Program PWSCF v.5.1.1 starts on 21Jul2015 at 4: 2:40 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TiSi2.save/ file Ti.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3D 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 53 19 5 1574 327 55 Max 54 20 6 1577 349 59 Sum 2569 931 283 75613 16377 2765 bravais-lattice index = 14 lattice parameter (alat) = 9.6934 a.u. unit-cell volume = 324.0943 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 2 number of electrons = 20.00 number of Kohn-Sham states= 28 kinetic-energy cutoff = 52.0000 Ry charge density cutoff = 576.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.693434 celldm(2)= 0.984528 celldm(3)= 0.635053 celldm(4)= 0.297961 celldm(5)= 0.341701 celldm(6)= 0.795307 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.783002 0.596828 0.000000 ) a(3) = ( 0.216998 0.027451 0.596196 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.311939 -0.303565 ) b(2) = ( 0.000000 1.675525 -0.077146 ) b(3) = ( 0.000000 0.000000 1.677300 ) PseudoPot. # 1 for Ti read from file: /home/autes/Pseudo/Ti.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ed6a930860ac2325f16e0d84c006faf2 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1177 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: fdd4f0c14d34ff7e95251eb8672b2767 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, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ti 12.00 47.86700 Ti( 1.00) Si 4.00 28.08550 Si( 1.00) 2 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 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 536 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 2) = ( 0.0075758 -0.0099389 0.0104071), wk = 0.0018657 k( 3) = ( 0.0151515 -0.0198779 0.0208142), wk = 0.0018657 k( 4) = ( 0.0227273 -0.0298168 0.0312212), wk = 0.0018657 k( 5) = ( 0.0303030 -0.0397557 0.0416283), wk = 0.0018657 k( 6) = ( 0.0378788 -0.0496947 0.0520354), wk = 0.0018657 k( 7) = ( 0.0454546 -0.0596336 0.0624425), wk = 0.0018657 k( 8) = ( 0.0530303 -0.0695725 0.0728496), wk = 0.0018657 k( 9) = ( 0.0606061 -0.0795114 0.0832566), wk = 0.0018657 k( 10) = ( 0.0681818 -0.0894504 0.0936637), wk = 0.0018657 k( 11) = ( 0.0757576 -0.0993893 0.1040708), wk = 0.0018657 k( 12) = ( 0.0833333 -0.1093282 0.1144779), wk = 0.0018657 k( 13) = ( 0.0909091 -0.1192672 0.1248850), wk = 0.0018657 k( 14) = ( 0.0984848 -0.1292061 0.1352920), wk = 0.0018657 k( 15) = ( 0.1060606 -0.1391450 0.1456991), wk = 0.0018657 k( 16) = ( 0.1136364 -0.1490840 0.1561062), wk = 0.0018657 k( 17) = ( 0.1212121 -0.1590229 0.1665133), wk = 0.0018657 k( 18) = ( 0.1287879 -0.1689618 0.1769204), wk = 0.0018657 k( 19) = ( 0.1363636 -0.1789008 0.1873275), wk = 0.0018657 k( 20) = ( 0.1439394 -0.1888397 0.1977345), wk = 0.0018657 k( 21) = ( 0.1515151 -0.1987786 0.2081416), wk = 0.0018657 k( 22) = ( 0.1590909 -0.2087175 0.2185487), wk = 0.0018657 k( 23) = ( 0.1666667 -0.2186565 0.2289558), wk = 0.0018657 k( 24) = ( 0.1742424 -0.2285954 0.2393628), wk = 0.0018657 k( 25) = ( 0.1818182 -0.2385343 0.2497699), wk = 0.0018657 k( 26) = ( 0.1893939 -0.2484733 0.2601770), wk = 0.0018657 k( 27) = ( 0.1969697 -0.2584122 0.2705841), wk = 0.0018657 k( 28) = ( 0.2045454 -0.2683511 0.2809912), wk = 0.0018657 k( 29) = ( 0.2121212 -0.2782901 0.2913982), wk = 0.0018657 k( 30) = ( 0.2196970 -0.2882290 0.3018053), wk = 0.0018657 k( 31) = ( 0.2272727 -0.2981679 0.3122124), wk = 0.0018657 k( 32) = ( 0.2348485 -0.3081069 0.3226195), wk = 0.0018657 k( 33) = ( 0.2424242 -0.3180458 0.3330266), wk = 0.0018657 k( 34) = ( 0.2500000 -0.3279847 0.3434337), wk = 0.0018657 k( 35) = ( 0.2575758 -0.3379237 0.3538407), wk = 0.0018657 k( 36) = ( 0.2651515 -0.3478626 0.3642478), wk = 0.0018657 k( 37) = ( 0.2727273 -0.3578015 0.3746549), wk = 0.0018657 k( 38) = ( 0.2803030 -0.3677404 0.3850620), wk = 0.0018657 k( 39) = ( 0.2878788 -0.3776794 0.3954691), wk = 0.0018657 k( 40) = ( 0.2954545 -0.3876183 0.4058761), wk = 0.0018657 k( 41) = ( 0.3030303 -0.3975572 0.4162832), wk = 0.0018657 k( 42) = ( 0.3106061 -0.4074962 0.4266903), wk = 0.0018657 k( 43) = ( 0.3181818 -0.4174351 0.4370974), wk = 0.0018657 k( 44) = ( 0.3257576 -0.4273740 0.4475045), wk = 0.0018657 k( 45) = ( 0.3333333 -0.4373130 0.4579115), wk = 0.0018657 k( 46) = ( 0.3409091 -0.4472519 0.4683186), wk = 0.0018657 k( 47) = ( 0.3484849 -0.4571908 0.4787257), wk = 0.0018657 k( 48) = ( 0.3560606 -0.4671298 0.4891328), wk = 0.0018657 k( 49) = ( 0.3636364 -0.4770687 0.4995399), wk = 0.0018657 k( 50) = ( 0.3712121 -0.4870076 0.5099469), wk = 0.0018657 k( 51) = ( 0.3787879 -0.4969465 0.5203540), wk = 0.0018657 k( 52) = ( 0.3863636 -0.5068855 0.5307611), wk = 0.0018657 k( 53) = ( 0.3939394 -0.5168244 0.5411682), wk = 0.0018657 k( 54) = ( 0.4015151 -0.5267633 0.5515753), wk = 0.0018657 k( 55) = ( 0.4090909 -0.5367023 0.5619823), wk = 0.0018657 k( 56) = ( 0.4166667 -0.5466412 0.5723894), wk = 0.0018657 k( 57) = ( 0.4242424 -0.5565801 0.5827965), wk = 0.0018657 k( 58) = ( 0.4318182 -0.5665191 0.5932036), wk = 0.0018657 k( 59) = ( 0.4393939 -0.5764580 0.6036107), wk = 0.0018657 k( 60) = ( 0.4469697 -0.5863969 0.6140177), wk = 0.0018657 k( 61) = ( 0.4545455 -0.5963358 0.6244248), wk = 0.0018657 k( 62) = ( 0.4621212 -0.6062748 0.6348319), wk = 0.0018657 k( 63) = ( 0.4696970 -0.6162137 0.6452390), wk = 0.0018657 k( 64) = ( 0.4772727 -0.6261526 0.6556461), wk = 0.0018657 k( 65) = ( 0.4848485 -0.6360916 0.6660531), wk = 0.0018657 k( 66) = ( 0.4924242 -0.6460305 0.6764602), wk = 0.0018657 k( 67) = ( 0.5000000 -0.6559694 0.6868673), wk = 0.0018657 k( 68) = ( 0.5000000 -0.6559694 0.6868673), wk = 0.0018657 k( 69) = ( 0.5000000 -0.6446172 0.6977089), wk = 0.0018657 k( 70) = ( 0.5000000 -0.6332649 0.7085506), wk = 0.0018657 k( 71) = ( 0.5000000 -0.6219126 0.7193922), wk = 0.0018657 k( 72) = ( 0.5000000 -0.6105603 0.7302338), wk = 0.0018657 k( 73) = ( 0.5000000 -0.5992080 0.7410754), wk = 0.0018657 k( 74) = ( 0.5000000 -0.5878557 0.7519171), wk = 0.0018657 k( 75) = ( 0.5000000 -0.5765034 0.7627587), wk = 0.0018657 k( 76) = ( 0.5000000 -0.5651511 0.7736003), wk = 0.0018657 k( 77) = ( 0.5000000 -0.5537988 0.7844419), wk = 0.0018657 k( 78) = ( 0.5000000 -0.5424465 0.7952836), wk = 0.0018657 k( 79) = ( 0.5000000 -0.5310942 0.8061252), wk = 0.0018657 k( 80) = ( 0.5000000 -0.5197419 0.8169668), wk = 0.0018657 k( 81) = ( 0.5000000 -0.5083896 0.8278084), wk = 0.0018657 k( 82) = ( 0.5000000 -0.4970373 0.8386501), wk = 0.0018657 k( 83) = ( 0.5000000 -0.4970373 0.8386501), wk = 0.0018657 k( 84) = ( 0.4944480 -0.4817672 0.8386501), wk = 0.0018657 k( 85) = ( 0.4888960 -0.4664971 0.8386501), wk = 0.0018657 k( 86) = ( 0.4833440 -0.4512269 0.8386501), wk = 0.0018657 k( 87) = ( 0.4777920 -0.4359568 0.8386501), wk = 0.0018657 k( 88) = ( 0.4722400 -0.4206866 0.8386501), wk = 0.0018657 k( 89) = ( 0.4666879 -0.4054165 0.8386500), wk = 0.0018657 k( 90) = ( 0.4611359 -0.3901464 0.8386500), wk = 0.0018657 k( 91) = ( 0.4555839 -0.3748762 0.8386500), wk = 0.0018657 k( 92) = ( 0.4500319 -0.3596061 0.8386500), wk = 0.0018657 k( 93) = ( 0.4444799 -0.3443360 0.8386500), wk = 0.0018657 k( 94) = ( 0.4389279 -0.3290658 0.8386501), wk = 0.0018657 k( 95) = ( 0.4333759 -0.3137957 0.8386501), wk = 0.0018657 k( 96) = ( 0.4278239 -0.2985255 0.8386501), wk = 0.0018657 k( 97) = ( 0.4222719 -0.2832554 0.8386501), wk = 0.0018657 k( 98) = ( 0.4167198 -0.2679852 0.8386501), wk = 0.0018657 k( 99) = ( 0.4111678 -0.2527151 0.8386501), wk = 0.0018657 k( 100) = ( 0.4056158 -0.2374450 0.8386501), wk = 0.0018657 k( 101) = ( 0.4000638 -0.2221748 0.8386501), wk = 0.0018657 k( 102) = ( 0.3945118 -0.2069047 0.8386501), wk = 0.0018657 k( 103) = ( 0.3889598 -0.1916346 0.8386501), wk = 0.0018657 k( 104) = ( 0.3834078 -0.1763644 0.8386501), wk = 0.0018657 k( 105) = ( 0.3778558 -0.1610943 0.8386501), wk = 0.0018657 k( 106) = ( 0.3723038 -0.1458242 0.8386501), wk = 0.0018657 k( 107) = ( 0.3667517 -0.1305540 0.8386501), wk = 0.0018657 k( 108) = ( 0.3611997 -0.1152839 0.8386501), wk = 0.0018657 k( 109) = ( 0.3556477 -0.1000137 0.8386501), wk = 0.0018657 k( 110) = ( 0.3500957 -0.0847436 0.8386500), wk = 0.0018657 k( 111) = ( 0.3445437 -0.0694735 0.8386500), wk = 0.0018657 k( 112) = ( 0.3389917 -0.0542033 0.8386500), wk = 0.0018657 k( 113) = ( 0.3334397 -0.0389332 0.8386500), wk = 0.0018657 k( 114) = ( 0.3278877 -0.0236631 0.8386500), wk = 0.0018657 k( 115) = ( 0.3223357 -0.0083929 0.8386501), wk = 0.0018657 k( 116) = ( 0.3167837 0.0068772 0.8386501), wk = 0.0018657 k( 117) = ( 0.3112316 0.0221474 0.8386501), wk = 0.0018657 k( 118) = ( 0.3056796 0.0374175 0.8386501), wk = 0.0018657 k( 119) = ( 0.3001276 0.0526877 0.8386501), wk = 0.0018657 k( 120) = ( 0.2945756 0.0679578 0.8386501), wk = 0.0018657 k( 121) = ( 0.2890236 0.0832279 0.8386501), wk = 0.0018657 k( 122) = ( 0.2834716 0.0984981 0.8386501), wk = 0.0018657 k( 123) = ( 0.2779196 0.1137682 0.8386501), wk = 0.0018657 k( 124) = ( 0.2723676 0.1290383 0.8386501), wk = 0.0018657 k( 125) = ( 0.2668156 0.1443085 0.8386501), wk = 0.0018657 k( 126) = ( 0.2612636 0.1595786 0.8386501), wk = 0.0018657 k( 127) = ( 0.2557115 0.1748488 0.8386501), wk = 0.0018657 k( 128) = ( 0.2501595 0.1901189 0.8386501), wk = 0.0018657 k( 129) = ( 0.2446075 0.2053890 0.8386501), wk = 0.0018657 k( 130) = ( 0.2390555 0.2206592 0.8386501), wk = 0.0018657 k( 131) = ( 0.2335035 0.2359293 0.8386501), wk = 0.0018657 k( 132) = ( 0.2279515 0.2511994 0.8386500), wk = 0.0018657 k( 133) = ( 0.2223995 0.2664696 0.8386500), wk = 0.0018657 k( 134) = ( 0.2168475 0.2817397 0.8386500), wk = 0.0018657 k( 135) = ( 0.2112955 0.2970098 0.8386500), wk = 0.0018657 k( 136) = ( 0.2057434 0.3122800 0.8386501), wk = 0.0018657 k( 137) = ( 0.2001914 0.3275502 0.8386501), wk = 0.0018657 k( 138) = ( 0.1946394 0.3428203 0.8386501), wk = 0.0018657 k( 139) = ( 0.1890874 0.3580904 0.8386501), wk = 0.0018657 k( 140) = ( 0.1835354 0.3733606 0.8386501), wk = 0.0018657 k( 141) = ( 0.1779834 0.3886307 0.8386501), wk = 0.0018657 k( 142) = ( 0.1724314 0.4039008 0.8386501), wk = 0.0018657 k( 143) = ( 0.1668794 0.4191710 0.8386501), wk = 0.0018657 k( 144) = ( 0.1613274 0.4344411 0.8386501), wk = 0.0018657 k( 145) = ( 0.1557754 0.4497112 0.8386501), wk = 0.0018657 k( 146) = ( 0.1502233 0.4649814 0.8386501), wk = 0.0018657 k( 147) = ( 0.1446713 0.4802515 0.8386501), wk = 0.0018657 k( 148) = ( 0.1391193 0.4955217 0.8386501), wk = 0.0018657 k( 149) = ( 0.1335673 0.5107918 0.8386501), wk = 0.0018657 k( 150) = ( 0.1280153 0.5260619 0.8386501), wk = 0.0018657 k( 151) = ( 0.1224633 0.5413321 0.8386501), wk = 0.0018657 k( 152) = ( 0.1169113 0.5566022 0.8386501), wk = 0.0018657 k( 153) = ( 0.1113593 0.5718723 0.8386500), wk = 0.0018657 k( 154) = ( 0.1058073 0.5871425 0.8386500), wk = 0.0018657 k( 155) = ( 0.1002553 0.6024126 0.8386500), wk = 0.0018657 k( 156) = ( 0.0947032 0.6176828 0.8386500), wk = 0.0018657 k( 157) = ( 0.0891512 0.6329529 0.8386501), wk = 0.0018657 k( 158) = ( 0.0835992 0.6482231 0.8386501), wk = 0.0018657 k( 159) = ( 0.0780472 0.6634932 0.8386501), wk = 0.0018657 k( 160) = ( 0.0724952 0.6787633 0.8386501), wk = 0.0018657 k( 161) = ( 0.0669432 0.6940335 0.8386501), wk = 0.0018657 k( 162) = ( 0.0613912 0.7093036 0.8386501), wk = 0.0018657 k( 163) = ( 0.0558392 0.7245737 0.8386501), wk = 0.0018657 k( 164) = ( 0.0502872 0.7398439 0.8386501), wk = 0.0018657 k( 165) = ( 0.0447351 0.7551140 0.8386501), wk = 0.0018657 k( 166) = ( 0.0391831 0.7703842 0.8386501), wk = 0.0018657 k( 167) = ( 0.0336311 0.7856543 0.8386501), wk = 0.0018657 k( 168) = ( 0.0280791 0.8009244 0.8386501), wk = 0.0018657 k( 169) = ( 0.0280791 0.8009244 0.8386501), wk = 0.0018657 k( 170) = ( 0.0210593 0.8101339 0.8290067), wk = 0.0018657 k( 171) = ( 0.0140395 0.8193435 0.8193634), wk = 0.0018657 k( 172) = ( 0.0070198 0.8285530 0.8097201), wk = 0.0018657 k( 173) = ( 0.0000000 0.8377625 0.8000768), wk = 0.0018657 k( 174) = ( 0.0000000 0.8377625 0.8000768), wk = 0.0018657 k( 175) = ( 0.0000000 0.8259630 0.7888081), wk = 0.0018657 k( 176) = ( 0.0000000 0.8141636 0.7775394), wk = 0.0018657 k( 177) = ( 0.0000000 0.8023641 0.7662707), wk = 0.0018657 k( 178) = ( 0.0000000 0.7905646 0.7550021), wk = 0.0018657 k( 179) = ( 0.0000000 0.7787651 0.7437334), wk = 0.0018657 k( 180) = ( 0.0000000 0.7669657 0.7324647), wk = 0.0018657 k( 181) = ( 0.0000000 0.7551662 0.7211960), wk = 0.0018657 k( 182) = ( 0.0000000 0.7433667 0.7099273), wk = 0.0018657 k( 183) = ( 0.0000000 0.7315673 0.6986586), wk = 0.0018657 k( 184) = ( 0.0000000 0.7197678 0.6873899), wk = 0.0018657 k( 185) = ( 0.0000000 0.7079683 0.6761212), wk = 0.0018657 k( 186) = ( 0.0000000 0.6961688 0.6648526), wk = 0.0018657 k( 187) = ( 0.0000000 0.6843694 0.6535839), wk = 0.0018657 k( 188) = ( 0.0000000 0.6725699 0.6423152), wk = 0.0018657 k( 189) = ( 0.0000000 0.6607704 0.6310465), wk = 0.0018657 k( 190) = ( 0.0000000 0.6489709 0.6197778), wk = 0.0018657 k( 191) = ( 0.0000000 0.6371715 0.6085091), wk = 0.0018657 k( 192) = ( 0.0000000 0.6253720 0.5972404), wk = 0.0018657 k( 193) = ( 0.0000000 0.6135725 0.5859717), wk = 0.0018657 k( 194) = ( 0.0000000 0.6017731 0.5747031), wk = 0.0018657 k( 195) = ( 0.0000000 0.5899736 0.5634344), wk = 0.0018657 k( 196) = ( 0.0000000 0.5781741 0.5521657), wk = 0.0018657 k( 197) = ( 0.0000000 0.5663747 0.5408970), wk = 0.0018657 k( 198) = ( 0.0000000 0.5545752 0.5296283), wk = 0.0018657 k( 199) = ( 0.0000000 0.5427757 0.5183596), wk = 0.0018657 k( 200) = ( 0.0000000 0.5309762 0.5070909), wk = 0.0018657 k( 201) = ( 0.0000000 0.5191768 0.4958222), wk = 0.0018657 k( 202) = ( 0.0000000 0.5073773 0.4845536), wk = 0.0018657 k( 203) = ( 0.0000000 0.4955778 0.4732849), wk = 0.0018657 k( 204) = ( 0.0000000 0.4837783 0.4620162), wk = 0.0018657 k( 205) = ( 0.0000000 0.4719789 0.4507475), wk = 0.0018657 k( 206) = ( 0.0000000 0.4601794 0.4394788), wk = 0.0018657 k( 207) = ( 0.0000000 0.4483799 0.4282101), wk = 0.0018657 k( 208) = ( 0.0000000 0.4365805 0.4169414), wk = 0.0018657 k( 209) = ( 0.0000000 0.4247810 0.4056728), wk = 0.0018657 k( 210) = ( 0.0000000 0.4129815 0.3944041), wk = 0.0018657 k( 211) = ( 0.0000000 0.4011820 0.3831354), wk = 0.0018657 k( 212) = ( 0.0000000 0.3893826 0.3718667), wk = 0.0018657 k( 213) = ( 0.0000000 0.3775831 0.3605980), wk = 0.0018657 k( 214) = ( 0.0000000 0.3657836 0.3493293), wk = 0.0018657 k( 215) = ( 0.0000000 0.3539842 0.3380606), wk = 0.0018657 k( 216) = ( 0.0000000 0.3421847 0.3267919), wk = 0.0018657 k( 217) = ( 0.0000000 0.3303852 0.3155232), wk = 0.0018657 k( 218) = ( 0.0000000 0.3185857 0.3042546), wk = 0.0018657 k( 219) = ( 0.0000000 0.3067863 0.2929859), wk = 0.0018657 k( 220) = ( 0.0000000 0.2949868 0.2817172), wk = 0.0018657 k( 221) = ( 0.0000000 0.2831873 0.2704485), wk = 0.0018657 k( 222) = ( 0.0000000 0.2713879 0.2591798), wk = 0.0018657 k( 223) = ( 0.0000000 0.2595884 0.2479111), wk = 0.0018657 k( 224) = ( 0.0000000 0.2477889 0.2366424), wk = 0.0018657 k( 225) = ( 0.0000000 0.2359894 0.2253737), wk = 0.0018657 k( 226) = ( 0.0000000 0.2241900 0.2141051), wk = 0.0018657 k( 227) = ( 0.0000000 0.2123905 0.2028364), wk = 0.0018657 k( 228) = ( 0.0000000 0.2005910 0.1915677), wk = 0.0018657 k( 229) = ( 0.0000000 0.1887916 0.1802990), wk = 0.0018657 k( 230) = ( 0.0000000 0.1769921 0.1690303), wk = 0.0018657 k( 231) = ( 0.0000000 0.1651926 0.1577616), wk = 0.0018657 k( 232) = ( 0.0000000 0.1533931 0.1464929), wk = 0.0018657 k( 233) = ( 0.0000000 0.1415937 0.1352242), wk = 0.0018657 k( 234) = ( 0.0000000 0.1297942 0.1239556), wk = 0.0018657 k( 235) = ( 0.0000000 0.1179947 0.1126869), wk = 0.0018657 k( 236) = ( 0.0000000 0.1061952 0.1014182), wk = 0.0018657 k( 237) = ( 0.0000000 0.0943958 0.0901495), wk = 0.0018657 k( 238) = ( 0.0000000 0.0825963 0.0788808), wk = 0.0018657 k( 239) = ( 0.0000000 0.0707968 0.0676121), wk = 0.0018657 k( 240) = ( 0.0000000 0.0589974 0.0563434), wk = 0.0018657 k( 241) = ( 0.0000000 0.0471979 0.0450747), wk = 0.0018657 k( 242) = ( 0.0000000 0.0353984 0.0338061), wk = 0.0018657 k( 243) = ( 0.0000000 0.0235989 0.0225374), wk = 0.0018657 k( 244) = ( 0.0000000 0.0117995 0.0112687), wk = 0.0018657 k( 245) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 