745 11.9745 12.9342 12.9342 13.8275 13.8275 15.7506 15.7506 15.8165 15.8165 16.0706 16.0706 k = 0.5000 0.2792 0.0361 ( 6188 PWs) bands (ev): -79.8006 -79.8006 -79.7869 -79.7869 -45.4995 -45.4995 -45.4647 -45.4647 -43.8319 -43.8319 -43.7705 -43.7705 -43.6868 -43.6868 -43.6785 -43.6785 -28.1067 -28.1067 -9.4207 -9.4207 -9.0553 -9.0553 -9.0383 -9.0383 2.7534 2.7534 2.9564 2.9564 7.6726 7.6726 9.0219 9.0219 9.0613 9.0613 9.2356 9.2356 9.6036 9.6036 9.9569 9.9569 9.9842 9.9842 10.3405 10.3405 11.2657 11.2657 11.7518 11.7518 11.8008 11.8008 11.9388 11.9388 12.9115 12.9115 13.8048 13.8048 15.7989 15.7989 15.8570 15.8570 16.0137 16.0137 k = 0.5000 0.2792 0.0180 ( 6190 PWs) bands (ev): -79.8007 -79.8007 -79.7869 -79.7869 -45.4995 -45.4995 -45.4647 -45.4647 -43.8319 -43.8319 -43.7705 -43.7705 -43.6868 -43.6868 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0551 -9.0551 -9.0383 -9.0383 2.7497 2.7497 2.9538 2.9538 7.6713 7.6713 9.0232 9.0232 9.0619 9.0619 9.2324 9.2324 9.6015 9.6015 9.9753 9.9753 9.9916 9.9916 10.3278 10.3278 11.2681 11.2681 11.7876 11.7876 11.8219 11.8219 11.9029 11.9029 12.8972 12.8972 13.7910 13.7910 15.8478 15.8478 15.8817 15.8817 15.9591 15.9591 k = 0.5000 0.2792-0.0000 ( 6198 PWs) bands (ev): -79.8007 -79.8007 -79.7872 -79.7872 -45.4996 -45.4996 -45.4647 -45.4647 -43.8320 -43.8320 -43.7704 -43.7704 -43.6869 -43.6869 -43.6785 -43.6785 -28.1067 -28.1067 -9.4206 -9.4206 -9.0550 -9.0550 -9.0383 -9.0383 2.7485 2.7485 2.9528 2.9528 7.6702 7.6702 9.0233 9.0233 9.0620 9.0620 9.2314 9.2314 9.6008 9.6008 9.9801 9.9801 9.9957 9.9957 10.3229 10.3229 11.2689 11.2689 11.8024 11.8024 11.8363 11.8363 11.8806 11.8806 12.8923 12.8923 13.7862 13.7862 15.8820 15.8820 15.8946 15.8946 15.9182 15.9182 k = 0.0000 0.0000 1.0256 ( 6154 PWs) bands (ev): -79.7930 -79.7930 -79.7929 -79.7929 -45.4827 -45.4827 -45.4827 -45.4827 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5695 3.5695 5.4521 5.4521 7.1211 7.1211 7.3287 7.3287 9.2039 9.2039 9.3354 9.3354 9.6982 9.6982 9.9233 9.9233 9.9294 9.9294 10.0039 10.0039 10.2248 10.2248 10.8981 10.8981 11.0578 11.0578 11.0779 11.0779 11.4946 11.4946 12.2831 12.2831 12.4491 12.4491 15.0827 15.0827 16.6978 16.6978 k = 0.0156 0.0087 1.0256 ( 6152 PWs) bands (ev): -79.7930 -79.7930 -79.7928 -79.7928 -45.4827 -45.4827 -45.4826 -45.4826 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5695 3.5695 5.4520 5.4520 7.1216 7.1216 7.3281 7.3281 9.2050 9.2050 9.3367 9.3367 9.6972 9.6972 9.9099 9.9099 9.9422 9.9422 10.0044 10.0044 10.2244 10.2244 10.8991 10.8991 11.0578 11.0578 11.0781 11.0781 11.4923 11.4923 12.2840 12.2840 12.4489 12.4489 15.0791 15.0791 16.7016 16.7016 k = 0.0312 0.0174 1.0256 ( 6154 PWs) bands (ev): -79.7931 -79.7931 -79.7928 -79.7928 -45.4828 -45.4828 -45.4826 -45.4826 -43.8049 -43.8049 -43.8046 -43.8046 -43.6794 -43.6794 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5696 3.5696 5.4517 5.4517 7.1228 7.1228 7.3263 7.3263 9.2082 9.2082 9.3405 9.3405 9.6935 9.6935 9.8932 9.8932 9.9567 9.9567 10.0055 10.0055 10.2225 10.2225 10.9019 10.9019 11.0588 11.0588 11.0781 11.0781 11.4857 11.4857 12.2868 12.2868 12.4487 12.4487 15.0680 15.0680 16.7131 16.7131 k = 0.0469 0.0262 1.0256 ( 6150 PWs) bands (ev): -79.7931 -79.7931 -79.7926 -79.7926 -45.4828 -45.4828 -45.4826 -45.4826 -43.8049 -43.8049 -43.8046 -43.8046 -43.6793 -43.6793 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5698 3.5698 5.4511 5.4511 7.1249 7.1249 7.3233 7.3233 9.2134 9.2134 9.3468 9.3468 9.6883 9.6883 9.8758 9.8758 9.9705 9.9705 10.0079 10.0079 10.2207 10.2207 10.9067 10.9067 11.0589 11.0589 11.0783 11.0783 11.4747 11.4747 12.2916 12.2916 12.4478 12.4478 15.0506 15.0506 16.7321 16.7321 k = 0.0625 0.0349 1.0256 ( 6166 PWs) bands (ev): -79.7935 -79.7935 -79.7928 -79.7928 -45.4829 -45.4829 -45.4826 -45.4826 -43.8050 -43.8050 -43.8046 -43.8046 -43.6794 -43.6794 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5699 3.5699 5.4503 5.4503 7.1277 7.1277 7.3189 7.3189 9.2207 9.2207 9.3554 9.3554 9.6805 9.6805 9.8569 9.8569 9.9818 9.9818 10.0110 10.0110 10.2174 10.2174 10.9132 10.9132 11.0588 11.0588 11.0781 11.0781 11.4595 11.4595 12.2969 12.2969 12.4455 12.4455 15.0276 15.0276 16.7582 16.7582 k = 0.0781 0.0436 1.0256 ( 6166 PWs) bands (ev): -79.7935 -79.7935 -79.7928 -79.7928 -45.4829 -45.4829 -45.4827 -45.4827 -43.8050 -43.8050 -43.8046 -43.8046 -43.6794 -43.6794 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5702 3.5702 5.4493 5.4493 7.1314 7.1314 7.3138 7.3138 9.2298 9.2298 9.3663 9.3663 9.6719 9.6719 9.8380 9.8380 9.9915 9.9915 10.0167 10.0167 10.2150 10.2150 10.9215 10.9215 11.0584 11.0584 11.0771 11.0771 11.4411 11.4411 12.3039 12.3039 12.4440 12.4440 15.0007 15.0007 16.7915 16.7915 k = 0.0938 0.0523 1.0256 ( 6170 PWs) bands (ev): -79.7935 -79.7935 -79.7930 -79.7930 -45.4829 -45.4829 -45.4827 -45.4827 -43.8050 -43.8050 -43.8046 -43.8046 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5705 3.5705 5.4482 5.4482 7.1359 7.1359 7.3077 7.3077 9.2406 9.2406 9.3794 9.3794 9.6615 9.6615 9.8182 9.8182 9.9979 9.9979 10.0247 10.0247 10.2111 10.2111 10.9316 10.9316 11.0588 11.0588 11.0764 11.0764 11.4197 11.4197 12.3114 12.3114 12.4419 12.4419 14.9712 14.9712 16.8313 16.8313 k = 0.1094 0.0611 1.0256 ( 6170 PWs) bands (ev): -79.7935 -79.7935 -79.7930 -79.7930 -45.4829 -45.4829 -45.4827 -45.4827 -43.8050 -43.8050 -43.8046 -43.8046 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5708 3.5708 5.4470 5.4470 7.1411 7.1411 7.3007 7.3007 9.2530 9.2530 9.3944 9.3944 9.6497 9.6497 9.7978 9.7978 10.0023 10.0023 10.0349 10.0349 10.2066 10.2066 10.9435 10.9435 11.0593 11.0593 11.0764 11.0764 11.3958 11.3958 12.3201 12.3201 12.4394 12.4394 14.9406 14.9406 16.8772 16.8772 k = 0.1250 0.0698 1.0256 ( 6178 PWs) bands (ev): -79.7935 -79.7935 -79.7933 -79.7933 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5711 3.5711 5.4458 5.4458 7.1470 