247) = ( 0.0142857 0.0051941 -0.0054387), wk = 0.0018657 k( 248) = ( 0.0285714 0.0103882 -0.0108775), wk = 0.0018657 k( 249) = ( 0.0428571 0.0155823 -0.0163162), wk = 0.0018657 k( 250) = ( 0.0571429 0.0207764 -0.0217550), wk = 0.0018657 k( 251) = ( 0.0714286 0.0259704 -0.0271937), wk = 0.0018657 k( 252) = ( 0.0857143 0.0311645 -0.0326325), wk = 0.0018657 k( 253) = ( 0.1000000 0.0363586 -0.0380712), wk = 0.0018657 k( 254) = ( 0.1142857 0.0415527 -0.0435099), wk = 0.0018657 k( 255) = ( 0.1285714 0.0467468 -0.0489487), wk = 0.0018657 k( 256) = ( 0.1428571 0.0519409 -0.0543874), wk = 0.0018657 k( 257) = ( 0.1571429 0.0571350 -0.0598262), wk = 0.0018657 k( 258) = ( 0.1714286 0.0623291 -0.0652649), wk = 0.0018657 k( 259) = ( 0.1857143 0.0675231 -0.0707037), wk = 0.0018657 k( 260) = ( 0.2000000 0.0727172 -0.0761424), wk = 0.0018657 k( 261) = ( 0.2142857 0.0779113 -0.0815811), wk = 0.0018657 k( 262) = ( 0.2285714 0.0831054 -0.0870199), wk = 0.0018657 k( 263) = ( 0.2428571 0.0882995 -0.0924586), wk = 0.0018657 k( 264) = ( 0.2571429 0.0934936 -0.0978974), wk = 0.0018657 k( 265) = ( 0.2714286 0.0986877 -0.1033361), wk = 0.0018657 k( 266) = ( 0.2857143 0.1038818 -0.1087749), wk = 0.0018657 k( 267) = ( 0.3000000 0.1090758 -0.1142136), wk = 0.0018657 k( 268) = ( 0.3142857 0.1142699 -0.1196523), wk = 0.0018657 k( 269) = ( 0.3285714 0.1194640 -0.1250911), wk = 0.0018657 k( 270) = ( 0.3428571 0.1246581 -0.1305298), wk = 0.0018657 k( 271) = ( 0.3571429 0.1298522 -0.1359686), wk = 0.0018657 k( 272) = ( 0.3714286 0.1350463 -0.1414073), wk = 0.0018657 k( 273) = ( 0.3857143 0.1402404 -0.1468461), wk = 0.0018657 k( 274) = ( 0.4000000 0.1454345 -0.1522848), wk = 0.0018657 k( 275) = ( 0.4142857 0.1506285 -0.1577235), wk = 0.0018657 k( 276) = ( 0.4285714 0.1558226 -0.1631623), wk = 0.0018657 k( 277) = ( 0.4428571 0.1610167 -0.1686010), wk = 0.0018657 k( 278) = ( 0.4571429 0.1662108 -0.1740398), wk = 0.0018657 k( 279) = ( 0.4714286 0.1714049 -0.1794785), wk = 0.0018657 k( 280) = ( 0.4857143 0.1765990 -0.1849172), wk = 0.0018657 k( 281) = ( 0.5000000 0.1817931 -0.1903560), wk = 0.0018657 k( 282) = ( 0.5000000 0.1817931 -0.1903560), wk = 0.0018657 k( 283) = ( 0.5074908 0.1719656 -0.1800656), wk = 0.0018657 k( 284) = ( 0.5149816 0.1621381 -0.1697752), wk = 0.0018657 k( 285) = ( 0.5224724 0.1523106 -0.1594848), wk = 0.0018657 k( 286) = ( 0.5299632 0.1424831 -0.1491945), wk = 0.0018657 k( 287) = ( 0.5374540 0.1326557 -0.1389041), wk = 0.0018657 k( 288) = ( 0.5449449 0.1228282 -0.1286137), wk = 0.0018657 k( 289) = ( 0.5524356 0.1130007 -0.1183233), wk = 0.0018657 k( 290) = ( 0.5599265 0.1031732 -0.1080329), wk = 0.0018657 k( 291) = ( 0.5674173 0.0933457 -0.0977426), wk = 0.0018657 k( 292) = ( 0.5749081 0.0835182 -0.0874522), wk = 0.0018657 k( 293) = ( 0.5823989 0.0736908 -0.0771618), wk = 0.0018657 k( 294) = ( 0.5898897 0.0638633 -0.0668714), wk = 0.0018657 k( 295) = ( 0.5973805 0.0540358 -0.0565810), wk = 0.0018657 k( 296) = ( 0.6048713 0.0442083 -0.0462906), wk = 0.0018657 k( 297) = ( 0.6123621 0.0343808 -0.0360003), wk = 0.0018657 k( 298) = ( 0.6198529 0.0245534 -0.0257099), wk = 0.0018657 k( 299) = ( 0.6273437 0.0147259 -0.0154195), wk = 0.0018657 k( 300) = ( 0.6348345 0.0048984 -0.0051291), wk = 0.0018657 k( 301) = ( 0.6423254 -0.0049291 0.0051613), wk = 0.0018657 k( 302) = ( 0.6498162 -0.0147566 0.0154517), wk = 0.0018657 k( 303) = ( 0.6573070 -0.0245841 0.0257420), wk = 0.0018657 k( 304) = ( 0.6647978 -0.0344115 0.0360324), wk = 0.0018657 k( 305) = ( 0.6722886 -0.0442390 0.0463228), wk = 0.0018657 k( 306) = ( 0.6797794 -0.0540665 0.0566132), wk = 0.0018657 k( 307) = ( 0.6872702 -0.0638940 0.0669036), wk = 0.0018657 k( 308) = ( 0.6947610 -0.0737215 0.0771939), wk = 0.0018657 k( 309) = ( 0.7022518 -0.0835489 0.0874843), wk = 0.0018657 k( 310) = ( 0.7097426 -0.0933764 0.0977747), wk = 0.0018657 k( 311) = ( 0.7172334 -0.1032039 0.1080651), wk = 0.0018657 k( 312) = ( 0.7247242 -0.1130314 0.1183555), wk = 0.0018657 k( 313) = ( 0.7322150 -0.1228589 0.1286458), wk = 0.0018657 k( 314) = ( 0.7397058 -0.1326864 0.1389362), wk = 0.0018657 k( 315) = ( 0.7471967 -0.1425138 0.1492266), wk = 0.0018657 k( 316) = ( 0.7546875 -0.1523413 0.1595170), wk = 0.0018657 k( 317) = ( 0.7621783 -0.1621688 0.1698074), wk = 0.0018657 k( 318) = ( 0.7696691 -0.1719963 0.1800978), wk = 0.0018657 k( 319) = ( 0.7771599 -0.1818238 0.1903881), wk = 0.0018657 k( 320) = ( 0.7846507 -0.1916513 0.2006785), wk = 0.0018657 k( 321) = ( 0.7921415 -0.2014787 0.2109689), wk = 0.0018657 k( 322) = ( 0.7996323 -0.2113062 0.2212593), wk = 0.0018657 k( 323) = ( 0.8071231 -0.2211337 0.2315497), wk = 0.0018657 k( 324) = ( 0.8146139 -0.2309612 0.2418401), wk = 0.0018657 k( 325) = ( 0.8221047 -0.2407887 0.2521304), wk = 0.0018657 k( 326) = ( 0.8295955 -0.2506161 0.2624208), wk = 0.0018657 k( 327) = ( 0.8370863 -0.2604436 0.2727112), wk = 0.0018657 k( 328) = ( 0.8445772 -0.2702711 0.2830016), wk = 0.0018657 k( 329) = ( 0.8520680 -0.2800986 0.2932920), wk = 0.0018657 k( 330) = ( 0.8595588 -0.2899261 0.3035823), wk = 0.0018657 k( 331) = ( 0.8670496 -0.2997535 0.3138727), wk = 0.0018657 k( 332) = ( 0.8745404 -0.3095810 0.3241631), wk = 0.0018657 k( 333) = ( 0.8820312 -0.3194085 0.3344535), wk = 0.0018657 k( 334) = ( 0.8895220 -0.3292360 0.3447439), wk = 0.0018657 k( 335) = ( 0.8970128 -0.3390635 0.3550342), wk = 0.0018657 k( 336) = ( 0.9045036 -0.3488910 0.3653246), wk = 0.0018657 k( 337) = ( 0.9119944 -0.3587184 0.3756150), wk = 0.0018657 k( 338) = ( 0.9194852 -0.3685459 0.3859054), wk = 0.0018657 k( 339) = ( 0.9269760 -0.3783734 0.3961958), wk = 0.0018657 k( 340) = ( 0.9344668 -0.3882009 0.4064862), wk = 0.0018657 k( 341) = ( 0.9419577 -0.3980284 0.4167765), wk = 0.0018657 k( 342) = ( 0.9494485 -0.4078559 0.4270669), wk = 0.0018657 k( 343) = ( 0.9569393 -0.4176833 0.4373573), wk = 0.0018657 k( 344) = ( 0.9644301 -0.4275108 0.4476477), wk = 0.0018657 k( 345) = ( 0.9719209 -0.4373383 0.4579381), wk = 0.0018657 k( 346) = ( 0.9719209 -0.4373383 0.4579381), wk = 0.0018657 k( 347) = ( 0.9627659 -0.4465478 0.4675814), wk = 0.0018657 k( 348) = ( 0.9536110 -0.4557573 0.4772247), wk = 0.0018657 k( 349) = ( 0.9444560 -0.4649668 0.4868680), wk = 0.0018657 k( 350) = ( 0.9353011 -0.4741764 0.4965113), wk = 0.0018657 k( 351) = ( 0.9261461 -0.4833859 0.5061546), wk = 0.0018657 k( 352) = ( 0.9169912 -0.4925954 0.5157979), wk = 0.0018657 k( 353) = ( 0.9078363 -0.5018049 0.5254412), wk = 0.0018657 k( 354) = ( 0.8986813 -0.5110144 0.5350846), wk = 0.0018657 k( 355) = ( 0.8986813 -0.5110144 0.5350846), wk = 0.0018657 k( 356) = ( 0.8858206 -0.5105636 0.5448770), wk = 0.0018657 k( 357) = ( 0.8729599 -0.5101127 0.5546694), wk = 0.0018657 k( 358) = ( 0.8600992 -0.5096618 0.5644619), wk = 0.0018657 k( 359) = ( 0.8472386 -0.5092109 0.5742543), wk = 0.0018657 k( 360) = ( 0.8343779 -0.5087601 0.5840467), wk = 0.0018657 k( 361) = ( 0.8215172 -0.5083092 0.5938392), wk = 0.0018657 k( 362) = ( 0.8086565 -0.5078583 0.6036316), wk = 0.0018657 k( 363) = ( 0.7957958 -0.5074074 0.6134240), wk = 0.0018657 k( 364) = ( 0.7829351 -0.5069566 0.6232165), wk = 0.0018657 k( 365) = ( 0.7700744 -0.5065057 0.6330089), wk = 0.0018657 k( 366) = ( 0.7572137 -0.5060548 0.6428013), wk = 0.0018657 k( 367) = ( 0.7443530 -0.5056039 0.6525938), wk = 0.0018657 k( 368) = ( 0.7314924 -0.5051531 0.6623862), wk = 0.0018657 k( 369) = ( 0.7186317 -0.5047022 0.6721786), wk = 0.0018657 k( 370) = ( 0.7057710 -0.5042513 0.6819711), wk = 0.0018657 k( 371) = ( 0.6929103 -0.5038004 0.6917635), wk = 0.0018657 k( 372) = ( 0.6800496 -0.5033496 0.7015560), wk = 0.0018657 k( 373) = ( 0.6671889 -0.5028987 0.7113484), wk = 0.0018657 k( 374) = ( 0.6543282 -0.5024478 0.7211408), wk = 0.0018657 k( 375) = ( 0.6414676 -0.5019970 0.7309333), wk = 0.0018657 k( 376) = ( 0.6286069 -0.5015461 0.7407257), wk = 0.0018657 k( 377) = ( 0.6157462 -0.5010952 0.7505181), wk = 0.0018657 k( 378) = ( 0.6028855 -0.5006443 0.7603106), wk = 0.0018657 k( 379) = ( 0.5900248 -0.5001935 0.7701030), wk = 0.0018657 k( 380) = ( 0.5771641 -0.4997426 0.7798954), wk = 0.0018657 k( 381) = ( 0.5643034 -0.4992917 0.7896879), wk = 0.0018657 k( 382) = ( 0.5514427 -0.4988408 0.7994803), wk = 0.0018657 k( 383) = ( 0.5385821 -0.4983900 0.8092727), wk = 0.0018657 k( 384) = ( 0.5257214 -0.4979391 0.8190652), wk = 0.0018657 k( 385) = ( 0.5128607 -0.4974882 0.8288576), wk = 0.0018657 k( 386) = ( 0.5000000 -0.4970373 0.8386501), wk = 0.0018657 k( 387) = ( 0.5000000 0.8606235 0.4579381), wk = 0.0018657 k( 388) = ( 0.5000000 0.8489195 0.4467606), wk = 0.0018657 k( 389) = ( 0.5000000 0.8372155 0.4355831), wk = 0.0018657 k( 390) = ( 0.5000000 0.8255115 0.4244056), wk = 0.0018657 k( 391) = ( 0.5000000 0.8138076 0.4132281), wk = 0.0018657 k( 392) = ( 0.5000000 0.8021036 0.4020507), wk = 0.0018657 k( 393) = ( 0.5000000 0.7903996 0.3908732), wk = 0.0018657 k( 394) = ( 0.5000000 0.7786956 0.3796957), wk = 0.0018657 k( 395) = ( 0.5000000 0.7669917 0.3685182), wk = 0.0018657 k( 396) = ( 0.5000000 0.7552877 0.3573407), wk = 0.0018657 k( 397) = ( 0.5000000 0.7435837 0.3461632), wk = 0.0018657 k( 398) = ( 0.5000000 0.7318798 0.3349858), wk = 0.0018657 k( 399) = ( 0.5000000 0.7201758 0.3238083), wk = 0.0018657 k( 400) = ( 0.5000000 0.7084718 0.3126308), wk = 0.0018657 k( 401) = ( 0.5000000 0.6967679 0.3014533), wk = 0.0018657 k( 402) = ( 0.5000000 0.6850639 0.2902758), wk = 0.0018657 k( 403) = ( 0.5000000 0.6733599 0.2790983), wk = 0.0018657 k( 404) = ( 0.5000000 0.6616559 0.2679209), wk = 0.0018657 k( 405) = ( 0.5000000 0.6499520 0.2567434), wk = 0.0018657 k( 406) = ( 0.5000000 0.6382480 0.2455659), wk = 0.0018657 k( 407) = ( 0.5000000 0.6265440 0.2343884), wk = 0.0018657 k( 408) = ( 0.5000000 0.6148400 0.2232109), wk = 0.0018657 k( 409) = ( 0.5000000 0.6031361 0.2120334), wk = 0.0018657 k( 410) = ( 0.5000000 0.5914321 0.2008559), wk = 0.0018657 k( 411) = ( 0.5000000 0.5797281 0.1896785), wk = 0.0018657 k( 412) = ( 0.5000000 0.5680241 0.1785010), wk = 0.0018657 k( 413) = ( 0.5000000 0.5563202 0.1673235), wk = 0.0018657 k( 414) = ( 0.5000000 0.5446162 0.1561460), wk = 0.0018657 k( 415) = ( 0.5000000 0.5329122 0.1449685), wk = 0.0018657 k( 416) = ( 0.5000000 0.5212083 0.1337910), wk = 0.0018657 k( 417) = ( 0.5000000 0.5095043 0.1226136), wk = 0.0018657 k( 418) = ( 0.5000000 0.4978003 0.1114361), wk = 0.0018657 k( 419) = ( 0.5000000 0.4860964 0.1002586), wk = 0.0018657 k( 420) = ( 0.5000000 0.4743924 0.0890811), wk = 0.0018657 k( 421) = ( 0.5000000 0.4626884 0.0779036), wk = 0.0018657 k( 422) = ( 0.5000000 0.4509844 0.0667261), wk = 0.0018657 k( 423) = ( 0.5000000 0.4392805 0.0555487), wk = 0.0018657 k( 424) = ( 0.5000000 0.4275765 0.0443712), wk = 0.0018657 k( 425) = ( 0.5000000 0.4158725 0.0331937), wk = 0.0018657 k( 426) = ( 0.5000000 0.4041685 0.0220162), wk = 0.0018657 k( 427) = ( 0.5000000 0.3924646 0.0108387), wk = 0.0018657 k( 428) = ( 0.5000000 0.3807606 -0.0003388), wk = 0.0018657 k( 429) = ( 0.5000000 0.3690566 -0.0115162), wk = 0.0018657 k( 430) = ( 0.5000000 0.3573526 -0.0226937), wk = 0.0018657 k( 431) = ( 0.5000000 0.3456487 -0.0338712), wk = 0.0018657 k( 432) = ( 0.5000000 0.3339447 -0.0450487), wk = 0.0018657 k( 433) = ( 0.5000000 0.3222407 -0.0562262), wk = 0.0018657 k( 434) = ( 0.5000000 0.3105368 -0.0674037), wk = 0.0018657 k( 435) = ( 0.5000000 0.2988328 -0.0785811), wk = 0.0018657 k( 436) = ( 0.5000000 0.2871288 -0.0897586), wk = 0.0018657 k( 437) = ( 0.5000000 0.2754248 -0.1009361), wk = 0.0018657 k( 438) = ( 0.5000000 0.2637209 -0.1121136), wk = 0.0018657 k( 439) = ( 0.5000000 0.2520169 -0.1232911), wk = 0.0018657 k( 440) = ( 0.5000000 0.2403129 -0.1344686), wk = 0.0018657 k( 441) = ( 0.5000000 0.2286090 -0.1456461), wk = 0.0018657 k( 442) = ( 0.5000000 0.2169050 -0.1568235), wk = 0.0018657 k( 443) = ( 0.5000000 0.2052010 -0.1680010), wk = 0.0018657 k( 444) = ( 0.5000000 0.1934970 -0.1791785), wk = 0.0018657 k( 445) = ( 0.5000000 0.1817931 -0.1903560), wk = 0.0018657 k( 446) = ( 0.0000000 0.8377625 0.8000768), wk = 0.0018657 k( 447) = ( 0.0126648 0.8423673 0.7952551), wk = 0.0018657 k( 448) = ( 0.0253297 0.8469720 0.7904335), wk = 0.0018657 k( 449) = ( 0.0379945 0.8515768 0.7856118), wk = 0.0018657 k( 450) = ( 0.0506593 0.8561815 0.7807902), wk = 0.0018657 k( 451) = ( 0.0633242 0.8607863 0.7759685), wk = 0.0018657 k( 452) = ( 0.0759890 0.8653911 0.7711469), wk = 0.0018657 k( 453) = ( 0.0886539 0.8699958 0.7663252), wk = 0.0018657 k( 454) = ( 0.1013187 0.8746006 0.7615036), wk = 0.0018657 k( 455) = ( 0.8986813 -0.5110144 0.5350846), wk = 0.0018657 k( 456) = ( 0.8844427 -0.5161914 0.5405054), wk = 0.0018657 k( 457) = ( 0.8702041 -0.5213684 0.5459262), wk = 0.0018657 k( 458) = ( 0.8559654 -0.5265453 0.5513470), wk = 0.0018657 k( 459) = ( 0.8417268 -0.5317223 0.5567678), wk = 0.0018657 k( 460) = ( 0.8274882 -0.5368993 0.5621886), wk = 0.0018657 k( 461) = ( 0.8132496 -0.5420762 0.5676094), wk = 0.0018657 k( 462) = ( 0.7990110 -0.5472532 0.5730302), wk = 0.0018657 k( 463) = ( 0.7847724 -0.5524302 0.5784511), wk = 0.0018657 k( 464) = ( 0.7705337 -0.5576071 0.5838719), wk = 0.0018657 k( 465) = ( 0.7562951 -0.5627841 0.5892927), wk = 0.0018657 k( 466) = ( 0.7420565 -0.5679611 0.5947135), wk = 0.0018657 k( 467) = ( 0.7278179 -0.5731380 0.6001343), wk = 0.0018657 k( 468) = ( 0.7135793 -0.5783150 0.6055551), wk = 0.0018657 k( 469) = ( 0.6993407 -0.5834919 0.6109759), wk = 0.0018657 k( 470) = ( 0.6851020 -0.5886689 0.6163967), wk = 0.0018657 k( 471) = ( 0.6708634 -0.5938459 0.6218176), wk = 0.0018657 k( 472) = ( 0.6566248 -0.5990228 0.6272384), wk = 0.0018657 k( 473) = ( 0.6423862 -0.6041998 0.6326592), wk = 0.0018657 k( 474) = ( 0.6281476 -0.6093768 0.6380800), wk = 0.0018657 k( 475) = ( 0.6139089 -0.6145537 0.6435008), wk = 0.0018657 k( 476) = ( 0.5996703 -0.6197307 0.6489216), wk = 0.0018657 k( 477) = ( 0.5854317 -0.6249077 0.6543424), wk = 0.0018657 k( 478) = ( 0.5711931 -0.6300846 0.6597632), wk = 0.0018657 k( 479) = ( 0.5569545 -0.6352616 0.6651841), wk = 0.0018657 k( 480) = ( 0.5427158 -0.6404385 0.6706049), wk = 0.0018657 k( 481) = ( 0.5284772 -0.6456155 0.6760257), wk = 0.0018657 k( 482) = ( 0.5142386 -0.6507925 0.6814465), wk = 0.0018657 k( 483) = ( 0.5000000 -0.6559694 0.6868673), wk = 0.0018657 k( 484) = ( 0.5000000 0.1817931 0.6482941), wk = 0.0018657 k( 485) = ( 0.4903846 0.1782970 0.6358269), wk = 0.0018657 k( 486) = ( 0.4807692 0.1748010 0.6233597), wk = 0.0018657 k( 487) = ( 0.4711538 0.1713050 0.6108925), wk = 0.0018657 k( 488) = ( 0.4615385 0.1678090 0.5984253), wk = 0.0018657 k( 489) = ( 0.4519231 0.1643130 0.5859581), wk = 0.0018657 k( 490) = ( 0.4423077 0.1608169 0.5734909), wk = 0.0018657 k( 491) = ( 0.4326923 0.1573209 0.5610237), wk = 0.0018657 k( 492) = ( 0.4230769 0.1538249 0.5485565), wk = 0.0018657 k( 493) = ( 0.4134615 0.1503289 0.5360893), wk = 0.0018657 k( 494) = ( 0.4038462 0.1468329 0.5236221), wk = 0.0018657 k( 495) = ( 0.3942308 0.1433368 0.5111549), wk = 0.0018657 k( 496) = ( 0.3846154 0.1398408 0.4986877), wk = 0.0018657 k( 497) = ( 0.3750000 0.1363448 0.4862205), wk = 0.0018657 k( 498) = ( 0.3653846 0.1328488 0.4737534), wk = 0.0018657 k( 499) = ( 0.3557692 0.1293528 0.4612862), wk = 0.0018657 k( 500) = ( 0.3461538 0.1258567 0.4488190), wk = 0.0018657 k( 501) = ( 0.3365385 0.1223607 0.4363518), wk = 0.0018657 k( 502) = ( 0.3269231 0.1188647 0.4238846), wk = 0.0018657 k( 503) = ( 0.3173077 0.1153687 0.4114174), wk = 0.0018657 k( 504) = ( 0.3076923 0.1118727 0.3989502), wk = 0.0018657 k( 505) = ( 0.2980769 0.1083766 0.3864830), wk = 0.0018657 k( 506) = ( 0.2884615 0.1048806 0.3740158), wk = 0.0018657 k( 507) = ( 0.2788462 0.1013846 0.3615486), wk = 0.0018657 k( 508) = ( 0.2692308 0.0978886 0.3490814), wk = 0.0018657 k( 509) = ( 0.2596154 0.0943926 0.3366142), wk = 0.0018657 k( 510) = ( 0.2500000 0.0908965 0.3241470), wk = 0.0018657 k( 511) = ( 0.2403846 0.0874005 0.3116798), wk = 0.0018657 k( 512) = ( 0.2307692 0.0839045 0.2992126), wk = 0.0018657 k( 513) = ( 0.2211539 0.0804085 0.2867455), wk = 0.0018657 k( 514) = ( 0.2115385 0.0769124 0.2742783), wk = 