7.1470 7.2929 7.2929 9.2666 9.2666 9.4109 9.4109 9.6367 9.6367 9.7765 9.7765 10.0054 10.0054 10.0452 10.0452 10.2014 10.2014 10.9560 10.9560 11.0598 11.0598 11.0764 11.0764 11.3699 11.3699 12.3288 12.3288 12.4365 12.4365 14.9102 14.9102 16.9281 16.9281 k = 0.1406 0.0785 1.0256 ( 6176 PWs) bands (ev): -79.7934 -79.7934 -79.7933 -79.7933 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8047 -43.8047 -43.6795 -43.6795 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5714 3.5714 5.4445 5.4445 7.1536 7.1536 7.2846 7.2846 9.2812 9.2812 9.4294 9.4294 9.6232 9.6232 9.7549 9.7549 10.0080 10.0080 10.0562 10.0562 10.1963 10.1963 10.9709 10.9709 11.0600 11.0600 11.0768 11.0768 11.3426 11.3426 12.3381 12.3381 12.4331 12.4331 14.8810 14.8810 16.9846 16.9846 k = 0.1562 0.0872 1.0256 ( 6188 PWs) bands (ev): -79.7937 -79.7937 -79.7934 -79.7934 -45.4829 -45.4829 -45.4829 -45.4829 -43.8050 -43.8050 -43.8048 -43.8048 -43.6796 -43.6796 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5717 3.5717 5.4433 5.4433 7.1608 7.1608 7.2755 7.2755 9.2964 9.2964 9.4491 9.4491 9.6087 9.6087 9.7326 9.7326 10.0098 10.0098 10.0670 10.0670 10.1902 10.1902 10.9863 10.9863 11.0606 11.0606 11.0752 11.0752 11.3143 11.3143 12.3464 12.3464 12.4293 12.4293 14.8537 14.8537 17.0452 17.0452 k = 0.1719 0.0960 1.0256 ( 6188 PWs) bands (ev): -79.7937 -79.7937 -79.7934 -79.7934 -45.4829 -45.4829 -45.4829 -45.4829 -43.8050 -43.8050 -43.8048 -43.8048 -43.6796 -43.6796 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5719 3.5719 5.4422 5.4422 7.1686 7.1686 7.2661 7.2661 9.3118 9.3118 9.4700 9.4700 9.5941 9.5941 9.7098 9.7098 10.0116 10.0116 10.0774 10.0774 10.1839 10.1839 11.0028 11.0028 11.0613 11.0613 11.0772 11.0772 11.2854 11.2854 12.3555 12.3555 12.4252 12.4252 14.8295 14.8295 17.1095 17.1095 k = 0.1875 0.1047 1.0256 ( 6192 PWs) bands (ev): -79.7940 -79.7940 -79.7933 -79.7933 -45.4830 -45.4830 -45.4828 -45.4828 -43.8050 -43.8050 -43.8049 -43.8049 -43.6797 -43.6797 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5722 3.5722 5.4413 5.4413 7.1769 7.1769 7.2565 7.2565 9.3265 9.3265 9.4916 9.4916 9.5800 9.5800 9.6868 9.6868 10.0128 10.0128 10.0869 10.0869 10.1778 10.1778 11.0182 11.0182 11.0614 11.0614 11.0807 11.0807 11.2565 11.2565 12.3638 12.3638 12.4213 12.4213 14.8088 14.8088 17.1762 17.1762 k = 0.2031 0.1134 1.0256 ( 6190 PWs) bands (ev): -79.7938 -79.7938 -79.7934 -79.7934 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8049 -43.8049 -43.6796 -43.6796 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5724 3.5724 5.4405 5.4405 7.1857 7.1857 7.2464 7.2464 9.3401 9.3401 9.5135 9.5135 9.5677 9.5677 9.6635 9.6635 10.0139 10.0139 10.0962 10.0962 10.1712 10.1712 11.0314 11.0314 11.0619 11.0619 11.0888 11.0888 11.2278 11.2278 12.3728 12.3728 12.4161 12.4161 14.7923 14.7923 17.2453 17.2453 k = 0.2188 0.1221 1.0256 ( 6178 PWs) bands (ev): -79.7934 -79.7934 -79.7934 -79.7934 -45.4828 -45.4828 -45.4828 -45.4828 -43.8050 -43.8050 -43.8048 -43.8048 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5725 3.5725 5.4400 5.4400 7.1951 7.1951 7.2364 7.2364 9.3513 9.3513 9.5337 9.5337 9.5600 9.5600 9.6402 9.6402 10.0153 10.0153 10.1041 10.1041 10.1655 10.1655 11.0410 11.0410 11.0628 11.0628 11.1030 11.1030 11.2000 11.2000 12.3813 12.3813 12.4108 12.4108 14.7807 14.7807 17.3152 17.3152 k = 0.2344 0.1309 1.0256 ( 6176 PWs) bands (ev): -79.7935 -79.7935 -79.7932 -79.7932 -45.4828 -45.4828 -45.4828 -45.4828 -43.8049 -43.8049 -43.8048 -43.8048 -43.6795 -43.6795 -43.6792 -43.6792 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0330 -9.0330 3.5726 3.5726 5.4396 5.4396 7.2045 7.2045 7.2264 7.2264 9.3588 9.3588 9.5418 9.5418 9.5670 9.5670 9.6178 9.6178 10.0157 10.0157 10.1095 10.1095 10.1613 10.1613 11.0456 11.0456 11.0632 11.0632 11.1212 11.1212 11.1742 11.1742 12.3879 12.3879 12.4056 12.4056 14.7733 14.7733 17.3837 17.3837 k = 0.2500 0.1396 1.0256 ( 6184 PWs) bands (ev): -79.7935 -79.7935 -79.7935 -79.7935 -45.4829 -45.4829 -45.4828 -45.4828 -43.8050 -43.8050 -43.8048 -43.8048 -43.6795 -43.6795 -43.6793 -43.6793 -28.0955 -28.0955 -9.4772 -9.4772 -9.1457 -9.1457 -9.0331 -9.0331 3.5726 3.5726 5.4394 5.4394 7.2127 7.2127 7.2177 7.2177 9.3614 9.3614 9.5411 9.5411 9.5787 9.5787 9.6037 9.6037 10.0153 10.0153 10.1115 10.1115 10.1595 10.1595 11.0469 11.0469 11.0632 11.0632 11.1357 11.1357 11.1572 11.1572 12.3911 12.3911 12.4022 12.4022 14.7704 14.7704 17.3928 17.3928 Writing output data file CaxCoSix2.save init_run : 0.28s CPU 0.62s WALL ( 1 calls) electrons : 388.98s CPU 394.18s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 388.97s CPU 394.17s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.06s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.14s WALL ( 366 calls) cegterg : 356.00s CPU 359.28s WALL ( 478 calls) Called by sum_band: Called by *egterg: h_psi : 257.16s CPU 260.00s WALL ( 8416 calls) s_psi : 7.92s CPU 8.10s WALL ( 8416 calls) g_psi : 0.48s CPU 0.50s WALL ( 7572 calls) cdiaghg : 82.22s CPU 83.25s WALL ( 7938 calls) cegterg:over : 13.06s CPU 12.97s WALL ( 7572 calls) cegterg:upda : 12.42s CPU 12.30s WALL ( 7572 calls) cegterg:last : 5.90s CPU 5.91s WALL ( 1390 calls) cdiaghg:chol : 4.75s CPU 4.81s WALL ( 7938 calls) cdiaghg:inve : 3.28s CPU 3.42s WALL ( 7938 calls) cdiaghg:para : 5.48s CPU 5.85s WALL ( 15876 calls) Called by h_psi: h_psi:vloc : 234.98s CPU 237.69s WALL ( 8416 calls) h_psi:vnl : 21.71s CPU 21.84s WALL ( 8416 calls) add_vuspsi : 11.77s CPU 11.79s WALL ( 8416 calls) General routines calbec : 9.90s CPU 10.03s WALL ( 8416 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 223.12s CPU 225.78s WALL ( 1071792 calls) davcio : 0.36s CPU 0.51s WALL ( 732 calls) Parallel routines fft_scatter : 74.40s CPU 74.97s WALL ( 1071807 calls) PWSCF : 6m54.65s CPU 7m32.40s WALL This run was terminated on: 16:53:27 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=