0.0018657 k( 515) = ( 0.2019231 0.0734164 0.2618111), wk = 0.0018657 k( 516) = ( 0.1923077 0.0699204 0.2493439), wk = 0.0018657 k( 517) = ( 0.1826923 0.0664244 0.2368767), wk = 0.0018657 k( 518) = ( 0.1730769 0.0629284 0.2244095), wk = 0.0018657 k( 519) = ( 0.1634615 0.0594323 0.2119423), wk = 0.0018657 k( 520) = ( 0.1538461 0.0559363 0.1994751), wk = 0.0018657 k( 521) = ( 0.1442308 0.0524403 0.1870079), wk = 0.0018657 k( 522) = ( 0.1346154 0.0489443 0.1745407), wk = 0.0018657 k( 523) = ( 0.1250000 0.0454483 0.1620735), wk = 0.0018657 k( 524) = ( 0.1153846 0.0419522 0.1496063), wk = 0.0018657 k( 525) = ( 0.1057692 0.0384562 0.1371391), wk = 0.0018657 k( 526) = ( 0.0961538 0.0349602 0.1246719), wk = 0.0018657 k( 527) = ( 0.0865385 0.0314642 0.1122047), wk = 0.0018657 k( 528) = ( 0.0769231 0.0279682 0.0997376), wk = 0.0018657 k( 529) = ( 0.0673077 0.0244721 0.0872704), wk = 0.0018657 k( 530) = ( 0.0576923 0.0209761 0.0748032), wk = 0.0018657 k( 531) = ( 0.0480769 0.0174801 0.0623360), wk = 0.0018657 k( 532) = ( 0.0384615 0.0139841 0.0498688), wk = 0.0018657 k( 533) = ( 0.0288462 0.0104881 0.0374016), wk = 0.0018657 k( 534) = ( 0.0192308 0.0069920 0.0249344), wk = 0.0018657 k( 535) = ( 0.0096154 0.0034960 0.0124672), wk = 0.0018657 k( 536) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 2) = ( 0.0075758 0.0000000 0.0075758), wk = 0.0018657 k( 3) = ( 0.0151515 0.0000000 0.0151515), wk = 0.0018657 k( 4) = ( 0.0227273 0.0000000 0.0227273), wk = 0.0018657 k( 5) = ( 0.0303030 0.0000000 0.0303030), wk = 0.0018657 k( 6) = ( 0.0378788 -0.0000000 0.0378788), wk = 0.0018657 k( 7) = ( 0.0454546 0.0000000 0.0454546), wk = 0.0018657 k( 8) = ( 0.0530303 0.0000000 0.0530303), wk = 0.0018657 k( 9) = ( 0.0606061 0.0000000 0.0606061), wk = 0.0018657 k( 10) = ( 0.0681818 -0.0000000 0.0681818), wk = 0.0018657 k( 11) = ( 0.0757576 -0.0000000 0.0757576), wk = 0.0018657 k( 12) = ( 0.0833333 0.0000000 0.0833333), wk = 0.0018657 k( 13) = ( 0.0909091 0.0000000 0.0909091), wk = 0.0018657 k( 14) = ( 0.0984848 0.0000000 0.0984849), wk = 0.0018657 k( 15) = ( 0.1060606 0.0000000 0.1060606), wk = 0.0018657 k( 16) = ( 0.1136364 0.0000000 0.1136364), wk = 0.0018657 k( 17) = ( 0.1212121 0.0000000 0.1212121), wk = 0.0018657 k( 18) = ( 0.1287879 -0.0000000 0.1287879), wk = 0.0018657 k( 19) = ( 0.1363636 -0.0000000 0.1363636), wk = 0.0018657 k( 20) = ( 0.1439394 -0.0000000 0.1439394), wk = 0.0018657 k( 21) = ( 0.1515151 0.0000000 0.1515152), wk = 0.0018657 k( 22) = ( 0.1590909 -0.0000000 0.1590909), wk = 0.0018657 k( 23) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0018657 k( 24) = ( 0.1742424 -0.0000000 0.1742424), wk = 0.0018657 k( 25) = ( 0.1818182 0.0000000 0.1818182), wk = 0.0018657 k( 26) = ( 0.1893939 0.0000000 0.1893939), wk = 0.0018657 k( 27) = ( 0.1969697 0.0000000 0.1969697), wk = 0.0018657 k( 28) = ( 0.2045454 0.0000000 0.2045455), wk = 0.0018657 k( 29) = ( 0.2121212 0.0000000 0.2121212), wk = 0.0018657 k( 30) = ( 0.2196970 0.0000000 0.2196970), wk = 0.0018657 k( 31) = ( 0.2272727 0.0000000 0.2272727), wk = 0.0018657 k( 32) = ( 0.2348485 -0.0000000 0.2348485), wk = 0.0018657 k( 33) = ( 0.2424242 0.0000000 0.2424242), wk = 0.0018657 k( 34) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0018657 k( 35) = ( 0.2575758 -0.0000000 0.2575758), wk = 0.0018657 k( 36) = ( 0.2651515 -0.0000000 0.2651515), wk = 0.0018657 k( 37) = ( 0.2727273 0.0000000 0.2727273), wk = 0.0018657 k( 38) = ( 0.2803030 -0.0000000 0.2803030), wk = 0.0018657 k( 39) = ( 0.2878788 0.0000000 0.2878788), wk = 0.0018657 k( 40) = ( 0.2954545 -0.0000000 0.2954546), wk = 0.0018657 k( 41) = ( 0.3030303 0.0000000 0.3030303), wk = 0.0018657 k( 42) = ( 0.3106061 0.0000000 0.3106061), wk = 0.0018657 k( 43) = ( 0.3181818 -0.0000000 0.3181818), wk = 0.0018657 k( 44) = ( 0.3257576 0.0000000 0.3257576), wk = 0.0018657 k( 45) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0018657 k( 46) = ( 0.3409091 0.0000000 0.3409091), wk = 0.0018657 k( 47) = ( 0.3484849 0.0000000 0.3484849), wk = 0.0018657 k( 48) = ( 0.3560606 0.0000000 0.3560606), wk = 0.0018657 k( 49) = ( 0.3636364 0.0000000 0.3636364), wk = 0.0018657 k( 50) = ( 0.3712121 0.0000000 0.3712121), wk = 0.0018657 k( 51) = ( 0.3787879 0.0000000 0.3787879), wk = 0.0018657 k( 52) = ( 0.3863636 -0.0000000 0.3863636), wk = 0.0018657 k( 53) = ( 0.3939394 -0.0000000 0.3939394), wk = 0.0018657 k( 54) = ( 0.4015151 0.0000000 0.4015151), wk = 0.0018657 k( 55) = ( 0.4090909 0.0000000 0.4090909), wk = 0.0018657 k( 56) = ( 0.4166667 0.0000000 0.4166667), wk = 0.0018657 k( 57) = ( 0.4242424 0.0000000 0.4242424), wk = 0.0018657 k( 58) = ( 0.4318182 -0.0000000 0.4318182), wk = 0.0018657 k( 59) = ( 0.4393939 0.0000000 0.4393939), wk = 0.0018657 k( 60) = ( 0.4469697 0.0000000 0.4469697), wk = 0.0018657 k( 61) = ( 0.4545455 0.0000000 0.4545455), wk = 0.0018657 k( 62) = ( 0.4621212 0.0000000 0.4621212), wk = 0.0018657 k( 63) = ( 0.4696970 0.0000000 0.4696970), wk = 0.0018657 k( 64) = ( 0.4772727 0.0000000 0.4772727), wk = 0.0018657 k( 65) = ( 0.4848485 0.0000000 0.4848485), wk = 0.0018657 k( 66) = ( 0.4924242 0.0000000 0.4924242), wk = 0.0018657 k( 67) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0018657 k( 68) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0018657 k( 69) = ( 0.5000000 0.0067754 0.5067754), wk = 0.0018657 k( 70) = ( 0.5000000 0.0135507 0.5135507), wk = 0.0018657 k( 71) = ( 0.5000000 0.0203261 0.5203261), wk = 0.0018657 k( 72) = ( 0.5000000 0.0271015 0.5271015), wk = 0.0018657 k( 73) = ( 0.5000000 0.0338768 0.5338768), wk = 0.0018657 k( 74) = ( 0.5000000 0.0406522 0.5406522), wk = 0.0018657 k( 75) = ( 0.5000000 0.0474276 0.5474276), wk = 0.0018657 k( 76) = ( 0.5000000 0.0542029 0.5542029), wk = 0.0018657 k( 77) = ( 0.5000000 0.0609783 0.5609783), wk = 0.0018657 k( 78) = ( 0.5000000 0.0677536 0.5677536), wk = 0.0018657 k( 79) = ( 0.5000000 0.0745290 0.5745290), wk = 0.0018657 k( 80) = ( 0.5000000 0.0813044 0.5813044), wk = 0.0018657 k( 81) = ( 0.5000000 0.0880797 0.5880797), wk = 0.0018657 k( 82) = ( 0.5000000 0.0948551 0.5948551), wk = 0.0018657 k( 83) = ( 0.5000000 0.0948551 0.5948551), wk = 0.0018657 k( 84) = ( 0.4944480 0.0996215 0.5940695), wk = 0.0018657 k( 85) = ( 0.4888960 0.1043879 0.5932839), wk = 0.0018657 k( 86) = ( 0.4833440 0.1091543 0.5924983), wk = 0.0018657 k( 87) = ( 0.4777920 0.1139208 0.5917127), wk = 0.0018657 k( 88) = ( 0.4722400 0.1186872 0.5909271), wk = 0.0018657 k( 89) = ( 0.4666879 0.1234536 0.5901415), wk = 0.0018657 k( 90) = ( 0.4611359 0.1282200 0.5893559), wk = 0.0018657 k( 91) = ( 0.4555839 0.1329864 0.5885703), wk = 0.0018657 k( 92) = ( 0.4500319 0.1377528 0.5877847), wk = 0.0018657 k( 93) = ( 0.4444799 0.1425192 0.5869991), wk = 0.0018657 k( 94) = ( 0.4389279 0.1472856 0.5862135), wk = 0.0018657 k( 95) = ( 0.4333759 0.1520520 0.5854279), wk = 0.0018657 k( 96) = ( 0.4278239 0.1568184 0.5846423), wk = 0.0018657 k( 97) = ( 0.4222719 0.1615849 0.5838567), wk = 0.0018657 k( 98) = ( 0.4167198 0.1663513 0.5830711), wk = 0.0018657 k( 99) = ( 0.4111678 0.1711177 0.5822855), wk = 0.0018657 k( 100) = ( 0.4056158 0.1758841 0.5814999), wk = 0.0018657 k( 101) = ( 0.4000638 0.1806505 0.5807143), wk = 0.0018657 k( 102) = ( 0.3945118 0.1854169 0.5799287), wk = 0.0018657 k( 103) = ( 0.3889598 0.1901833 0.5791431), wk = 0.0018657 k( 104) = ( 0.3834078 0.1949497 0.5783575), wk = 0.0018657 k( 105) = ( 0.3778558 0.1997161 0.5775719), wk = 0.0018657 k( 106) = ( 0.3723038 0.2044826 0.5767863), wk = 0.0018657 k( 107) = ( 0.3667517 0.2092490 0.5760007), wk = 0.0018657 k( 108) = ( 0.3611997 0.2140154 0.5752151), wk = 0.0018657 k( 109) = ( 0.3556477 0.2187818 0.5744295), wk = 0.0018657 k( 110) = ( 0.3500957 0.2235482 0.5736439), wk = 0.0018657 k( 111) = ( 0.3445437 0.2283146 0.5728583), wk = 0.0018657 k( 112) = ( 0.3389917 0.2330810 0.5720727), wk = 0.0018657 k( 113) = ( 0.3334397 0.2378474 0.5712871), wk = 0.0018657 k( 114) = ( 0.3278877 0.2426138 0.5705015), wk = 0.0018657 k( 115) = ( 0.3223357 0.2473802 0.5697159), wk = 0.0018657 k( 116) = ( 0.3167837 0.2521467 0.5689303), wk = 0.0018657 k( 117) = ( 0.3112316 0.2569131 0.5681447), wk = 0.0018657 k( 118) = ( 0.3056796 0.2616795 0.5673591), wk = 0.0018657 k( 119) = ( 0.3001276 0.2664459 0.5665735), wk = 0.0018657 k( 120) = ( 0.2945756 0.2712123 0.5657879), wk = 0.0018657 k( 121) = ( 0.2890236 0.2759787 0.5650023), wk = 0.0018657 k( 122) = ( 0.2834716 0.2807451 0.5642167), wk = 0.0018657 k( 123) = ( 0.2779196 0.2855115 0.5634311), wk = 0.0018657 k( 124) = ( 0.2723676 0.2902779 0.5626455), wk = 0.0018657 k( 125) = ( 0.2668156 0.2950444 0.5618599), wk = 0.0018657 k( 126) = ( 0.2612636 0.2998108 0.5610743), wk = 0.0018657 k( 127) = ( 0.2557115 0.3045772 0.5602887), wk = 0.0018657 k( 128) = ( 0.2501595 0.3093436 0.5595031), wk = 0.0018657 k( 129) = ( 0.2446075 0.3141100 0.5587175), wk = 0.0018657 k( 130) = ( 0.2390555 0.3188764 0.5579319), wk = 0.0018657 k( 131) = ( 0.2335035 0.3236428 0.5571463), wk = 0.0018657 k( 132) = ( 0.2279515 0.3284092 0.5563607), wk = 0.0018657 k( 133) = ( 0.2223995 0.3331756 0.5555751), wk = 0.0018657 k( 134) = ( 0.2168475 0.3379420 0.5547895), wk = 0.0018657 k( 135) = ( 0.2112955 0.3427085 0.5540039), wk = 0.0018657 k( 136) = ( 0.2057434 0.3474749 0.5532183), wk = 0.0018657 k( 137) = ( 0.2001914 0.3522413 0.5524327), wk = 0.0018657 k( 138) = ( 0.1946394 0.3570077 0.5516471), wk = 0.0018657 k( 139) = ( 0.1890874 0.3617741 0.5508615), wk = 0.0018657 k( 140) = ( 0.1835354 0.3665405 0.5500759), wk = 0.0018657 k( 141) = ( 0.1779834 0.3713069 0.5492903), wk = 0.0018657 k( 142) = ( 0.1724314 0.3760733 0.5485047), wk = 0.0018657 k( 143) = ( 0.1668794 0.3808397 0.5477191), wk = 0.0018657 k( 144) = ( 0.1613274 0.3856061 0.5469335), wk = 0.0018657 k( 145) = ( 0.1557754 0.3903726 0.5461479), wk = 0.0018657 k( 146) = ( 0.1502233 0.3951390 0.5453623), wk = 0.0018657 k( 147) = ( 0.1446713 0.3999054 0.5445767), wk = 0.0018657 k( 148) = ( 0.1391193 0.4046718 0.5437911), wk = 0.0018657 k( 149) = ( 0.1335673 0.4094382 0.5430055), wk = 0.0018657 k( 150) = ( 0.1280153 0.4142046 0.5422199), wk = 0.0018657 k( 151) = ( 0.1224633 0.4189710 0.5414343), wk = 0.0018657 k( 152) = ( 0.1169113 0.4237374 0.5406487), wk = 0.0018657 k( 153) = ( 0.1113593 0.4285038 0.5398631), wk = 0.0018657 k( 154) = ( 0.1058073 0.4332703 0.5390775), wk = 0.0018657 k( 155) = ( 0.1002553 0.4380367 0.5382919), wk = 0.0018657 k( 156) = ( 0.0947032 0.4428031 0.5375063), wk = 0.0018657 k( 157) = ( 0.0891512 0.4475695 0.5367207), wk = 0.0018657 k( 158) = ( 0.0835992 0.4523359 0.5359351), wk = 0.0018657 k( 159) = ( 0.0780472 0.4571023 0.5351495), wk = 0.0018657 k( 160) = ( 0.0724952 0.4618687 0.5343639), wk = 0.0018657 k( 161) = ( 0.0669432 0.4666351 0.5335783), wk = 0.0018657 k( 162) = ( 0.0613912 0.4714015 0.5327927), wk = 0.0018657 k( 163) = ( 0.0558392 0.4761680 0.5320071), wk = 0.0018657 k( 164) = ( 0.0502872 0.4809344 0.5312215), wk = 0.0018657 k( 165) = ( 0.0447351 0.4857008 0.5304359), wk = 0.0018657 k( 166) = ( 0.0391831 0.4904672 0.5296503), wk = 0.0018657 k( 167) = ( 0.0336311 0.4952336 0.5288647), wk = 0.0018657 k( 168) = ( 0.0280791 0.5000000 0.5280791), wk = 0.0018657 k( 169) = ( 0.0280791 0.5000000 0.5280791), wk = 0.0018657 k( 170) = ( 0.0210593 0.5000000 0.5210593), wk = 0.0018657 k( 171) = ( 0.0140395 0.5000000 0.5140396), wk = 0.0018657 k( 172) = ( 0.0070198 0.5000000 0.5070198), wk = 0.0018657 k( 173) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0018657 k( 174) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0018657 k( 175) = ( 0.0000000 0.4929578 0.4929578), wk = 0.0018657 k( 176) = ( 0.0000000 0.4859155 0.4859155), wk = 0.0018657 k( 177) = ( 0.0000000 0.4788732 0.4788732), wk = 0.0018657 k( 178) = ( 0.0000000 0.4718310 0.4718310), wk = 0.0018657 k( 179) = ( 0.0000000 0.4647887 0.4647887), wk = 0.0018657 k( 180) = ( 0.0000000 0.4577465 0.4577465), wk = 0.0018657 k( 181) = ( 0.0000000 0.4507042 0.4507042), wk = 0.0018657 k( 182) = ( 0.0000000 0.4436620 0.4436620), wk = 0.0018657 k( 183) = ( 0.0000000 0.4366197 0.4366197), wk = 0.0018657 k( 184) = ( 0.0000000 0.4295775 0.4295775), wk = 0.0018657 k( 185) = ( 0.0000000 0.4225352 0.4225352), wk = 0.0018657 k( 186) = ( 0.0000000 0.4154930 0.4154930), wk = 0.0018657 k( 187) = ( 0.0000000 0.4084507 0.4084507), wk = 0.0018657 k( 188) = ( 0.0000000 0.4014085 0.4014085), wk = 0.0018657 k( 189) = ( 0.0000000 0.3943662 0.3943662), wk = 0.0018657 k( 190) = ( 0.0000000 0.3873239 0.3873239), wk = 0.0018657 k( 191) = ( 0.0000000 0.3802817 0.3802817), wk = 0.0018657 k( 192) = ( 0.0000000 0.3732394 0.3732394), wk = 0.0018657 k( 193) = ( 0.0000000 0.3661972 0.3661972), wk = 0.0018657 k( 194) = ( 0.0000000 0.3591549 0.3591549), wk = 0.0018657 k( 195) = ( 0.0000000 0.3521127 0.3521127), wk = 0.0018657 k( 196) = ( 0.0000000 0.3450704 0.3450704), wk = 0.0018657 k( 197) = ( 0.0000000 0.3380282 0.3380282), wk = 0.0018657 k( 198) = ( 0.0000000 0.3309859 0.3309859), wk = 0.0018657 k( 199) = ( 0.0000000 0.3239437 0.3239437), wk = 0.0018657 k( 200) = ( 0.0000000 0.3169014 0.3169014), wk = 0.0018657 k( 201) = ( 0.0000000 0.3098592 0.3098592), wk = 0.0018657 k( 202) = ( 0.0000000 0.3028169 0.3028169), wk = 0.0018657 k( 203) = ( 0.0000000 0.2957746 0.2957747), wk = 0.0018657 k( 204) = ( 0.0000000 0.2887324 0.2887324), wk = 0.0018657 k( 205) = ( 0.0000000 0.2816901 0.2816901), wk = 0.0018657 k( 206) = ( 0.0000000 0.2746479 0.2746479), wk = 0.0018657 k( 207) = ( 0.0000000 0.2676056 0.2676056), wk = 0.0018657 k( 208) = ( 0.0000000 0.2605634 0.2605634), wk = 0.0018657 k( 209) = ( 0.0000000 0.2535211 0.2535211), wk = 0.0018657 k( 210) = ( 0.0000000 0.2464789 0.2464789), wk = 0.0018657 k( 211) = ( 0.0000000 0.2394366 0.2394366), wk = 0.0018657 k( 212) = ( 0.0000000 0.2323944 0.2323944), wk = 0.0018657 k( 213) = ( 0.0000000 0.2253521 0.2253521), wk = 0.0018657 k( 214) = ( 0.0000000 0.2183099 0.2183099), wk = 0.0018657 k( 215) = ( 0.0000000 0.2112676 0.2112676), wk = 0.0018657 k( 216) = ( 0.0000000 0.2042253 0.2042254), wk = 0.0018657 k( 217) = ( 0.0000000 0.1971831 0.1971831), wk = 0.0018657 k( 218) = ( 0.0000000 0.1901409 0.1901409), wk = 0.0018657 k( 219) = ( 0.0000000 0.1830986 0.1830986), wk = 0.0018657 k( 220) = ( 0.0000000 0.1760563 0.1760563), wk = 0.0018657 k( 221) = ( 0.0000000 0.1690141 0.1690141), wk = 0.0018657 k( 222) = ( 0.0000000 0.1619718 0.1619718), wk = 0.0018657 k( 223) = ( 0.0000000 0.1549296 0.1549296), wk = 0.0018657 k( 224) = ( 0.0000000 0.1478873 0.1478873), wk = 0.0018657 k( 225) = ( 0.0000000 0.1408451 0.1408451), wk = 0.0018657 k( 226) = ( 0.0000000 0.1338028 0.1338028), wk = 0.0018657 k( 227) = ( 0.0000000 0.1267606 0.1267606), wk = 0.0018657 k( 228) = ( 0.0000000 0.1197183 0.1197183), wk = 0.0018657 k( 229) = ( 0.0000000 0.1126761 0.1126761), wk = 0.0018657 k( 230) = ( 0.0000000 0.1056338 0.1056338), wk = 0.0018657 k( 231) = ( 0.0000000 0.0985916 0.0985916), wk = 0.0018657 k( 232) = ( 0.0000000 0.0915493 0.0915493), wk = 0.0018657 k( 233) = ( 0.0000000 0.0845070 0.0845070), wk = 0.0018657 k( 234) = ( 0.0000000 0.0774648 0.0774648), wk = 0.0018657 k( 235) = ( 0.0000000 0.0704225 0.0704225), wk = 0.0018657 k( 236) = ( 0.0000000 0.0633803 0.0633803), wk = 0.0018657 k( 237) = ( 0.0000000 0.0563380 0.0563380), wk = 0.0018657 k( 238) = ( 0.0000000 0.0492958 0.0492958), wk = 0.0018657 k( 239) = ( 0.0000000 0.0422535 0.0422535), wk = 0.0018657 k( 240) = ( 0.0000000 0.0352113 0.0352113), wk = 0.0018657 k( 241) = ( 0.0000000 0.0281690 0.0281690), wk = 0.0018657 k( 242) = ( 0.0000000 0.0211268 0.0211268), wk = 0.0018657 k( 243) = ( 0.0000000 0.0140845 0.0140845), wk = 0.0018657 k( 244) = ( 0.0000000 0.0070423 0.0070423), wk = 0.0018657 k( 245) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 246) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 k( 247) = ( 0.0142857 0.0142857 0.0000000), wk = 0.0018657 k( 248) = ( 0.0285714 0.0285714 0.0000000), wk = 0.0018657 k( 249) = ( 0.0428571 0.0428571 -0.0000000), wk = 0.0018657 k( 250) = ( 0.0571429 0.0571429 0.0000000), wk = 0.0018657 k( 251) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0018657 k( 252) = ( 0.0857143 0.0857143 0.0000000), wk = 0.0018657 k( 253) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0018657 k( 254) = ( 0.1142857 0.1142857 0.0000000), wk = 0.0018657 k( 255) = ( 0.1285714 0.1285714 0.0000000), wk = 0.0018657 k( 256) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0018657 k( 257) = ( 0.1571429 0.1571429 0.0000000), wk = 0.0018657 k( 258) = ( 0.1714286 0.1714286 0.0000000), wk = 0.0018657 k( 259) = ( 0.1857143 0.1857143 0.0000000), wk = 0.0018657 k( 260) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0018657 k( 261) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0018657 k( 262) = ( 0.2285714 0.2285714 0.0000000), wk = 0.0018657 k( 263) = ( 0.2428571 0.2428571 -0.0000000), wk = 0.0018657 k( 264) = ( 0.2571429 0.2571429 0.0000000), wk = 0.0018657 k( 265) = ( 0.2714286 0.2714286 0.0000000), wk = 0.0018657 k( 266) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0018657 k( 267) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0018657 k( 268) = ( 0.3142857 0.3142857 0.0000000), wk = 0.0018657 k( 269) = ( 0.3285714 0.3285714 0.0000000), wk = 0.0018657 k( 270) = ( 0.3428571 0.3428571 0.0000000), wk = 0.0018657 k( 271) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0018657 k( 272) = ( 0.3714286 0.3714286 0.0000000), wk = 0.0018657 k( 273) = ( 0.3857143 0.3857143 0.0000000), wk = 0.0018657 k( 274) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0018657 k( 275) = ( 0.4142857 0.4142857 0.0000000), wk = 0.0018657 k( 276) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0018657 k( 277) = ( 0.4428571 0.4428571 0.0000000), wk = 0.0018657 k( 278) = ( 0.4571429 0.4571429 0.0000000), wk = 0.0018657 k( 279) = ( 0.4714286 0.4714286 0.0000000), wk = 0.0018657 k( 280) = ( 0.4857143 0.4857143 0.0000000), wk = 0.0018657 k( 281) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018657 k( 282) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018657 k( 283) = ( 0.5074908 0.5000000 0.0074908), wk = 0.0018657 k( 284) = ( 0.5149816 0.5000000 0.0149816), wk = 0.0018657 k( 285) = ( 0.5224724 0.5000000 0.0224724), wk = 0.0018657 k( 286) = ( 0.5299632 0.5000000 0.0299632), wk = 0.0018657 k( 287) = ( 0.5374540 0.5000000 0.0374540), wk = 0.0018657 k( 288) = ( 0.5449449 0.5000000 0.0449448), wk = 0.0018657 k( 289) = ( 0.5524356 0.5000000 0.0524357), wk = 0.0018657 k( 290) = ( 0.5599265 0.5000000 0.0599265), wk = 0.0018657 k( 291) = ( 0.5674173 0.5000000 0.0674173), wk = 0.0018657 k( 292) = ( 0.5749081 0.5000000 0.0749081), wk = 0.0018657 k( 293) = ( 0.5823989 0.5000000 0.0823989), wk = 0.0018657 k( 294) = ( 0.5898897 0.5000000 0.0898897), wk = 0.0018657 k( 295) = ( 0.5973805 0.5000000 0.0973805), wk = 0.0018657 k( 296) = ( 0.6048713 0.5000000 0.1048713), wk = 0.0018657 k( 297) = ( 0.6123621 0.5000000 0.1123621), wk = 0.0018657 k( 298) = ( 0.6198529 0.5000000 0.1198529), wk = 0.0018657 k( 299) = ( 0.6273437 0.5000000 0.1273437), wk = 0.0018657 k( 300) = ( 0.6348345 0.5000000 0.1348345), wk = 0.0018657 k( 301) = ( 0.6423254 0.5000000 0.1423253), wk = 0.0018657 k( 302) = ( 0.6498162 0.5000000 0.1498162), wk = 0.0018657 k( 303) = ( 0.6573070 0.5000000 0.1573070), wk = 0.0018657 k( 304) = ( 0.6647978 0.5000000 0.1647978), wk = 0.0018657 k( 305) = ( 0.6722886 0.5000000 0.1722886), wk = 0.0018657 k( 306) = ( 0.6797794 0.5000000 0.1797794), wk = 0.0018657 k( 307) = ( 0.6872702 0.5000000 0.1872702), wk = 0.0018657 k( 308) = ( 0.6947610 0.5000000 0.1947610), wk = 0.0018657 k( 309) = ( 0.7022518 0.5000000 0.2022518), wk = 0.0018657 k( 310) = ( 0.7097426 0.5000000 0.2097426), wk = 0.0018657 k( 311) = ( 0.7172334 0.5000000 0.2172334), wk = 0.0018657 k( 312) = ( 0.7247242 0.5000000 0.2247242), wk = 0.0018657 k( 313) = ( 0.7322150 0.5000000 0.2322150), wk = 0.0018657 k( 314) = ( 0.7397058 0.5000000 0.2397059), wk = 0.0018657 k( 315) = ( 0.7471967 0.5000000 0.2471967), wk = 0.0018657 k( 316) = ( 0.7546875 0.5000000 0.2546875), wk = 0.0018657 k( 317) = ( 0.7621783 0.5000000 0.2621783), wk = 0.0018657 k( 318) = ( 0.7696691 0.5000000 0.2696691), wk = 0.0018657 k( 319) = ( 0.7771599 0.5000000 0.2771599), wk = 0.0018657 k( 320) = ( 0.7846507 0.5000000 0.2846507), wk = 0.0018657 k( 321) = ( 0.7921415 0.5000000 0.2921415), wk = 0.0018657 k( 322) = ( 0.7996323 0.5000000 0.2996323), wk = 0.0018657 k( 323) = ( 0.8071231 0.5000000 0.3071231), wk = 0.0018657 k( 324) = ( 0.8146139 0.5000000 0.3146139), wk = 0.0018657 k( 325) = ( 0.8221047 0.5000000 0.3221047), wk = 0.0018657 k( 326) = ( 0.8295955 0.5000000 0.3295955), wk = 0.0018657 k( 327) = ( 0.8370863 0.5000000 0.3370863), wk = 0.0018657 k( 328) = ( 0.8445772 0.5000000 0.3445772), wk = 0.0018657 k( 329) = ( 0.8520680 0.5000000 0.3520680), wk = 0.0018657 k( 330) = ( 0.8595588 0.5000000 0.3595588), wk = 0.0018657 k( 331) = ( 0.8670496 0.5000000 0.3670496), wk = 0.0018657 k( 332) = ( 0.8745404 0.5000000 0.3745404), wk = 0.0018657 k( 333) = ( 0.8820312 0.5000000 0.3820312), wk = 0.0018657 k( 334) = ( 0.8895220 0.5000000 0.3895220), wk = 0.0018657 k( 335) = ( 0.8970128 0.5000000 0.3970128), wk = 0.0018657 k( 336) = ( 0.9045036 0.5000000 0.4045036), wk = 0.0018657 k( 337) = ( 0.9119944 0.5000000 0.4119944), wk = 0.0018657 k( 338) = ( 0.9194852 0.5000000 0.4194852), wk = 0.0018657 k( 339) = ( 0.9269760 0.5000000 0.4269760), wk = 0.0018657 k( 340) = ( 0.9344668 0.5000000 0.4344669), wk = 0.0018657 k( 341) = ( 0.9419577 0.5000000 0.4419577), wk = 0.0018657 k( 342) = ( 0.9494485 0.5000000 0.4494485), wk = 0.0018657 k( 343) = ( 0.9569393 0.5000000 0.4569393), wk = 0.0018657 k( 344) = ( 0.9644301 0.5000000 0.4644301), wk = 0.0018657 k( 345) = ( 0.9719209 0.5000000 0.4719209), wk = 0.0018657 k( 346) = ( 0.9719209 0.5000000 0.4719209), wk = 0.0018657 k( 347) = ( 0.9627659 0.4873352 0.4754308), wk = 0.0018657 k( 348) = ( 0.9536110 0.4746703 0.4789407), wk = 0.0018657 k( 349) = ( 0.9444560 0.4620055 0.4824506), wk = 0.0018657 k( 350) = ( 0.9353011 0.4493406 0.4859605), wk = 0.0018657 k( 351) = ( 0.9261461 0.4366758 0.4894703), wk = 0.0018657 k( 352) = ( 0.9169912 0.4240110 0.4929802), wk = 0.0018657 k( 353) = ( 0.9078363 0.4113461 0.4964901), wk = 0.0018657 k( 354) = ( 0.8986813 0.3986813 0.5000000), wk = 0.0018657 k( 355) = ( 0.8986813 0.3986813 0.5000000), wk = 0.0018657 k( 356) = ( 0.8858206 0.3888804 0.5030598), wk = 0.0018657 k( 357) = ( 0.8729599 0.3790796 0.5061197), wk = 0.0018657 k( 358) = ( 0.8600992 0.3692788 0.5091795), wk = 0.0018657 k( 359) = ( 0.8472386 0.3594779 0.5122394), wk = 0.0018657 k( 360) = ( 0.8343779 0.3496771 0.5152992), wk = 0.0018657 k( 361) = ( 0.8215172 0.3398762 0.5183591), wk = 0.0018657 k( 362) = ( 0.8086565 0.3300754 0.5214189), wk = 0.0018657 k( 363) = ( 0.7957958 0.3202745 0.5244787), wk = 0.0018657 k( 364) = ( 0.7829351 0.3104737 0.5275386), wk = 0.0018657 k( 365) = ( 0.7700744 0.3006728 0.5305984), wk = 0.0018657 k( 366) = ( 0.7572137 0.2908720 0.5336583), wk = 0.0018657 k( 367) = ( 0.7443530 0.2810712 0.5367181), wk = 0.0018657 k( 368) = ( 0.7314924 0.2712703 0.5397779), wk = 0.0018657 k( 369) = ( 0.7186317 0.2614695 0.5428378), wk = 0.0018657 k( 370) = ( 0.7057710 0.2516686 0.5458976), wk = 0.0018657 k( 371) = ( 0.6929103 0.2418678 0.5489575), wk = 0.0018657 k( 372) = ( 0.6800496 0.2320669 0.5520173), wk = 0.0018657 k( 373) = ( 0.6671889 0.2222661 0.5550772), wk = 0.0018657 k( 374) = ( 0.6543282 0.2124652 0.5581370), wk = 0.0018657 k( 375) = ( 0.6414676 0.2026644 0.5611968), wk = 0.0018657 k( 376) = ( 0.6286069 0.1928636 0.5642567), wk = 0.0018657 k( 377) = ( 0.6157462 0.1830627 0.5673165), wk = 0.0018657 k( 378) = ( 0.6028855 0.1732619 0.5703764), wk = 0.0018657 k( 379) = ( 0.5900248 0.1634610 0.5734362), wk = 0.0018657 k( 380) = ( 0.5771641 0.1536602 0.5764961), wk = 0.0018657 k( 381) = ( 0.5643034 0.1438593 0.5795559), wk = 0.0018657 k( 382) = ( 0.5514427 0.1340585 0.5826157), wk = 0.0018657 k( 383) = ( 0.5385821 0.1242576 0.5856756), wk = 0.0018657 k( 384) = ( 0.5257214 0.1144568 0.5887354), wk = 0.0018657 k( 385) = ( 0.5128607 0.1046559 0.5917953), wk = 0.0018657 k( 386) = ( 0.5000000 0.0948551 0.5948551), wk = 0.0018657 k( 387) = ( 0.5000000 0.9051449 0.4051449), wk = 0.0018657 k( 388) = ( 0.5000000 0.8981596 0.3981596), wk = 0.0018657 k( 389) = ( 0.5000000 0.8911744 0.3911744), wk = 0.0018657 k( 390) = ( 0.5000000 0.8841891 0.3841891), wk = 0.0018657 k( 391) = ( 0.5000000 0.8772039 0.3772039), wk = 0.0018657 k( 392) = ( 0.5000000 0.8702186 0.3702186), wk = 0.0018657 k( 393) = ( 0.5000000 0.8632334 0.3632334), wk = 0.0018657 k( 394) = ( 0.5000000 0.8562481 0.3562481), wk = 0.0018657 k( 395) = ( 0.5000000 0.8492628 0.3492628), wk = 0.0018657 k( 396) = ( 0.5000000 0.8422776 0.3422776), wk = 0.0018657 k( 397) = ( 0.5000000 0.8352923 0.3352923), wk = 0.0018657 k( 398) = ( 0.5000000 0.8283071 0.3283071), wk = 0.0018657 k( 399) = ( 0.5000000 0.8213218 0.3213218), wk = 0.0018657 k( 400) = ( 0.5000000 0.8143366 0.3143366), wk = 0.0018657 k( 401) = ( 0.5000000 0.8073513 0.3073513), wk = 0.0018657 k( 402) = ( 0.5000000 0.8003660 0.3003660), wk = 0.0018657 k( 403) = ( 0.5000000 0.7933808 0.2933808), wk = 0.0018657 k( 404) = ( 0.5000000 0.7863955 0.2863955), wk = 0.0018657 k( 405) = ( 0.5000000 0.7794103 0.2794103), wk = 0.0018657 k( 406) = ( 0.5000000 0.7724250 0.2724250), wk = 0.0018657 k( 407) = ( 0.5000000 0.7654398 0.2654398), wk = 0.0018657 k( 408) = ( 0.5000000 0.7584545 0.2584545), wk = 0.0018657 k( 409) = ( 0.5000000 0.7514692 0.2514692), wk = 0.0018657 k( 410) = ( 0.5000000 0.7444840 0.2444840), wk = 0.0018657 k( 411) = ( 0.5000000 0.7374987 0.2374987), wk = 0.0018657 k( 412) = ( 0.5000000 0.7305135 0.2305135), wk = 0.0018657 k( 413) = ( 0.5000000 0.7235282 0.2235282), wk = 0.0018657 k( 414) = ( 0.5000000 0.7165430 0.2165430), wk = 0.0018657 k( 415) = ( 0.5000000 0.7095577 0.2095577), wk = 0.0018657 k( 416) = ( 0.5000000 0.7025725 0.2025725), wk = 0.0018657 k( 417) = ( 0.5000000 0.6955872 0.1955872), wk = 0.0018657 k( 418) = ( 0.5000000 0.6886019 0.1886019), wk = 0.0018657 k( 419) = ( 0.5000000 0.6816167 0.1816167), wk = 0.0018657 k( 420) = ( 0.5000000 0.6746314 0.1746314), wk = 0.0018657 k( 421) = ( 0.5000000 0.6676462 0.1676462), wk = 0.0018657 k( 422) = ( 0.5000000 0.6606609 0.1606609), wk = 0.0018657 k( 423) = ( 0.5000000 0.6536757 0.1536756), wk = 0.0018657 k( 424) = ( 0.5000000 0.6466904 0.1466904), wk = 0.0018657 k( 425) = ( 0.5000000 0.6397051 0.1397051), wk = 0.0018657 k( 426) = ( 0.5000000 0.6327199 0.1327199), wk = 0.0018657 k( 427) = ( 0.5000000 0.6257346 0.1257346), wk = 0.0018657 k( 428) = ( 0.5000000 0.6187494 0.1187494), wk = 0.0018657 k( 429) = ( 0.5000000 0.6117641 0.1117641), wk = 0.0018657 k( 430) = ( 0.5000000 0.6047789 0.1047789), wk = 0.0018657 k( 431) = ( 0.5000000 0.5977936 0.0977936), wk = 0.0018657 k( 432) = ( 0.5000000 0.5908083 0.0908083), wk = 0.0018657 k( 433) = ( 0.5000000 0.5838231 0.0838231), wk = 0.0018657 k( 434) = ( 0.5000000 0.5768378 0.0768378), wk = 0.0018657 k( 435) = ( 0.5000000 0.5698526 0.0698526), wk = 0.0018657 k( 436) = ( 0.5000000 0.5628673 0.0628673), wk = 0.0018657 k( 437) = ( 0.5000000 0.5558821 0.0558821), wk = 0.0018657 k( 438) = ( 0.5000000 0.5488968 0.0488968), wk = 0.0018657 k( 439) = ( 0.5000000 0.5419115 0.0419115), wk = 0.0018657 k( 440) = ( 0.5000000 0.5349263 0.0349263), wk = 0.0018657 k( 441) = ( 0.5000000 0.5279410 0.0279410), wk = 0.0018657 k( 442) = ( 0.5000000 0.5209558 0.0209558), wk = 0.0018657 k( 443) = ( 0.5000000 0.5139705 0.0139705), wk = 0.0018657 k( 444) = ( 0.5000000 0.5069853 0.0069853), wk = 0.0018657 k( 445) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0018657 k( 446) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0018657 k( 447) = ( 0.0126648 0.5126648 0.5000000), wk = 0.0018657 k( 448) = ( 0.0253297 0.5253297 0.5000000), wk = 0.0018657 k( 449) = ( 0.0379945 0.5379945 0.5000000), wk = 0.0018657 k( 450) = ( 0.0506593 0.5506593 0.5000000), wk = 0.0018657 k( 451) = ( 0.0633242 0.5633242 0.5000000), wk = 0.0018657 k( 452) = ( 0.0759890 0.5759890 0.5000000), wk = 0.0018657 k( 453) = ( 0.0886539 0.5886539 0.5000000), wk = 0.0018657 k( 454) = ( 0.1013187 0.6013187 0.5000000), wk = 0.0018657 k( 455) = ( 0.8986813 0.3986813 0.5000000), wk = 0.0018657 k( 456) = ( 0.8844427 0.3844427 0.5000000), wk = 0.0018657 k( 457) = ( 0.8702041 0.3702041 0.5000000), wk = 0.0018657 k( 458) = ( 0.8559654 0.3559654 0.5000000), wk = 0.0018657 k( 459) = ( 0.8417268 0.3417268 0.5000000), wk = 0.0018657 k( 460) = ( 0.8274882 0.3274882 0.5000000), wk = 0.0018657 k( 461) = ( 0.8132496 0.3132496 0.5000000), wk = 0.0018657 k( 462) = ( 0.7990110 0.2990110 0.5000000), wk = 0.0018657 k( 463) = ( 0.7847724 0.2847724 0.5000000), wk = 0.0018657 k( 464) = ( 0.7705337 0.2705337 0.5000000), wk = 0.0018657 k( 465) = ( 0.7562951 0.2562951 0.5000000), wk = 0.0018657 k( 466) = ( 0.7420565 0.2420565 0.5000000), wk = 0.0018657 k( 467) = ( 0.7278179 0.2278179 0.5000000), wk = 0.0018657 k( 468) = ( 0.7135793 0.2135793 0.5000000), wk = 0.0018657 k( 469) = ( 0.6993407 0.1993407 0.5000000), wk = 0.0018657 k( 470) = ( 0.6851020 0.1851020 0.5000000), wk = 0.0018657 k( 471) = ( 0.6708634 0.1708634 0.5000000), wk = 0.0018657 k( 472) = ( 0.6566248 0.1566248 0.5000000), wk = 0.0018657 k( 473) = ( 0.6423862 0.1423862 0.5000000), wk = 0.0018657 k( 474) = ( 0.6281476 0.1281476 0.5000000), wk = 0.0018657 k( 475) = ( 0.6139089 0.1139089 0.5000000), wk = 0.0018657 k( 476) = ( 0.5996703 0.0996703 0.5000000), wk = 0.0018657 k( 477) = ( 0.5854317 0.0854317 0.5000000), wk = 0.0018657 k( 478) = ( 0.5711931 0.0711931 0.5000000), wk = 0.0018657 k( 479) = ( 0.5569545 0.0569545 0.5000000), wk = 0.0018657 k( 480) = ( 0.5427158 0.0427159 0.5000000), wk = 0.0018657 k( 481) = ( 0.5284772 0.0284772 0.5000000), wk = 0.0018657 k( 482) = ( 0.5142386 0.0142386 0.5000000), wk = 0.0018657 k( 483) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0018657 k( 484) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0018657 k( 485) = ( 0.4903846 0.4903846 0.4903846), wk = 0.0018657 k( 486) = ( 0.4807692 0.4807692 0.4807692), wk = 0.0018657 k( 487) = ( 0.4711538 0.4711538 0.4711538), wk = 0.0018657 k( 488) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0018657 k( 489) = ( 0.4519231 0.4519231 0.4519231), wk = 0.0018657 k( 490) = ( 0.4423077 0.4423077 0.4423077), wk = 0.0018657 k( 491) = ( 0.4326923 0.4326923 0.4326923), wk = 0.0018657 k( 492) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0018657 k( 493) = ( 0.4134615 0.4134615 0.4134615), wk = 0.0018657 k( 494) = ( 0.4038462 0.4038462 0.4038462), wk = 0.0018657 k( 495) = ( 0.3942308 0.3942308 0.3942308), wk = 0.0018657 k( 496) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0018657 k( 497) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0018657 k( 498) = ( 0.3653846 0.3653846 0.3653846), wk = 0.0018657 k( 499) = ( 0.3557692 0.3557692 0.3557692), wk = 0.0018657 k( 500) = ( 0.3461538 0.3461539 0.3461539), wk = 0.0018657 k( 501) = ( 0.3365385 0.3365385 0.3365385), wk = 0.0018657 k( 502) = ( 0.3269231 0.3269231 0.3269231), wk = 0.0018657 k( 503) = ( 0.3173077 0.3173077 0.3173077), wk = 0.0018657 k( 504) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0018657 k( 505) = ( 0.2980769 0.2980769 0.2980769), wk = 0.0018657 k( 506) = ( 0.2884615 0.2884615 0.2884615), wk = 0.0018657 k( 507) = ( 0.2788462 0.2788462 0.2788462), wk = 0.0018657 k( 508) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0018657 k( 509) = ( 0.2596154 0.2596154 0.2596154), wk = 0.0018657 k( 510) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0018657 k( 511) = ( 0.2403846 0.2403846 0.2403846), wk = 0.0018657 k( 512) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0018657 k( 513) = ( 0.2211539 0.2211539 0.2211539), wk = 0.0018657 k( 514) = ( 0.2115385 0.2115385 0.2115385), wk = 0.0018657 k( 515) = ( 0.2019231 0.2019231 0.2019231), wk = 0.0018657 k( 516) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0018657 k( 517) = ( 0.1826923 0.1826923 0.1826923), wk = 0.0018657 k( 518) = ( 0.1730769 0.1730769 0.1730769), wk = 0.0018657 k( 519) = ( 0.1634615 0.1634615 0.1634615), wk = 0.0018657 k( 520) = ( 0.1538461 0.1538461 0.1538461), wk = 0.0018657 k( 521) = ( 0.1442308 0.1442308 0.1442308), wk = 0.0018657 k( 522) = ( 0.1346154 0.1346154 0.1346154), wk = 0.0018657 k( 523) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0018657 k( 524) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0018657 k( 525) = ( 0.1057692 0.1057692 0.1057692), wk = 0.0018657 k( 526) = ( 0.0961538 0.0961538 0.0961539), wk = 0.0018657 k( 527) = ( 0.0865385 0.0865385 0.0865385), wk = 0.0018657 k( 528) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0018657 k( 529) = ( 0.0673077 0.0673077 0.0673077), wk = 0.0018657 k( 530) = ( 0.0576923 0.0576923 0.0576923), wk = 0.0018657 k( 531) = ( 0.0480769 0.0480769 0.0480769), wk = 0.0018657 k( 532) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0018657 k( 533) = ( 0.0288462 0.0288462 0.0288462), wk = 0.0018657 k( 534) = ( 0.0192308 0.0192308 0.0192308), wk = 0.0018657 k( 535) = ( 0.0096154 0.0096154 0.0096154), wk = 0.0018657 k( 536) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0018657 Dense grid: 75613 G-vectors FFT dimensions: ( 75, 75, 48) Smooth grid: 16377 G-vectors FFT dimensions: ( 45, 45, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.04 Mb ( 88, 28) NL pseudopotentials 0.04 Mb ( 44, 62) Each V/rho on FFT grid 0.09 Mb ( 5625) Each G-vector array 0.01 Mb ( 1576) G-vector shells 0.01 Mb ( 1470) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.15 Mb ( 88, 112) Each subspace H/S matrix 0.19 Mb ( 112, 112) Each matrix 0.05 Mb ( 62, 2, 28) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./TiSi2.save/charge-density.dat Starting wfc are 36 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.4 secs Computing kpt #: 2 total cpu time spent up to now is 42.1 secs Computing kpt #: 3 total cpu time spent up to now is 42.6 secs Computing kpt #: 4 total cpu time spent up to now is 43.1 secs Computing kpt #: 5 total cpu time spent up to now is 43.6 secs Computing kpt #: 6 total cpu time spent up to now is 44.1 secs Computing kpt #: 7 total cpu time spent up to now is 44.5 secs Computing kpt #: 8 total cpu time spent up to now is 44.9 secs Computing kpt #: 9 total cpu time spent up to now is 45.3 secs Computing kpt #: 10 total cpu time spent up to now is 45.8 secs Computing kpt #: 11 total cpu time spent up to now is 46.2 secs Computing kpt #: 12 total cpu time spent up to now is 46.6 secs Computing kpt #: 13 total cpu time spent up to now is 47.0 secs Computing kpt #: 14 total cpu time spent up to now is 47.4 secs Computing kpt #: 15 total cpu time spent up to now is 47.8 secs Computing kpt #: 16 total cpu time spent up to now is 48.3 secs Computing kpt #: 17 total cpu time spent up to now is 48.7 secs Computing kpt #: 18 total cpu time spent up to now is 49.1 secs Computing kpt #: 19 total cpu time spent up to now is 49.5 secs Computing kpt #: 20 total cpu time spent up to now is 50.0 secs Computing kpt #: 21 total cpu time spent up to now is 50.4 secs Computing kpt #: 22 total cpu time spent up to now is 50.8 secs Computing kpt #: 23 total cpu time spent up to now is 51.2 secs Computing kpt #: 24 total cpu time spent up to now is 51.6 secs Computing kpt #: 25 total cpu time spent up to now is 52.0 secs Computing kpt #: 26 total cpu time spent up to now is 52.4 secs Computing kpt #: 27 total cpu time spent up to now is 52.8 secs Computing kpt #: 28 total cpu time spent up to now is 53.2 secs Computing kpt #: 29 total cpu time spent up to now is 53.6 secs Computing kpt #: 30 total cpu time spent up to now is 54.0 secs Computing kpt #: 31 total cpu time spent up to now is 54.4 secs Computing kpt #: 32 total cpu time spent up to now is 55.4 secs Computing kpt #: 33 total cpu time spent up to now is 56.5 secs Computing kpt #: 34 total cpu time spent up to now is 57.8 secs Computing kpt #: 35 total cpu time spent up to now is 58.9 secs Computing kpt #: 36 total cpu time spent up to now is 59.4 secs Computing kpt #: 37 total cpu time spent up to now is 60.0 secs Computing kpt #: 38 total cpu time spent up to now is 60.5 secs Computing kpt #: 39 total cpu time spent up to now is 61.0 secs Computing kpt #: 40 total cpu time spent up to now is 61.5 secs Computing kpt #: 41 total cpu time spent up to now is 62.1 secs Computing kpt #: 42 total cpu time spent up to now is 62.8 secs Computing kpt #: 43 total cpu time spent up to now is 63.4 secs Computing kpt #: 44 total cpu time spent up to now is 63.9 secs Computing kpt #: 45 total cpu time spent up to now is 64.5 secs Computing kpt #: 46 total cpu time spent up to now is 65.1 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kpt #: 78 total cpu time spent up to now is 84.3 secs Computing kpt #: 79 total cpu time spent up to now is 85.3 secs Computing kpt #: 80 total cpu time spent up to now is 86.4 secs Computing kpt #: 81 total cpu time spent up to now is 87.3 secs Computing kpt #: 82 total cpu time spent up to now is 88.0 secs Computing kpt #: 83 total cpu time spent up to now is 88.4 secs Computing kpt #: 84 total cpu time spent up to now is 89.0 secs Computing kpt #: 85 total cpu time spent up to now is 89.8 secs Computing kpt #: 86 total cpu time spent up to now is 90.3 secs Computing kpt #: 87 total cpu time spent up to now is 90.9 secs Computing kpt #: 88 total cpu time spent up to now is 91.9 secs Computing kpt #: 89 total cpu time spent up to now is 92.4 secs Computing kpt #: 90 total cpu time spent up to now is 92.9 secs Computing kpt #: 91 total cpu time spent up to now is 93.3 secs Computing kpt #: 92 total cpu time spent up to now is 93.9 secs Computing kpt #: 93 total cpu time spent up to now is 94.3 secs Computing kpt #: 94 total cpu time spent up to now is 94.8 secs Computing kpt #: 95 total cpu time spent up to now is 95.3 secs Computing kpt #: 96 total cpu time spent up to now is 95.8 secs Computing kpt #: 97 total cpu time spent up to now is 96.2 secs Computing kpt #: 98 total cpu time spent up to now is 96.8 secs Computing kpt #: 99 total cpu time spent up to now is 97.2 secs Computing kpt #: 100 total cpu time spent up to now is 97.8 secs Computing kpt #: 101 total cpu time spent up to now is 98.2 secs Computing kpt #: 102 total cpu time spent up to now is 98.7 secs Computing kpt #: 103 total cpu time spent up to now is 99.7 secs Computing kpt #: 104 total cpu time spent up to now is 100.8 secs Computing kpt #: 105 total cpu time spent up to now is 101.9 secs Computing kpt #: 106 total cpu time spent up to now is 102.3 secs Computing kpt #: 107 total cpu time spent up to now is 102.9 secs Computing kpt #: 108 total cpu time spent up to now is 103.3 secs Computing kpt 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total cpu time spent up to now is 113.0 secs Computing kpt #: 125 total cpu time spent up to now is 114.4 secs Computing kpt #: 126 total cpu time spent up to now is 115.9 secs Computing kpt #: 127 total cpu time spent up to now is 117.5 secs Computing kpt #: 128 total cpu time spent up to now is 118.1 secs Computing kpt #: 129 total cpu time spent up to now is 118.8 secs Computing kpt #: 130 total cpu time spent up to now is 119.3 secs Computing kpt #: 131 total cpu time spent up to now is 119.9 secs Computing kpt #: 132 total cpu time spent up to now is 120.4 secs Computing kpt #: 133 total cpu time spent up to now is 121.0 secs Computing kpt #: 134 total cpu time spent up to now is 121.5 secs Computing kpt #: 135 total cpu time spent up to now is 122.0 secs Computing kpt #: 136 total cpu time spent up to now is 122.4 secs Computing kpt #: 137 total cpu time spent up to now is 122.9 secs Computing kpt #: 138 total cpu time spent up to now is 123.4 secs Computing kpt #: 139 total cpu 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up to now is 130.8 secs Computing kpt #: 155 total cpu time spent up to now is 131.2 secs Computing kpt #: 156 total cpu time spent up to now is 131.7 secs Computing kpt #: 157 total cpu time spent up to now is 132.5 secs Computing kpt #: 158 total cpu time spent up to now is 133.5 secs Computing kpt #: 159 total cpu time spent up to now is 134.4 secs Computing kpt #: 160 total cpu time spent up to now is 135.5 secs Computing kpt #: 161 total cpu time spent up to now is 136.6 secs Computing kpt #: 162 total cpu time spent up to now is 137.3 secs Computing kpt #: 163 total cpu time spent up to now is 137.9 secs Computing kpt #: 164 total cpu time spent up to now is 138.4 secs Computing kpt #: 165 total cpu time spent up to now is 139.0 secs Computing kpt #: 166 total cpu time spent up to now is 139.6 secs Computing kpt #: 167 total cpu time spent up to now is 140.2 secs Computing kpt #: 168 total cpu time spent up to now is 140.7 secs Computing kpt #: 169 total cpu time spent up to now is 141.5 secs Computing kpt #: 170 total cpu time spent up to now is 142.3 secs Computing kpt #: 171 total cpu time spent up to now is 142.9 secs Computing kpt #: 172 total cpu time spent up to now is 143.4 secs Computing kpt #: 173 total cpu time spent up to now is 144.2 secs Computing kpt #: 174 total cpu time spent up to now is 145.0 secs Computing kpt #: 175 total cpu time spent up to now is 145.8 secs Computing kpt #: 176 total cpu time spent up to now is 146.7 secs Computing kpt #: 177 total cpu time spent up to now is 147.4 secs Computing kpt #: 178 total cpu time spent up to now is 148.0 secs Computing kpt #: 179 total cpu time spent up to now is 148.5 secs Computing kpt #: 180 total cpu time spent up to now is 149.0 secs Computing kpt #: 181 total cpu time spent up to now is 149.6 secs Computing kpt #: 182 total cpu time spent up to now is 150.2 secs Computing kpt #: 183 total cpu time spent up to now is 150.6 secs Computing kpt #: 184 total cpu time spent up to now is 151.3 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Computing kpt #: 200 total cpu time spent up to now is 164.1 secs Computing kpt #: 201 total cpu time spent up to now is 164.6 secs Computing kpt #: 202 total cpu time spent up to now is 165.1 secs Computing kpt #: 203 total cpu time spent up to now is 165.6 secs Computing kpt #: 204 total cpu time spent up to now is 166.9 secs Computing kpt #: 205 total cpu time spent up to now is 167.6 secs Computing kpt #: 206 total cpu time spent up to now is 168.1 secs Computing kpt #: 207 total cpu time spent up to now is 168.6 secs Computing kpt #: 208 total cpu time spent up to now is 169.1 secs Computing kpt #: 209 total cpu time spent up to now is 169.5 secs Computing kpt #: 210 total cpu time spent up to now is 170.0 secs Computing kpt #: 211 total cpu time spent up to now is 170.5 secs Computing kpt #: 212 total cpu time spent up to now is 171.1 secs Computing kpt #: 213 total cpu time spent up to now is 172.0 secs Computing kpt #: 214 total cpu time spent up to now is 172.6 secs Computing kpt #: 215 total cpu time spent up to now is 173.0 secs Computing kpt #: 216 total cpu time spent up to now is 173.5 secs Computing kpt #: 217 total cpu time spent up to now is 174.0 secs Computing kpt #: 218 total cpu time spent up to now is 174.4 secs Computing kpt #: 219 total cpu time spent up to now is 174.9 secs Computing kpt #: 220 total cpu time spent up to now is 175.4 secs Computing kpt #: 221 total cpu time spent up to now is 175.8 secs Computing kpt #: 222 total cpu time spent up to now is 176.3 secs Computing kpt #: 223 total cpu time spent up to now is 176.8 secs Computing kpt #: 224 total cpu time spent up to now is 178.1 secs Computing kpt #: 225 total cpu time spent up to now is 179.2 secs Computing kpt #: 226 total cpu time spent up to now is 180.5 secs Computing kpt #: 227 total cpu time spent up to now is 181.5 secs Computing kpt #: 228 total cpu time spent up to now is 182.4 secs Computing kpt #: 229 total cpu time spent up to now is 182.9 secs Computing kpt #: 230 total cpu time spent up to now is 183.3 secs Computing kpt #: 231 total cpu time spent up to now is 183.9 secs Computing kpt #: 232 total cpu time spent up to now is 184.4 secs Computing kpt #: 233 total cpu time spent up to now is 185.0 secs Computing kpt #: 234 total cpu time spent up to now is 185.4 secs Computing kpt #: 235 total cpu time spent up to now is 185.8 secs Computing kpt #: 236 total cpu time spent up to now is 186.3 secs Computing kpt #: 237 total cpu time spent up to now is 186.8 secs Computing kpt #: 238 total cpu time spent up to now is 187.2 secs Computing kpt #: 239 total cpu time spent up to now is 187.7 secs Computing kpt #: 240 total cpu time spent up to now is 188.1 secs Computing kpt #: 241 total cpu time spent up to now is 188.6 secs Computing kpt #: 242 total cpu time spent up to now is 189.1 secs Computing kpt #: 243 total cpu time spent up to now is 189.7 secs Computing kpt #: 244 total cpu time spent up to now is 190.6 secs Computing kpt #: 245 total cpu time spent up to now is 191.3 secs Computing kpt #: 246 total cpu time spent up to now is 191.7 secs Computing kpt #: 247 total cpu time spent up to now is 192.7 secs Computing kpt #: 248 total cpu time spent up to now is 193.4 secs Computing kpt #: 249 total cpu time spent up to now is 194.2 secs Computing kpt #: 250 total cpu time spent up to now is 194.8 secs Computing kpt #: 251 total cpu time spent up to now is 195.4 secs Computing kpt #: 252 total cpu time spent up to now is 195.9 secs Computing kpt #: 253 total cpu time spent up to now is 197.1 secs Computing kpt #: 254 total cpu time spent up to now is 198.3 secs Computing kpt #: 255 total cpu time spent up to now is 199.6 secs Computing kpt #: 256 total cpu time spent up to now is 200.7 secs Computing kpt #: 257 total cpu time spent up to now is 201.2 secs Computing kpt #: 258 total cpu time spent up to now is 201.7 secs Computing kpt #: 259 total cpu time spent up to now is 202.2 secs Computing kpt #: 260 total cpu time spent up to now is 202.8 secs Computing kpt #: 261 total cpu time spent up to now is 203.4 secs Computing kpt #: 262 total cpu time spent up to now is 203.8 secs Computing kpt #: 263 total cpu time spent up to now is 204.2 secs Computing kpt #: 264 total cpu time spent up to now is 204.6 secs Computing kpt #: 265 total cpu time spent up to now is 205.0 secs Computing kpt #: 266 total cpu time spent up to now is 205.4 secs Computing kpt #: 267 total cpu time spent up to now is 205.9 secs Computing kpt #: 268 total cpu time spent up to now is 206.3 secs Computing kpt #: 269 total cpu time spent up to now is 206.8 secs Computing kpt #: 270 total cpu time spent up to now is 207.2 secs Computing kpt #: 271 total cpu time spent up to now is 207.6 secs Computing kpt #: 272 total cpu time spent up to now is 208.0 secs Computing kpt #: 273 total cpu time spent up to now is 208.4 secs Computing kpt #: 274 total cpu time spent up to now is 208.9 secs Computing kpt #: 275 total cpu time spent up to now is 209.3 secs Computing kpt #: 276 total cpu time spent up to now is 209.7 secs Computing kpt #: 277 total cpu time spent up to now is 210.2 secs Computing kpt #: 278 total cpu time spent up to now is 210.6 secs Computing kpt #: 279 total cpu time spent up to now is 211.0 secs Computing kpt #: 280 total cpu time spent up to now is 211.4 secs Computing kpt #: 281 total cpu time spent up to now is 211.9 secs Computing kpt #: 282 total cpu time spent up to now is 212.5 secs Computing kpt #: 283 total cpu time spent up to now is 212.9 secs Computing kpt #: 284 total cpu time spent up to now is 213.3 secs Computing kpt #: 285 total cpu time spent up to now is 213.7 secs Computing kpt #: 286 total cpu time spent up to now is 214.1 secs Computing kpt #: 287 total cpu time spent up to now is 214.5 secs Computing kpt #: 288 total cpu time spent up to now is 214.8 secs Computing kpt #: 289 total cpu time spent up to now is 215.5 secs Computing kpt #: 290 total cpu time spent up to now is 216.5 secs Computing kpt #: 291 total cpu time spent up to now is 217.6 secs Computing kpt #: 292 total cpu time spent up to now is 218.6 secs Computing kpt #: 293 total cpu time spent up to now is 219.3 secs Computing kpt #: 294 total cpu time spent up to now is 219.7 secs Computing kpt #: 295 total cpu time spent up to now is 220.1 secs Computing kpt #: 296 total cpu time spent up to now is 220.4 secs Computing kpt #: 297 total cpu time spent up to now is 220.9 secs Computing kpt #: 298 total cpu time spent up to now is 221.3 secs Computing kpt #: 299 total cpu time spent up to now is 221.8 secs Computing kpt #: 300 total cpu time spent up to now is 222.2 secs Computing kpt #: 301 total cpu time spent up to now is 222.6 secs Computing kpt #: 302 total cpu time spent up to now is 223.0 secs Computing kpt #: 303 total cpu time spent up to now is 223.3 secs Computing kpt #: 304 total cpu time spent up to now is 223.7 secs Computing kpt #: 305 total cpu time spent up to now is 224.1 secs Computing kpt #: 306 total cpu time spent up to now is 224.5 secs Computing kpt #: 307 total cpu time spent up to now is 224.9 secs Computing kpt #: 308 total cpu time spent up to now is 225.3 secs Computing kpt #: 309 total cpu time spent up to now is 225.6 secs Computing kpt #: 310 total cpu time spent up to now is 226.0 secs Computing kpt #: 311 total cpu time spent up to now is 226.4 secs Computing kpt #: 312 total cpu time spent up to now is 226.8 secs Computing kpt #: 313 total cpu time spent up to now is 227.2 secs Computing kpt #: 314 total cpu time spent up to now is 227.6 secs Computing kpt #: 315 total cpu time spent up to now is 228.0 secs Computing kpt #: 316 total cpu time spent up to now is 228.3 secs Computing kpt #: 317 total cpu time spent up to now is 228.7 secs Computing kpt #: 318 total cpu time spent up to now is 229.1 secs Computing kpt #: 319 total cpu time spent up to now is 229.7 secs Computing kpt #: 320 total cpu time spent up to now is 230.4 secs Computing kpt #: 321 total cpu time spent up to now is 230.9 secs Computing kpt #: 322 total cpu time spent up to now is 231.7 secs Computing kpt #: 323 total cpu time spent up to now is 232.6 secs Computing kpt #: 324 total cpu time spent up to now is 233.6 secs Computing kpt #: 325 total cpu time spent up to now is 234.6 secs Computing kpt #: 326 total cpu time spent up to now is 235.6 secs Computing kpt #: 327 total cpu time spent up to now is 236.5 secs Computing kpt #: 328 total cpu time spent up to now is 236.9 secs Computing kpt #: 329 total cpu time spent up to now is 237.5 secs Computing kpt #: 330 total cpu time spent up to now is 237.9 secs Computing kpt #: 331 total cpu time spent up to now is 238.3 secs Computing kpt #: 332 total cpu time spent up to now is 238.7 secs Computing kpt #: 333 total cpu time spent up to now is 239.1 secs Computing kpt #: 334 total cpu time spent up to now is 239.5 secs Computing kpt #: 335 total cpu time spent up to now is 239.9 secs Computing kpt #: 336 total cpu time spent up to now is 240.3 secs Computing kpt #: 337 total cpu time spent up to now is 240.7 secs Computing kpt #: 338 total cpu time spent up to now is 241.1 secs Computing kpt #: 339 total cpu time spent up to now is 241.6 secs Computing kpt #: 340 total cpu time spent up to now is 242.1 secs Computing kpt #: 341 total cpu time spent up to now is 242.7 secs Computing kpt #: 342 total cpu time spent up to now is 243.6 secs Computing kpt #: 343 total cpu time spent up to now is 244.4 secs Computing kpt #: 344 total cpu time spent up to now is 245.0 secs Computing kpt #: 345 total cpu time spent up to now is 245.6 secs Computing kpt #: 346 total cpu time spent up to now is 246.2 secs Computing kpt #: 347 total cpu time spent up to now is 246.8 secs Computing kpt #: 348 total cpu time spent up to now is 247.5 secs Computing kpt #: 349 total cpu time spent up to now is 248.1 secs Computing kpt #: 350 total cpu time spent up to now is 248.7 secs Computing kpt #: 351 total cpu time spent up to now is 249.3 secs Computing kpt #: 352 total cpu time spent up to now is 249.7 secs Computing kpt #: 353 total cpu time spent up to now is 250.2 secs Computing kpt #: 354 total cpu time spent up to now is 250.6 secs Computing kpt #: 355 total cpu time spent up to now is 251.3 secs Computing kpt #: 356 total cpu time spent up to now is 252.1 secs Computing kpt #: 357 total cpu time spent up to now is 253.3 secs Computing kpt #: 358 total cpu time spent up to now is 254.6 secs Computing kpt #: 359 total cpu time spent up to now is 255.7 secs Computing kpt #: 360 total cpu time spent up to now is 256.3 secs Computing kpt #: 361 total cpu time spent up to now is 256.8 secs Computing kpt #: 362 total cpu time spent up to now is 257.4 secs Computing kpt #: 363 total cpu time spent up to now is 258.1 secs Computing kpt #: 364 total cpu time spent up to now is 258.7 secs Computing kpt #: 365 total cpu time spent up to now is 259.4 secs Computing kpt #: 366 total cpu time spent up to now is 260.1 secs Computing kpt #: 367 total cpu time spent up to now is 261.1 secs Computing kpt #: 368 total cpu time spent up to now is 261.9 secs Computing kpt #: 369 total cpu time spent up to now is 262.4 secs Computing kpt #: 370 total cpu time spent up to now is 263.0 secs Computing kpt #: 371 total cpu time spent up to now is 263.6 secs Computing kpt #: 372 total cpu time spent up to now is 264.2 secs Computing kpt #: 373 total cpu time spent up to now is 264.8 secs Computing kpt #: 374 total cpu time spent up to now is 265.4 secs Computing kpt #: 375 total cpu time spent up to now is 266.2 secs Computing kpt #: 376 total cpu time spent up to now is 266.9 secs Computing kpt #: 377 total cpu time spent up to now is 267.4 secs Computing kpt #: 378 total cpu time spent up to now is 268.0 secs Computing kpt #: 379 total cpu time spent up to now is 268.5 secs Computing kpt #: 380 total cpu time spent up to now is 269.0 secs Computing kpt #: 381 total cpu time spent up to now is 269.5 secs Computing kpt #: 382 total cpu time spent up to now is 270.5 secs Computing kpt #: 383 total cpu time spent up to now is 271.9 secs Computing kpt #: 384 total cpu time spent up to now is 273.1 secs Computing kpt #: 385 total cpu time spent up to now is 274.1 secs Computing kpt #: 386 total cpu time spent up to now is 274.8 secs Computing kpt #: 387 total cpu time spent up to now is 275.2 secs Computing kpt #: 388 total cpu time spent up to now is 275.8 secs Computing kpt #: 389 total cpu time spent up to now is 276.2 secs Computing kpt #: 390 total cpu time spent up to now is 276.6 secs Computing kpt #: 391 total cpu time spent up to now is 277.5 secs Computing kpt #: 392 total cpu time spent up to now is 277.9 secs Computing kpt #: 393 total cpu time spent up to now is 278.5 secs Computing kpt #: 394 total cpu time spent up to now is 278.9 secs Computing kpt #: 395 total cpu time spent up to now is 279.3 secs Computing kpt #: 396 total cpu time spent up to now is 279.7 secs Computing kpt #: 397 total cpu time spent up to now is 280.1 secs Computing kpt #: 398 total cpu time spent up to now is 280.5 secs Computing kpt #: 399 total cpu time spent up to now is 280.9 secs Computing kpt #: 400 total cpu time spent up to now is 281.4 secs Computing kpt #: 401 total cpu time spent up to now is 281.8 secs Computing kpt #: 402 total cpu time spent up to now is 282.4 secs Computing kpt #: 403 total cpu time spent up to now is 282.9 secs Computing kpt #: 404 total cpu time spent up to now is 283.3 secs Computing kpt #: 405 total cpu time spent up to now is 283.8 secs Computing kpt #: 406 total cpu time spent up to now is 284.2 secs Computing kpt #: 407 total cpu time spent up to now is 284.9 secs Computing kpt #: 408 total cpu time spent up to now is 285.3 secs Computing kpt #: 409 total cpu time spent up to now is 285.9 secs Computing kpt #: 410 total cpu time spent up to now is 286.4 secs Computing kpt #: 411 total cpu time spent up to now is 287.1 secs Computing kpt #: 412 total cpu time spent up to now is 287.5 secs Computing kpt #: 413 total cpu time spent up to now is 287.9 secs Computing kpt #: 414 total cpu time spent up to now is 288.3 secs Computing kpt #: 415 total cpu time spent up to now is 288.6 secs Computing kpt #: 416 total cpu time spent up to now is 289.1 secs Computing kpt #: 417 total cpu time spent up to now is 290.5 secs Computing kpt #: 418 total cpu time spent up to now is 291.6 secs Computing kpt #: 419 total cpu time spent up to now is 292.6 secs Computing kpt #: 420 total cpu time spent up to now is 293.5 secs Computing kpt #: 421 total cpu time spent up to now is 294.4 secs Computing kpt #: 422 total cpu time spent up to now is 294.8 secs Computing kpt #: 423 total cpu time spent up to now is 295.3 secs Computing kpt #: 424 total cpu time spent up to now is 295.8 secs Computing kpt #: 425 total cpu time spent up to now is 296.1 secs Computing kpt #: 426 total cpu time spent up to now is 296.6 secs Computing kpt #: 427 total cpu time spent up to now is 297.2 secs Computing kpt #: 428 total cpu time spent up to now is 297.5 secs Computing kpt #: 429 total cpu time spent up to now is 297.9 secs Computing kpt #: 430 total cpu time spent up to now is 298.3 secs Computing kpt #: 431 total cpu time spent up to now is 298.6 secs Computing kpt #: 432 total cpu time spent up to now is 299.0 secs Computing kpt #: 433 total cpu time spent up to now is 299.4 secs Computing kpt #: 434 total cpu time spent up to now is 299.8 secs Computing kpt #: 435 total cpu time spent up to now is 300.2 secs Computing kpt #: 436 total cpu time spent up to now is 300.9 secs Computing kpt #: 437 total cpu time spent up to now is 301.7 secs Computing kpt #: 438 total cpu time spent up to now is 302.3 secs Computing kpt #: 439 total cpu time spent up to now is 303.0 secs Computing kpt #: 440 total cpu time spent up to now is 303.4 secs Computing kpt #: 441 total cpu time spent up to now is 303.8 secs Computing kpt #: 442 total cpu time spent up to now is 304.2 secs Computing kpt #: 443 total cpu time spent up to now is 304.7 secs Computing kpt #: 444 total cpu time spent up to now is 305.1 secs Computing kpt #: 445 total cpu time spent up to now is 305.5 secs Computing kpt #: 446 total cpu time spent up to now is 305.9 secs Computing kpt #: 447 total cpu time spent up to now is 306.3 secs Computing kpt #: 448 total cpu time spent up to now is 306.9 secs Computing kpt #: 449 total cpu time spent up to now is 307.5 secs Computing kpt #: 450 total cpu time spent up to now is 308.0 secs Computing kpt #: 451 total cpu time spent up to now is 308.6 secs Computing kpt #: 452 total cpu time spent up to now is 309.3 secs Computing kpt #: 453 total cpu time spent up to now is 309.8 secs Computing kpt #: 454 total cpu time spent up to now is 310.3 secs Computing kpt #: 455 total cpu time spent up to now is 310.8 secs Computing kpt #: 456 total cpu time spent up to now is 311.3 secs Computing kpt #: 457 total cpu time spent up to now is 311.7 secs Computing kpt #: 458 total cpu time spent up to now is 312.4 secs Computing kpt #: 459 total cpu time spent up to now is 313.8 secs Computing kpt #: 460 total cpu time spent up to now is 315.1 secs Computing kpt #: 461 total cpu time spent up to now is 316.5 secs Computing kpt #: 462 total cpu time spent up to now is 318.3 secs Computing kpt #: 463 total cpu time spent up to now is 319.6 secs Computing kpt #: 464 total cpu time spent up to now is 320.7 secs Computing kpt #: 465 total cpu time spent up to now is 321.3 secs Computing kpt #: 466 total cpu time spent up to now is 322.4 secs Computing kpt #: 467 total cpu time spent up to now is 323.1 secs Computing kpt #: 468 total cpu time spent up to now is 324.1 secs Computing kpt #: 469 total cpu time spent up to now is 325.0 secs Computing kpt #: 470 total cpu time spent up to now is 325.7 secs Computing kpt #: 471 total cpu time spent up to now is 326.3 secs Computing kpt #: 472 total cpu time spent up to now is 326.8 secs Computing kpt #: 473 total cpu time spent up to now is 327.4 secs Computing kpt #: 474 total cpu time spent up to now is 328.0 secs Computing kpt #: 475 total cpu time spent up to now is 328.6 secs Computing kpt #: 476 total cpu time spent up to now is 329.5 secs Computing kpt #: 477 total cpu time spent up to now is 330.3 secs Computing kpt #: 478 total cpu time spent up to now is 331.1 secs Computing kpt #: 479 total cpu time spent up to now is 332.1 secs Computing kpt #: 480 total cpu time spent up to now is 334.0 secs Computing kpt #: 481 total cpu time spent up to now is 335.7 secs Computing kpt #: 482 total cpu time spent up to now is 336.5 secs Computing kpt #: 483 total cpu time spent up to now is 337.0 secs Computing kpt #: 484 total cpu time spent up to now is 337.6 secs Computing kpt #: 485 total cpu time spent up to now is 338.6 secs Computing kpt #: 486 total cpu time spent up to now is 339.5 secs Computing kpt #: 487 total cpu time spent up to now is 340.2 secs Computing kpt #: 488 total cpu time spent up to now is 340.7 secs Computing kpt #: 489 total cpu time spent up to now is 341.2 secs Computing kpt #: 490 total cpu time spent up to now is 341.7 secs Computing kpt #: 491 total cpu time spent up to now is 342.3 secs Computing kpt #: 492 total cpu time spent up to now is 343.0 secs Computing kpt #: 493 total cpu time spent up to now is 343.6 secs Computing kpt #: 494 total cpu time spent up to now is 344.2 secs Computing kpt #: 495 total cpu time spent up to now is 345.3 secs Computing kpt #: 496 total cpu time spent up to now is 346.9 secs Computing kpt #: 497 total cpu time spent up to now is 348.8 secs Computing kpt #: 498 total cpu time spent up to now is 349.4 secs Computing kpt #: 499 total cpu time spent up to now is 350.0 secs Computing kpt #: 500 total cpu time spent up to now is 350.6 secs Computing kpt #: 501 total cpu time spent up to now is 351.2 secs Computing kpt #: 502 total cpu time spent up to now is 351.9 secs Computing kpt #: 503 total cpu time spent up to now is 352.5 secs Computing kpt #: 504 total cpu time spent up to now is 353.1 secs Computing kpt #: 505 total cpu time spent up to now is 353.7 secs Computing kpt #: 506 total cpu time spent up to now is 354.4 secs Computing kpt #: 507 total cpu time spent up to now is 355.1 secs Computing kpt #: 508 total cpu time spent up to now is 355.8 secs Computing kpt #: 509 total cpu time spent up to now is 356.6 secs Computing kpt #: 510 total cpu time spent up to now is 357.3 secs Computing kpt #: 511 total cpu time spent up to now is 357.9 secs Computing kpt #: 512 total cpu time spent up to now is 358.5 secs Computing kpt #: 513 total cpu time spent up to now is 359.1 secs Computing kpt #: 514 total cpu time spent up to now is 359.8 secs Computing kpt #: 515 total cpu time spent up to now is 360.9 secs Computing kpt #: 516 total cpu time spent up to now is 363.1 secs Computing kpt #: 517 total cpu time spent up to now is 364.5 secs Computing kpt #: 518 total cpu time spent up to now is 365.2 secs Computing kpt #: 519 total cpu time spent up to now is 365.8 secs Computing kpt #: 520 total cpu time spent up to now is 366.3 secs Computing kpt #: 521 total cpu time spent up to now is 366.8 secs Computing kpt #: 522 total cpu time spent up to now is 367.3 secs Computing kpt #: 523 total cpu time spent up to now is 367.8 secs Computing kpt #: 524 total cpu time spent up to now is 368.3 secs Computing kpt #: 525 total cpu time spent up to now is 368.8 secs Computing kpt #: 526 total cpu time spent up to now is 369.2 secs Computing kpt #: 527 total cpu time spent up to now is 369.8 secs Computing kpt #: 528 total cpu time spent up to now is 370.4 secs Computing kpt #: 529 total cpu time spent up to now is 370.9 secs Computing kpt #: 530 total cpu time spent up to now is 371.4 secs Computing kpt #: 531 total cpu time spent up to now is 371.9 secs Computing kpt #: 532 total cpu time spent up to now is 373.0 secs Computing kpt #: 533 total cpu time spent up to now is 373.7 secs Computing kpt #: 534 total cpu time spent up to now is 374.3 secs Computing kpt #: 535 total cpu time spent up to now is 374.8 secs Computing kpt #: 536 total cpu time spent up to now is 375.3 secs ethr = 5.00E-11, avg # of iterations = 24.0 total cpu time spent up to now is 375.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2341 -1.2341 6.1741 6.1741 6.5797 6.5797 9.6502 9.6502 10.3146 10.3146 10.5793 10.5793 12.7184 12.7184 13.5693 13.5693 13.7662 13.7662 14.2941 14.2941 k = 0.0076-0.0099 0.0104 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9707 -21.9707 -1.2326 -1.2326 6.1745 6.1745 6.5810 6.5810 9.6457 9.6457 10.3147 10.3147 10.5766 10.5766 12.7143 12.7143 13.5693 13.5693 13.7521 13.7521 14.2833 14.2833 k = 0.0152-0.0199 0.0208 ( 2041 PWs) bands (ev): -46.0022 -46.0022 -22.6729 -22.6729 -22.0473 -22.0473 -21.9708 -21.9708 -1.2282 -1.2282 6.1757 6.1757 6.5850 6.5850 9.6322 9.6322 10.3152 10.3152 10.5685 10.5685 12.7021 12.7021 13.5691 13.5691 13.7140 13.7140 14.2547 14.2547 k = 0.0227-0.0298 0.0312 ( 2039 PWs) bands (ev): -46.0022 -46.0022 -22.6730 -22.6730 -22.0474 -22.0474 -21.9711 -21.9711 -1.2209 -1.2209 6.1778 6.1778 6.5915 6.5915 9.6100 9.6100 10.3161 10.3161 10.5550 10.5550 12.6819 12.6819 13.5688 13.5688 13.6612 13.6612 14.2156 14.2156 k = 0.0303-0.0398 0.0416 ( 2039 PWs) bands (ev): -46.0021 -46.0021 -22.6732 -22.6732 -22.0475 -22.0475 -21.9716 -21.9716 -1.2106 -1.2106 6.1807 6.1807 6.6007 6.6007 9.5793 9.5793 10.3172 10.3172 10.5362 10.5362 12.6537 12.6537 13.5677 13.5677 13.6021 13.6021 14.1723 14.1723 k = 0.0379-0.0497 0.0520 ( 2043 PWs) bands (ev): -46.0020 -46.0020 -22.6735 -22.6735 -22.0476 -22.0476 -21.9722 -21.9722 -1.1974 -1.1974 6.1844 6.1844 6.6125 6.6125 9.5407 9.5407 10.3187 10.3187 10.5123 10.5123 12.6179 12.6179 13.5371 13.5371 13.5704 13.5704 14.1283 14.1283 k = 0.0455-0.0596 0.0624 ( 2039 PWs) bands (ev): -46.0019 -46.0019 -22.6738 -22.6738 -22.0478 -22.0478 -21.9729 -21.9729 -1.1812 -1.1812 6.1889 6.1889 6.6267 6.6267 9.4945 9.4945 10.3205 10.3205 10.4834 10.4834 12.5748 12.5748 13.4771 13.4771 13.5691 13.5691 14.0855 14.0855 k = 0.0530-0.0696 0.0728 ( 2037 PWs) bands (ev): -46.0017 -46.0017 -22.6742 -22.6742 -22.0480 -22.0480 -21.9737 -21.9737 -1.1622 -1.1622 6.1941 6.1941 6.6435 6.6435 9.4415 9.4415 10.3227 10.3227 10.4497 10.4497 12.5246 12.5246 13.4192 13.4192 13.5686 13.5686 14.0447 14.0447 k = 0.0606-0.0795 0.0833 ( 2037 PWs) bands (ev): -46.0015 -46.0015 -22.6746 -22.6746 -22.0482 -22.0482 -21.9747 -21.9747 -1.1402 -1.1402 6.2002 6.2002 6.6628 6.6628 9.3821 9.3821 10.3251 10.3251 10.4114 10.4114 12.4678 12.4678 13.3651 13.3651 13.5680 13.5680 14.0062 14.0062 k = 0.0682-0.0895 0.0937 ( 2039 PWs) bands (ev): -46.0014 -46.0014 -22.6751 -22.6751 -22.0485 -22.0485 -21.9758 -21.9758 -1.1153 -1.1153 6.2071 6.2071 6.6844 6.6844 9.3171 9.3171 10.3275 10.3275 10.3692 10.3692 12.4047 12.4047 13.3154 13.3154 13.5674 13.5674 13.9700 13.9700 k = 0.0758-0.0994 0.1041 ( 2031 PWs) bands (ev): -46.0011 -46.0011 -22.6756 -22.6756 -22.0488 -22.0488 -21.9769 -21.9769 -1.0875 -1.0875 6.2147 6.2147 6.7083 6.7083 9.2471 9.2471 10.3194 10.3194 10.3340 10.3340 12.3360 12.3360 13.2704 13.2704 13.5668 13.5668 13.9360 13.9360 k = 0.0833-0.1093 0.1145 ( 2031 PWs) bands (ev): -46.0009 -46.0009 -22.6762 -22.6762 -22.0491 -22.0491 -21.9783 -21.9783 -1.0568 -1.0568 6.2230 6.2230 6.7345 6.7345 9.1726 9.1726 10.2712 10.2712 10.3355 10.3355 12.2620 12.2620 13.2303 13.2303 13.5660 13.5660 13.9040 13.9040 k = 0.0909-0.1193 0.1249 ( 2031 PWs) bands (ev): -46.0007 -46.0007 -22.6769 -22.6769 -22.0495 -22.0495 -21.9797 -21.9797 -1.0232 -1.0232 6.2320 6.2320 6.7628 6.7628 9.0944 9.0944 10.2180 10.2180 10.3391 10.3391 12.1832 12.1832 13.1950 13.1950 13.5651 13.5651 13.8738 13.8738 k = 0.0985-0.1292 0.1353 ( 2039 PWs) bands (ev): -46.0004 -46.0004 -22.6776 -22.6776 -22.0499 -22.0499 -21.9813 -21.9813 -0.9867 -0.9867 6.2418 6.2418 6.7932 6.7932 9.0129 9.0129 10.1618 10.1618 10.3433 10.3433 12.1003 12.1003 13.1644 13.1644 13.5641 13.5641 13.8452 13.8452 k = 0.1061-0.1391 0.1457 ( 2037 PWs) bands (ev): -46.0001 -46.0001 -22.6784 -22.6784 -22.0503 -22.0503 -21.9830 -21.9830 -0.9473 -0.9473 6.2522 6.2522 6.8254 6.8254 8.9287 8.9287 10.1032 10.1032 10.3478 10.3478 12.0138 12.0138 13.1383 13.1383 13.5630 13.5630 13.8181 13.8181 k = 0.1136-0.1491 0.1561 ( 2031 PWs) bands (ev): -45.9998 -45.9998 -22.6791 -22.6791 -22.0506 -22.0506 -21.9847 -21.9847 -0.9051 -0.9051 6.2633 6.2633 6.8594 6.8594 8.8423 8.8423 10.0425 10.0425 10.3526 10.3526 11.9241 11.9241 13.1165 13.1165 13.5617 13.5617 13.7922 13.7922 k = 0.1212-0.1590 0.1665 ( 2031 PWs) bands (ev): -45.9995 -45.9995 -22.6800 -22.6800 -22.0511 -22.0511 -21.9865 -21.9865 -0.8601 -0.8601 6.2749 6.2749 6.8951 6.8951 8.7541 8.7541 9.9803 9.9803 10.3579 10.3579 11.8318 11.8318 13.0986 13.0986 13.5603 13.5603 13.7673 13.7673 k = 0.1288-0.1690 0.1769 ( 2027 PWs) bands (ev): -45.9991 -45.9991 -22.6809 -22.6809 -22.0515 -22.0515 -21.9884 -21.9884 -0.8122 -0.8122 6.2871 6.2871 6.9322 6.9322 8.6646 8.6646 9.9170 9.9170 10.3634 10.3634 11.7375 11.7375 13.0844 13.0844 13.5586 13.5586 13.7433 13.7433 k = 0.1364-0.1789 0.1873 ( 2029 PWs) bands (ev): -45.9988 -45.9988 -22.6818 -22.6818 -22.0520 -22.0520 -21.9904 -21.9904 -0.7615 -0.7615 6.2998 6.2998 6.9706 6.9706 8.5741 8.5741 9.8528 9.8528 10.3693 10.3693 11.6416 11.6416 13.0735 13.0735 13.5568 13.5568 13.7201 13.7201 k = 0.1439-0.1888 0.1977 ( 2021 PWs) bands (ev): -45.9984 -45.9984 -22.6827 -22.6827 -22.0525 -22.0525 -21.9925 -21.9925 -0.7079 -0.7079 6.3130 6.3130 7.0101 7.0101 8.4830 8.4830 9.7883 9.7883 10.3755 10.3755 11.5445 11.5445 13.0657 13.0657 13.5547 13.5547 13.6975 13.6975 k = 0.1515-0.1988 0.2081 ( 2025 PWs) bands (ev): -45.9980 -45.9980 -22.6838 -22.6838 -22.0530 -22.0530 -21.9947 -21.9947 -0.6516 -0.6516 6.3265 6.3265 7.0504 7.0504 8.3916 8.3916 9.7239 9.7239 10.3821 10.3821 11.4468 11.4468 13.0605 13.0605 13.5524 13.5524 13.6755 13.6755 k = 0.1591-0.2087 0.2185 ( 2027 PWs) bands (ev): -45.9976 -45.9976 -22.6849 -22.6849 -22.0536 -22.0536 -21.9969 -21.9969 -0.5925 -0.5925 6.3404 6.3404 7.0913 7.0913 8.3001 8.3001 9.6598 9.6598 10.3889 10.3889 11.3490 11.3490 13.0578 13.0578 13.5498 13.5498 13.6541 13.6541 k = 0.1667-0.2187 0.2290 ( 2027 PWs) bands (ev): -45.9972 -45.9972 -22.6860 -22.6860 -22.0541 -22.0541 -21.9992 -21.9992 -0.5307 -0.5307 6.3546 6.3546 7.1325 7.1325 8.2088 8.2088 9.5965 9.5965 10.3961 10.3961 11.2512 11.2512 13.0572 13.0572 13.5469 13.5469 13.6331 13.6331 k = 0.1742-0.2286 0.2394 ( 2027 PWs) bands (ev): -45.9967 -45.9967 -22.6871 -22.6871 -22.0547 -22.0547 -22.0015 -22.0015 -0.4661 -0.4661 6.3690 6.3690 7.1737 7.1737 8.1179 8.1179 9.5342 9.5342 10.4036 10.4036 11.1541 11.1541 13.0583 13.0583 13.5435 13.5435 13.6127 13.6127 k = 0.1818-0.2385 0.2498 ( 2035 PWs) bands (ev): -45.9963 -45.9963 -22.6883 -22.6883 -22.0553 -22.0553 -22.0039 -22.0039 -0.3988 -0.3988 6.3835 6.3835 7.2145 7.2145 8.0277 8.0277 9.4733 9.4733 10.4114 10.4114 11.0579 11.0579 13.0608 13.0608 13.5395 13.5395 13.5929 13.5929 k = 0.1894-0.2485 0.2602 ( 2046 PWs) bands (ev): -45.9959 -45.9959 -22.6896 -22.6896 -22.0560 -22.0560 -22.0065 -22.0065 -0.3288 -0.3288 6.3980 6.3980 7.2547 7.2547 7.9383 7.9383 9.4141 9.4141 10.4194 10.4194 10.9630 10.9630 13.0645 13.0645 13.5345 13.5345 13.5742 13.5742 k = 0.1970-0.2584 0.2706 ( 2046 PWs) bands (ev): -45.9954 -45.9954 -22.6909 -22.6909 -22.0566 -22.0566 -22.0089 -22.0089 -0.2561 -0.2561 6.4124 6.4124 7.2937 7.2937 7.8499 7.8499 9.3569 9.3569 10.4278 10.4278 10.8695 10.8695 13.0689 13.0689 13.5274 13.5274 13.5574 13.5574 k = 0.2045-0.2684 0.2810 ( 2050 PWs) bands (ev): -45.9950 -45.9950 -22.6921 -22.6921 -22.0572 -22.0572 -22.0114 -22.0114 -0.1808 -0.1808 6.4266 6.4266 7.3313 7.3313 7.7626 7.7626 9.3019 9.3019 10.4364 10.4364 10.7779 10.7779 13.0739 13.0739 13.5165 13.5165 13.5442 13.5442 k = 0.2121-0.2783 0.2914 ( 2054 PWs) bands (ev): -45.9945 -45.9945 -22.6934 -22.6934 -22.0579 -22.0579 -22.0139 -22.0139 -0.1028 -0.1028 6.4405 6.4405 7.3669 7.3669 7.6765 7.6765 9.2494 9.2494 10.4452 10.4452 10.6882 10.6882 13.0790 13.0790 13.5014 13.5014 13.5351 13.5351 k = 0.2197-0.2882 0.3018 ( 2050 PWs) bands (ev): -45.9940 -45.9940 -22.6947 -22.6947 -22.0585 -22.0585 -22.0164 -22.0164 -0.0223 -0.0223 6.4540 6.4540 7.4000 7.4000 7.5919 7.5919 9.1997 9.1997 10.4542 10.4542 10.6008 10.6008 13.0840 13.0840 13.4840 13.4840 13.5280 13.5280 k = 0.2273-0.2982 0.3122 ( 2050 PWs) bands (ev): -45.9936 -45.9936 -22.6960 -22.6960 -22.0591 -22.0591 -22.0189 -22.0189 0.0609 0.0609 6.4670 6.4670 7.4301 7.4301 7.5089 7.5089 9.1530 9.1530 10.4630 10.4630 10.5159 10.5159 13.0885 13.0885 13.4658 13.4658 13.5214 13.5214 k = 0.2348-0.3081 0.3226 ( 2050 PWs) bands (ev): -45.9931 -45.9931 -22.6973 -22.6973 -22.0598 -22.0598 -22.0214 -22.0214 0.1466 0.1466 6.4793 6.4793 7.4259 7.4259 7.4586 7.4586 9.1096 9.1096 10.4305 10.4305 10.4745 10.4745 13.0922 13.0922 13.4472 13.4472 13.5146 13.5146 k = 0.2424-0.3180 0.3330 ( 2050 PWs) bands (ev): -45.9926 -45.9926 -22.6987 -22.6987 -22.0605 -22.0605 -22.0239 -22.0239 0.2348 0.2348 6.4908 6.4908 7.3467 7.3467 7.4809 7.4809 9.0696 9.0696 10.3499 10.3499 10.4835 10.4835 13.0947 13.0947 13.4286 13.4286 13.5070 13.5070 k = 0.2500-0.3280 0.3434 ( 2046 PWs) bands (ev): -45.9921 -45.9921 -22.7000 -22.7000 -22.0612 -22.0612 -22.0264 -22.0264 0.3255 0.3255 6.5014 6.5014 7.2687 7.2687 7.4997 7.4997 9.0333 9.0333 10.2705 10.2705 10.4933 10.4933 13.0958 13.0958 13.4101 13.4101 13.4981 13.4981 k = 0.2576-0.3379 0.3538 ( 2050 PWs) bands (ev): -45.9916 -45.9916 -22.7014 -22.7014 -22.0619 -22.0619 -22.0288 -22.0288 0.4186 0.4186 6.5109 6.5109 7.1923 7.1923 7.5139 7.5139 9.0009 9.0009 10.1923 10.1923 10.5033 10.5033 13.0951 13.0951 13.3917 13.3917 13.4873 13.4873 k = 0.2652-0.3479 0.3642 ( 2056 PWs) bands (ev): -45.9911 -45.9911 -22.7028 -22.7028 -22.0627 -22.0627 -22.0312 -22.0312 0.5142 0.5142 6.5194 6.5194 7.1179 7.1179 7.5231 7.5231 8.9724 8.9724 10.1151 10.1151 10.5134 10.5134 13.0922 13.0922 13.3735 13.3735 13.4733 13.4733 k = 0.2727-0.3578 0.3747 ( 2056 PWs) bands (ev): -45.9907 -45.9907 -22.7041 -22.7041 -22.0634 -22.0634 -22.0336 -22.0336 0.6121 0.6121 6.5266 6.5266 7.0454 7.0454 7.5270 7.5270 8.9481 8.9481 10.0382 10.0382 10.5237 10.5237 13.0869 13.0869 13.3555 13.3555 13.4546 13.4546 k = 0.2803-0.3677 0.3851 ( 2064 PWs) bands (ev): -45.9902 -45.9902 -22.7055 -22.7055 -22.0642 -22.0642 -22.0359 -22.0359 0.7123 0.7123 6.5325 6.5325 6.9749 6.9749 7.5254 7.5254 8.9280 8.9280 9.9610 9.9610 10.5340 10.5340 13.0788 13.0788 13.3377 13.3377 13.4286 13.4286 k = 0.2879-0.3777 0.3955 ( 2064 PWs) bands (ev): -45.9897 -45.9897 -22.7068 -22.7068 -22.0651 -22.0651 -22.0382 -22.0382 0.8148 0.8148 6.5370 6.5370 6.9065 6.9065 7.5181 7.5181 8.9123 8.9123 9.8827 9.8827 10.5444 10.5444 13.0677 13.0677 13.3201 13.3201 13.3931 13.3931 k = 0.2955-0.3876 0.4059 ( 2062 PWs) bands (ev): -45.9893 -45.9893 -22.7081 -22.7081 -22.0659 -22.0659 -22.0403 -22.0403 0.9195 0.9195 6.5401 6.5401 6.8402 6.8402 7.5052 7.5052 8.9010 8.9010 9.8026 9.8026 10.5548 10.5548 13.0533 13.0533 13.3026 13.3026 13.3483 13.3483 k = 0.3030-0.3976 0.4163 ( 2062 PWs) bands (ev): -45.9888 -45.9888 -22.7095 -22.7095 -22.0668 -22.0668 -22.0423 -22.0423 1.0264 1.0264 6.5418 6.5418 6.7760 6.7760 7.4865 7.4865 8.8940 8.8940 9.7199 9.7199 10.5653 10.5653 13.0353 13.0353 13.2833 13.2833 13.2999 13.2999 k = 0.3106-0.4075 0.4267 ( 2058 PWs) bands (ev): -45.9883 -45.9883 -22.7107 -22.7107 -22.0677 -22.0677 -22.0442 -22.0442 1.1354 1.1354 6.5420 6.5420 6.7140 6.7140 7.4621 7.4621 8.8914 8.8914 9.6343 9.6343 10.5756 10.5756 13.0135 13.0135 13.2437 13.2437 13.2721 13.2721 k = 0.3182-0.4174 0.4371 ( 2058 PWs) bands (ev): -45.9879 -45.9879 -22.7120 -22.7120 -22.0686 -22.0686 -22.0460 -22.0460 1.2463 1.2463 6.5409 6.5409 6.6542 6.6542 7.4322 7.4322 8.8931 8.8931 9.5453 9.5453 10.5860 10.5860 12.9879 12.9879 13.1985 13.1985 13.2552 13.2552 k = 0.3258-0.4274 0.4475 ( 2058 PWs) bands (ev): -45.9875 -45.9875 -22.7132 -22.7132 -22.0697 -22.0697 -22.0477 -22.0477 1.3593 1.3593 6.5384 6.5384 6.5967 6.5967 7.3970 7.3970 8.8990 8.8990 9.4527 9.4527 10.5962 10.5962 12.9585 12.9585 13.1605 13.1605 13.2394 13.2394 k = 0.3333-0.4373 0.4579 ( 2062 PWs) bands (ev): -45.9871 -45.9871 -22.7145 -22.7145 -22.0708 -22.0708 -22.0493 -22.0493 1.4741 1.4741 6.5345 6.5345 6.5416 6.5416 7.3564 7.3564 8.9089 8.9089 9.3569 9.3569 10.6063 10.6063 12.9252 12.9252 13.1315 13.1315 13.2241 13.2241 k = 0.3409-0.4473 0.4683 ( 2062 PWs) bands (ev): -45.9866 -45.9866 -22.7157 -22.7157 -22.0719 -22.0719 -22.0507 -22.0507 1.5906 1.5906 6.4884 6.4884 6.5300 6.5300 7.3106 7.3106 8.9227 8.9227 9.2581 9.2581 10.6162 10.6162 12.8881 12.8881 13.1118 13.1118 13.2094 13.2094 k = 0.3485-0.4572 0.4787 ( 2062 PWs) bands (ev): -45.9862 -45.9862 -22.7168 -22.7168 -22.0731 -22.0731 -22.0521 -22.0521 1.7087 1.7087 6.4378 6.4378 6.5241 6.5241 7.2598 7.2598 8.9400 8.9400 9.1570 9.1570 10.6260 10.6260 12.8475 12.8475 13.1005 13.1005 13.1953 13.1953 k = 0.3561-0.4671 0.4891 ( 2062 PWs) bands (ev): -45.9859 -45.9859 -22.7179 -22.7179 -22.0743 -22.0743 -22.0532 -22.0532 1.8284 1.8284 6.3895 6.3895 6.5174 6.5174 7.2038 7.2038 8.9608 8.9608 9.0546 9.0546 10.6355 10.6355 12.8035 12.8035 13.0967 13.0967 13.1817 13.1817 k = 0.3636-0.4771 0.4995 ( 2060 PWs) bands (ev): -45.9855 -45.9855 -22.7190 -22.7190 -22.0755 -22.0755 -22.0543 -22.0543 1.9494 1.9494 6.3436 6.3436 6.5099 6.5099 7.1429 7.1429 8.9515 8.9515 8.9850 8.9850 10.6448 10.6448 12.7563 12.7563 13.0986 13.0986 13.1686 13.1686 k = 0.3712-0.4870 0.5099 ( 2060 PWs) bands (ev): -45.9851 -45.9851 -22.7201 -22.7201 -22.0767 -22.0767 -22.0553 -22.0553 2.0715 2.0715 6.3001 6.3001 6.5018 6.5018 7.0768 7.0768 8.8495 8.8495 9.0115 9.0115 10.6538 10.6538 12.7063 12.7063 13.1046 13.1046 13.1563 13.1563 k = 0.3788-0.4969 0.5204 ( 2060 PWs) bands (ev): -45.9848 -45.9848 -22.7210 -22.7210 -22.0779 -22.0779 -22.0561 -22.0561 2.1946 2.1946 6.2590 6.2590 6.4933 6.4933 7.0057 7.0057 8.7493 8.7493 9.0407 9.0407 10.6625 10.6625 12.6540 12.6540 13.1130 13.1130 13.1448 13.1448 k = 0.3864-0.5069 0.5308 ( 2060 PWs) bands (ev): -45.9845 -45.9845 -22.7220 -22.7220 -22.0792 -22.0792 -22.0569 -22.0569 2.3185 2.3185 6.2203 6.2203 6.4845 6.4845 6.9295 6.9295 8.6521 8.6521 9.0719 9.0719 10.6708 10.6708 12.5998 12.5998 13.1210 13.1210 13.1356 13.1356 k = 0.3939-0.5168 0.5412 ( 2060 PWs) bands (ev): -45.9842 -45.9842 -22.7229 -22.7229 -22.0803 -22.0803 -22.0576 -22.0576 2.4427 2.4427 6.1841 6.1841 6.4755 6.4755 6.8484 6.8484 8.5589 8.5589 9.1049 9.1049 10.6788 10.6788 12.5443 12.5443 13.1192 13.1192 13.1368 13.1368 k = 0.4015-0.5268 0.5516 ( 2060 PWs) bands (ev): -45.9839 -45.9839 -22.7237 -22.7237 -22.0815 -22.0815 -22.0582 -22.0582 2.5670 2.5670 6.1503 6.1503 6.4666 6.4666 6.7626 6.7626 8.4707 8.4707 9.1391 9.1391 10.6863 10.6863 12.4880 12.4880 13.1105 13.1105 13.1451 13.1451 k = 0.4091-0.5367 0.5620 ( 2068 PWs) bands (ev): -45.9836 -45.9836 -22.7246 -22.7246 -22.0826 -22.0826 -22.0588 -22.0588 2.6909 2.6909 6.1190 6.1190 6.4577 6.4577 6.6724 6.6724 8.3883 8.3883 9.1741 9.1741 10.6935 10.6935 12.4316 12.4316 13.1015 13.1015 13.1534 13.1534 k = 0.4167-0.5466 0.5724 ( 2064 PWs) bands (ev): -45.9834 -45.9834 -22.7253 -22.7253 -22.0836 -22.0836 -22.0592 -22.0592 2.8139 2.8139 6.0901 6.0901 6.4491 6.4491 6.5786 6.5786 8.3123 8.3123 9.2095 9.2095 10.7001 10.7001 12.3758 12.3758 13.0930 13.0930 13.1607 13.1607 k = 0.4242-0.5566 0.5828 ( 2064 PWs) bands (ev): -45.9831 -45.9831 -22.7260 -22.7260 -22.0846 -22.0846 -22.0596 -22.0596 2.9353 2.9353 6.0637 6.0637 6.4409 6.4409 6.4819 6.4819 8.2429 8.2429 9.2446 9.2446 10.7063 10.7063 12.3213 12.3213 13.0851 13.0851 13.1668 13.1668 k = 0.4318-0.5665 0.5932 ( 2064 PWs) bands (ev): -45.9829 -45.9829 -22.7266 -22.7266 -22.0855 -22.0855 -22.0600 -22.0600 3.0543 3.0543 6.0398 6.0398 6.3835 6.3835 6.4331 6.4331 8.1806 8.1806 9.2791 9.2791 10.7119 10.7119 12.2687 12.2687 13.0779 13.0779 13.1719 13.1719 k = 0.4394-0.5765 0.6036 ( 2056 PWs) bands (ev): -45.9827 -45.9827 -22.7271 -22.7271 -22.0863 -22.0863 -22.0603 -22.0603 3.1698 3.1698 6.0184 6.0184 6.2848 6.2848 6.4259 6.4259 8.1253 8.1253 9.3122 9.3122 10.7170 10.7170 12.2189 12.2189 13.0714 13.0714 13.1760 13.1760 k = 0.4470-0.5864 0.6140 ( 2052 PWs) bands (ev): -45.9825 -45.9825 -22.7276 -22.7276 -22.0870 -22.0870 -22.0605 -22.0605 3.2806 3.2806 5.9995 5.9995 6.1876 6.1876 6.4194 6.4194 8.0770 8.0770 9.3434 9.3434 10.7216 10.7216 12.1726 12.1726 13.0657 13.0657 13.1793 13.1793 k = 0.4545-0.5963 0.6244 ( 2060 PWs) bands (ev): -45.9824 -45.9824 -22.7281 -22.7281 -22.0877 -22.0877 -22.0608 -22.0608 3.3849 3.3849 5.9831 5.9831 6.0939 6.0939 6.4136 6.4136 8.0356 8.0356 9.3721 9.3721 10.7256 10.7256 12.1305 12.1305 13.0606 13.0606 13.1819 13.1819 k = 0.4621-0.6063 0.6348 ( 2056 PWs) bands (ev): -45.9823 -45.9823 -22.7284 -22.7284 -22.0882 -22.0882 -22.0609 -22.0609 3.4807 3.4807 5.9693 5.9693 6.0062 6.0062 6.4085 6.4085 8.0009 8.0009 9.3976 9.3976 10.7290 10.7290 12.0934 12.0934 13.0564 13.0564 13.1838 13.1838 k = 0.4697-0.6162 0.6452 ( 2058 PWs) bands (ev): -45.9822 -45.9822 -22.7287 -22.7287 -22.0887 -22.0887 -22.0611 -22.0611 3.5655 3.5655 5.9275 5.9275 5.9580 5.9580 6.4043 6.4043 7.9729 7.9729 9.4195 9.4195 10.7318 10.7318 12.0619 12.0619 13.0529 13.0529 13.1853 13.1853 k = 0.4773-0.6262 0.6556 ( 2062 PWs) bands (ev): -45.9821 -45.9821 -22.7290 -22.7290 -22.0891 -22.0891 -22.0612 -22.0612 3.6363 3.6363 5.8611 5.8611 5.9491 5.9491 6.4010 6.4010 7.9512 7.9512 9.4371 9.4371 10.7340 10.7340 12.0367 12.0367 13.0501 13.0501 13.1864 13.1864 k = 0.4848-0.6361 0.6661 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7291 -22.7291 -22.0893 -22.0893 -22.0612 -22.0612 3.6900 3.6900 5.8103 5.8103 5.9428 5.9428 6.3986 6.3986 7.9359 7.9359 9.4500 9.4500 10.7355 10.7355 12.0183 12.0183 13.0482 13.0482 13.1871 13.1871 k = 0.4924-0.6460 0.6765 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0613 -22.0613 3.7237 3.7237 5.7783 5.7783 5.9390 5.9390 6.3972 6.3972 7.9267 7.9267 9.4579 9.4579 10.7365 10.7365 12.0071 12.0071 13.0470 13.0470 13.1875 13.1875 k = 0.5000-0.6560 0.6869 ( 2046 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0612 -22.0612 3.7352 3.7352 5.7674 5.7674 5.9377 5.9377 6.3967 6.3967 7.9236 7.9236 9.4606 9.4606 10.7368 10.7368 12.0034 12.0034 13.0466 13.0466 13.1877 13.1877 k = 0.5000-0.6560 0.6869 ( 2046 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0612 -22.0612 3.7352 3.7352 5.7674 5.7674 5.9377 5.9377 6.3967 6.3967 7.9236 7.9236 9.4606 9.4606 10.7368 10.7368 12.0034 12.0034 13.0466 13.0466 13.1877 13.1877 k = 0.5000-0.6446 0.6977 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0613 -22.0613 3.7362 3.7362 5.7685 5.7685 5.8793 5.8793 6.4572 6.4572 7.9219 7.9219 9.4615 9.4615 10.7347 10.7347 11.9967 11.9967 13.0554 13.0554 13.1874 13.1874 k = 0.5000-0.6333 0.7086 ( 2056 PWs) bands (ev): -45.9820 -45.9820 -22.7291 -22.7291 -22.0894 -22.0894 -22.0613 -22.0613 3.7394 3.7394 5.7517 5.7517 5.7718 5.7718 6.5906 6.5906 7.9165 7.9165 9.4644 9.4644 10.7287 10.7287 11.9775 11.9775 13.0812 13.0812 13.1867 13.1867 k = 0.5000-0.6219 0.7194 ( 2060 PWs) bands (ev): -45.9821 -45.9821 -22.7290 -22.7290 -22.0892 -22.0892 -22.0612 -22.0612 3.7446 3.7446 5.6018 5.6018 5.7774 5.7774 6.7506 6.7506 7.9076 7.9076 9.4690 9.4690 10.7189 10.7189 11.9473 11.9473 13.1218 13.1218 13.1858 13.1858 k = 0.5000-0.6106 0.7302 ( 2048 PWs) bands (ev): -45.9821 -45.9821 -22.7288 -22.7288 -22.0889 -22.0889 -22.0610 -22.0610 3.7519 3.7519 5.4446 5.4446 5.7852 5.7852 6.9216 6.9216 7.8949 7.8949 9.4756 9.4756 10.7060 10.7060 11.9084 11.9084 13.1706 13.1706 13.1891 13.1891 k = 0.5000-0.5992 0.7411 ( 2044 PWs) bands (ev): -45.9822 -45.9822 -22.7285 -22.7285 -22.0886 -22.0886 -22.0609 -22.0609 3.7612 3.7612 5.2853 5.2853 5.7953 5.7953 7.0987 7.0987 7.8786 7.8786 9.4840 9.4840 10.6904 10.6904 11.8631 11.8631 13.1779 13.1779 13.2438 13.2438 k = 0.5000-0.5879 0.7519 ( 2044 PWs) bands (ev): -45.9823 -45.9823 -22.7283 -22.7283 -22.0882 -22.0882 -22.0607 -22.0607 3.7725 3.7725 5.1259 5.1259 5.8075 5.8075 7.2798 7.2798 7.8584 7.8584 9.4942 9.4942 10.6729 10.6729 11.8133 11.8133 13.1743 13.1743 13.3170 13.3170 k = 0.5000-0.5765 0.7628 ( 2052 PWs) bands (ev): -45.9824 -45.9824 -22.7280 -22.7280 -22.0878 -22.0878 -22.0606 -22.0606 3.7858 3.7858 4.9673 4.9673 5.8220 5.8220 7.4640 7.4640 7.8344 7.8344 9.5063 9.5063 10.6543 10.6543 11.7606 11.7606 13.1689 13.1689 13.3767 13.3767 k = 0.5000-0.5652 0.7736 ( 2048 PWs) bands (ev): -45.9826 -45.9826 -22.7276 -22.7276 -22.0872 -22.0872 -22.0604 -22.0604 3.8009 3.8009 4.8101 4.8101 5.8387 5.8387 7.6507 7.6507 7.8065 7.8065 9.5203 9.5203 10.6354 10.6354 11.7062 11.7062 13.1620 13.1620 13.3309 13.3309 k = 0.5000-0.5538 0.7844 ( 2052 PWs) bands (ev): -45.9827 -45.9827 -22.7272 -22.7272 -22.0867 -22.0867 -22.0601 -22.0601 3.8179 3.8179 4.6544 4.6544 5.8576 5.8576 7.7740 7.7740 7.8401 7.8401 9.5360 9.5360 10.6171 10.6171 11.6509 11.6509 13.1536 13.1536 13.2812 13.2812 k = 0.5000-0.5424 0.7953 ( 2052 PWs) bands (ev): -45.9829 -45.9829 -22.7268 -22.7268 -22.0860 -22.0860 -22.0598 -22.0598 3.8366 3.8366 4.5006 4.5006 5.8788 5.8788 7.7384 7.7384 8.0307 8.0307 9.5536 9.5536 10.6001 10.6001 11.5957 11.5957 13.1434 13.1434 13.2298 13.2298 k = 0.5000-0.5311 0.8061 ( 2052 PWs) bands (ev): -45.9831 -45.9831 -22.7263 -22.7263 -22.0853 -22.0853 -22.0595 -22.0595 3.8570 3.8570 4.3486 4.3486 5.9021 5.9021 7.6986 7.6986 8.2233 8.2233 9.5730 9.5730 10.5851 10.5851 11.5409 11.5409 13.1313 13.1313 13.1773 13.1773 k = 0.5000-0.5197 0.8170 ( 2054 PWs) bands (ev): -45.9833 -45.9833 -22.7257 -22.7257 -22.0846 -22.0846 -22.0591 -22.0591 3.8789 3.8789 4.1987 4.1987 5.9277 5.9277 7.6551 7.6551 8.4175 8.4175 9.5941 9.5941 10.5727 10.5727 11.4870 11.4870 13.1149 13.1149 13.1266 13.1266 k = 0.5000-0.5084 0.8278 ( 2054 PWs) bands (ev): -45.9835 -45.9835 -22.7251 -22.7251 -22.0838 -22.0838 -22.0586 -22.0586 3.9023 3.9023 4.0509 4.0509 5.9554 5.9554 7.6079 7.6079 8.6131 8.6131 9.6170 9.6170 10.5636 10.5636 11.4344 11.4344 13.0687 13.0687 13.1037 13.1037 k = 0.5000-0.4970 0.8387 ( 2050 PWs) bands (ev): -45.9837 -45.9837 -22.7245 -22.7245 -22.0830 -22.0830 -22.0581 -22.0581 3.9052 3.9052 3.9269 3.9269 5.9854 5.9854 7.5575 7.5575 8.8100 8.8100 9.6417 9.6417 10.5580 10.5580 11.3835 11.3835 13.0154 13.0154 13.0861 13.0861 k = 0.5000-0.4970 0.8387 ( 2050 PWs) bands (ev): -45.9837 -45.9837 -22.7245 -22.7245 -22.0830 -22.0830 -22.0581 -22.0581 3.9052 3.9052 3.9269 3.9269 5.9854 5.9854 7.5575 7.5575 8.8100 8.8100 9.6417 9.6417 10.5580 10.5580 11.3835 11.3835 13.0154 13.0154 13.0861 13.0861 k = 0.4944-0.4818 0.8387 ( 2052 PWs) bands (ev): -45.9839 -45.9839 -22.7240 -22.7240 -22.0824 -22.0824 -22.0577 -22.0577 3.8046 3.8046 3.9393 3.9393 6.0119 6.0119 7.5231 7.5231 8.9488 8.9488 9.6586 9.6586 10.5559 10.5559 11.3515 11.3515 12.9739 12.9739 13.0772 13.0772 k = 0.4889-0.4665 0.8387 ( 2058 PWs) bands (ev): -45.9841 -45.9841 -22.7235 -22.7235 -22.0818 -22.0818 -22.0572 -22.0572 3.7064 3.7064 3.9414 3.9414 6.0468 6.0468 7.4939 7.4939 9.0865 9.0865 9.6736 9.6736 10.5547 10.5547 11.3266 11.3266 12.9286 12.9286 13.0722 13.0722 k = 0.4833-0.4512 0.8387 ( 2056 PWs) bands (ev): -45.9843 -45.9843 -22.7229 -22.7229 -22.0813 -22.0813 -22.0566 -22.0566 3.6106 3.6106 3.9342 3.9342 6.0878 6.0878 7.4713 7.4713 9.2212 9.2212 9.6883 9.6883 10.5545 10.5545 11.3092 11.3092 12.8824 12.8824 13.0686 13.0686 k = 0.4778-0.4360 0.8387 ( 2058 PWs) bands (ev): -45.9845 -45.9845 -22.7223 -22.7223 -22.0808 -22.0808 -22.0558 -22.0558 3.5172 3.5172 3.9186 3.9186 6.1322 6.1322 7.4571 7.4571 9.3486 9.3486 9.7063 9.7063 10.5550 10.5550 11.3000 11.3000 12.8362 12.8362 13.0656 13.0656 k = 0.4722-0.4207 0.8387 ( 2060 PWs) bands (ev): -45.9847 -45.9847 -22.7217 -22.7217 -22.0803 -22.0803 -22.0548 -22.0548 3.4262 3.4262 3.8960 3.8960 6.1767 6.1767 7.4534 7.4534 9.4582 9.4582 9.7376 9.7376 10.5563 10.5563 11.2995 11.2995 12.7909 12.7909 13.0627 13.0627 k = 0.4667-0.4054 0.8387 ( 2060 PWs) bands (ev): -45.9850 -45.9850 -22.7211 -22.7211 -22.0800 -22.0800 -22.0537 -22.0537 3.3377 3.3377 3.8675 3.8675 6.2182 6.2182 7.4623 7.4623 9.5315 9.5315 9.8001 9.8001 10.5581 10.5581 11.3081 11.3081 12.7469 12.7469 13.0599 13.0599 k = 0.4611-0.3901 0.8387 ( 2062 PWs) bands (ev): -45.9852 -45.9852 -22.7204 -22.7204 -22.0797 -22.0797 -22.0524 -22.0524 3.2516 3.2516 3.8341 3.8341 6.2535 6.2535 7.4858 7.4858 9.5626 9.5626 9.8993 9.8993 10.5604 10.5604 11.3263 11.3263 12.7047 12.7047 13.0569 13.0569 k = 0.4556-0.3749 0.8387 ( 2064 PWs) bands (ev): -45.9855 -45.9855 -22.7197 -22.7197 -22.0795 -22.0795 -22.0509 -22.0509 3.1680 3.1680 3.7971 3.7971 6.2802 6.2802 7.5254 7.5254 9.5675 9.5675 10.0188 10.0188 10.5629 10.5629 11.3546 11.3546 12.6648 12.6648 13.0538 13.0538 k = 0.4500-0.3596 0.8387 ( 2064 PWs) bands (ev): -45.9858 -45.9858 -22.7190 -22.7190 -22.0794 -22.0794 -22.0493 -22.0493 3.0870 3.0870 3.7571 3.7571 6.2971 6.2971 7.5814 7.5814 9.5590 9.5590 10.1452 10.1452 10.5656 10.5656 11.3932 11.3932 12.6276 12.6276 13.0503 13.0503 k = 0.4445-0.3443 0.8387 ( 2066 PWs) bands (ev): -45.9861 -45.9861 -22.7182 -22.7182 -22.0794 -22.0794 -22.0476 -22.0476 3.0084 3.0084 3.7151 3.7151 6.3038 6.3038 7.6533 7.6533 9.5428 9.5428 10.2723 10.2723 10.5683 10.5683 11.4426 11.4426 12.5934 12.5934 13.0465 13.0465 k = 0.4389-0.3291 0.8387 ( 2058 PWs) bands (ev): -45.9864 -45.9864 -22.7174 -22.7174 -22.0794 -22.0794 -22.0456 -22.0456 2.9324 2.9324 3.6716 3.6716 6.3011 6.3011 7.7397 7.7397 9.5215 9.5215 10.3969 10.3969 10.5708 10.5708 11.5034 11.5034 12.5629 12.5629 13.0423 13.0423 k = 0.4334-0.3138 0.8387 ( 2058 PWs) bands (ev): -45.9867 -45.9867 -22.7167 -22.7167 -22.0795 -22.0795 -22.0436 -22.0436 2.8590 2.8590 3.6272 3.6272 6.2903 6.2903 7.8387 7.8387 9.4966 9.4966 10.5166 10.5166 10.5734 10.5734 11.5758 11.5758 12.5363 12.5363 13.0377 13.0377 k = 0.4278-0.2985 0.8387 ( 2054 PWs) bands (ev): -45.9870 -45.9870 -22.7159 -22.7159 -22.0797 -22.0797 -22.0414 -22.0414 2.7881 2.7881 3.5825 3.5825 6.2730 6.2730 7.9482 7.9482 9.4690 9.4690 10.5736 10.5736 10.6325 10.6325 11.6599 11.6599 12.5140 12.5140 13.0327 13.0327 k = 0.4223-0.2833 0.8387 ( 2052 PWs) bands (ev): -45.9873 -45.9873 -22.7152 -22.7152 -22.0799 -22.0799 -22.0392 -22.0392 2.7198 2.7198 3.5377 3.5377 6.2505 6.2505 8.0662 8.0662 9.4395 9.4395 10.5751 10.5751 10.7399 10.7399 11.7558 11.7558 12.4965 12.4965 13.0273 13.0273 k = 0.4167-0.2680 0.8387 ( 2053 PWs) bands (ev): -45.9876 -45.9876 -22.7144 -22.7144 -22.0802 -22.0802 -22.0369 -22.0369 2.6541 2.6541 3.4932 3.4932 6.2242 6.2242 8.1908 8.1908 9.4086 9.4086 10.5757 10.5757 10.8409 10.8409 11.8627 11.8627 12.4841 12.4841 13.0215 13.0215 k = 0.4112-0.2527 0.8387 ( 2053 PWs) bands (ev): -45.9879 -45.9879 -22.7137 -22.7137 -22.0805 -22.0805 -22.0346 -22.0346 2.5909 2.5909 3.4493 3.4493 6.1951 6.1951 8.3205 8.3205 9.3769 9.3769 10.5756 10.5756 10.9354 10.9354 11.9797 11.9797 12.4771 12.4771 13.0153 13.0153 k = 0.4056-0.2374 0.8387 ( 2051 PWs) bands (ev): -45.9882 -45.9882 -22.7130 -22.7130 -22.0808 -22.0808 -22.0322 -22.0322 2.5304 2.5304 3.4062 3.4062 6.1641 6.1641 8.4538 8.4538 9.3446 9.3446 10.5750 10.5750 11.0238 11.0238 12.1055 12.1055 12.4758 12.4758 13.0088 13.0088 k = 0.4001-0.2222 0.8387 ( 2051 PWs) bands (ev): -45.9885 -45.9885 -22.7123 -22.7123 -22.0812 -22.0812 -22.0298 -22.0298 2.4725 2.4725 3.3642 3.3642 6.1320 6.1320 8.5895 8.5895 9.3121 9.3121 10.5740 10.5740 11.1069 11.1069 12.2386 12.2386 12.4804 12.4804 13.0021 13.0021 k = 0.3945-0.2069 0.8387 ( 2049 PWs) bands (ev): -45.9888 -45.9888 -22.7116 -22.7116 -22.0816 -22.0816 -22.0273 -22.0273 2.4172 2.4172 3.3233 3.3233 6.0992 6.0992 8.7262 8.7262 9.2798 9.2798 10.5728 10.5728 11.1855 11.1855 12.3774 12.3774 12.4911 12.4911 12.9953 12.9953 k = 0.3890-0.1916 0.8387 ( 2049 PWs) bands (ev): -45.9891 -45.9891 -22.7109 -22.7109 -22.0820 -22.0820 -22.0249 -22.0249 2.3646 2.3646 3.2839 3.2839 6.0663 6.0663 8.8627 8.8627 9.2478 9.2478 10.5719 10.5719 11.2603 11.2603 12.5050 12.5050 12.5232 12.5232 12.9888 12.9888 k = 0.3834-0.1764 0.8387 ( 2048 PWs) bands (ev): -45.9894 -45.9894 -22.7103 -22.7103 -22.0823 -22.0823 -22.0226 -22.0226 2.3146 2.3146 3.2459 3.2459 6.0336 6.0336 8.9979 8.9979 9.2165 9.2165 10.5716 10.5716 11.3319 11.3319 12.5295 12.5295 12.6671 12.6671 12.9828 12.9828 k = 0.3779-0.1611 0.8387 ( 2050 PWs) bands (ev): -45.9897 -45.9897 -22.7097 -22.7097 -22.0827 -22.0827 -22.0203 -22.0203 2.2672 2.2672 3.2095 3.2095 6.0015 6.0015 9.1301 9.1301 9.1861 9.1861 10.5724 10.5724 11.4007 11.4007 12.5576 12.5576 12.8142 12.8142 12.9782 12.9782 k = 0.3723-0.1458 0.8387 ( 2050 PWs) bands (ev): -45.9900 -45.9900 -22.7091 -22.7091 -22.0831 -22.0831 -22.0180 -22.0180 2.2225 2.2225 3.1749 3.1749 5.9702 5.9702 9.1557 9.1557 9.2591 9.2591 10.5753 10.5753 11.4670 11.4670 12.5904 12.5904 12.9579 12.9579 12.9795 12.9795 k = 0.3668-0.1306 0.8387 ( 2052 PWs) bands (ev): -45.9903 -45.9903 -22.7086 -22.7086 -22.0835 -22.0835 -22.0158 -22.0158 2.1804 2.1804 3.1420 3.1420 5.9399 5.9399 9.1272 9.1272 9.3817 9.3817 10.5809 10.5809 11.5310 11.5310 12.6265 12.6265 12.9756 12.9756 13.1093 13.1093 k = 0.3612-0.1153 0.8387 ( 2053 PWs) bands (ev): -45.9905 -45.9905 -22.7081 -22.7081 -22.0839 -22.0839 -22.0137 -22.0137 2.1410 2.1410 3.1110 3.1110 5.9108 5.9108 9.0997 9.0997 9.4970 9.4970 10.5904 10.5904 11.5926 11.5926 12.6636 12.6636 12.9836 12.9836 13.2529 13.2529 k = 0.3556-0.1000 0.8387 ( 2049 PWs) bands (ev): -45.9908 -45.9908 -22.7076 -22.7076 -22.0843 -22.0843 -22.0116 -22.0116 2.1043 2.1043 3.0819 3.0819 5.8830 5.8830 9.0734 9.0734 9.6032 9.6032 10.6049 10.6049 11.6520 11.6520 12.6978 12.6978 13.0019 13.0019 13.3927 13.3927 k = 0.3501-0.0847 0.8387 ( 2051 PWs) bands (ev): -45.9910 -45.9910 -22.7071 -22.7071 -22.0846 -22.0846 -22.0096 -22.0096 2.0702 2.0702 3.0547 3.0547 5.8568 5.8568 9.0485 9.0485 9.6985 9.6985 10.6255 10.6255 11.7088 11.7088 12.7249 12.7249 13.0352 13.0352 13.5271 13.5271 k = 0.3445-0.0695 0.8387 ( 2053 PWs) bands (ev): -45.9912 -45.9912 -22.7067 -22.7067 -22.0850 -22.0850 -22.0078 -22.0078 2.0388 2.0388 3.0297 3.0297 5.8322 5.8322 9.0250 9.0250 9.7814 9.7814 10.6530 10.6530 11.7629 11.7629 12.7421 12.7421 13.0863 13.0863 13.6541 13.6541 k = 0.3390-0.0542 0.8387 ( 2055 PWs) bands (ev): -45.9914 -45.9914 -22.7063 -22.7063 -22.0853 -22.0853 -22.0061 -22.0061 2.0101 2.0101 3.0066 3.0066 5.8093 5.8093 9.0029 9.0029 9.8511 9.8511 10.6876 10.6876 11.8140 11.8140 12.7501 12.7501 13.1549 13.1549 13.7720 13.7720 k = 0.3334-0.0389 0.8387 ( 2057 PWs) bands (ev): -45.9916 -45.9916 -22.7060 -22.7060 -22.0857 -22.0857 -22.0045 -22.0045 1.9841 1.9841 2.9858 2.9858 5.7883 5.7883 8.9824 8.9824 9.9076 9.9076 10.7288 10.7288 11.8617 11.8617 12.7514 12.7514 13.2384 13.2384 13.8786 13.8786 k = 0.3279-0.0237 0.8387 ( 2056 PWs) bands (ev): -45.9917 -45.9917 -22.7057 -22.7057 -22.0859 -22.0859 -22.0031 -22.0031 1.9607 1.9607 2.9670 2.9670 5.7691 5.7691 8.9635 8.9635 9.9520 9.9520 10.7749 10.7749 11.9056 11.9056 12.7484 12.7484 13.3341 13.3341 13.9717 13.9717 k = 0.3223-0.0084 0.8387 ( 2056 PWs) bands (ev): -45.9919 -45.9919 -22.7054 -22.7054 -22.0862 -22.0862 -22.0017 -22.0017 1.9401 1.9401 2.9505 2.9505 5.7518 5.7518 8.9461 8.9461 9.9860 9.9860 10.8238 10.8238 11.9451 11.9451 12.7431 12.7431 13.4399 13.4399 14.0495 14.0495 k = 0.3168 0.0069 0.8387 ( 2058 PWs) bands (ev): -45.9920 -45.9920 -22.7052 -22.7052 -22.0864 -22.0864 -22.0006 -22.0006 1.9221 1.9221 2.9361 2.9361 5.7366 5.7366 8.9304 8.9304 10.0115 10.0115 10.8731 10.8731 11.9797 11.9797 12.7368 12.7368 13.5537 13.5537 14.1104 14.1104 k = 0.3112 0.0221 0.8387 ( 2062 PWs) bands (ev): -45.9921 -45.9921 -22.7050 -22.7050 -22.0867 -22.0867 -21.9996 -21.9996 1.9068 1.9068 2.9240 2.9240 5.7233 5.7233 8.9164 8.9164 10.0306 10.0306 10.9206 10.9206 12.0088 12.0088 12.7304 12.7304 13.6737 13.6737 14.1536 14.1536 k = 0.3057 0.0374 0.8387 ( 2060 PWs) bands (ev): -45.9922 -45.9922 -22.7048 -22.7048 -22.0868 -22.0868 -21.9988 -21.9988 1.8943 1.8943 2.9141 2.9141 5.7122 5.7122 8.9040 8.9040 10.0449 10.0449 10.9644 10.9644 12.0317 12.0317 12.7248 12.7248 13.7977 13.7977 14.1793 14.1793 k = 0.3001 0.0527 0.8387 ( 2060 PWs) bands (ev): -45.9923 -45.9923 -22.7047 -22.7047 -22.0870 -22.0870 -21.9981 -21.9981 1.8844 1.8844 2.9065 2.9065 5.7032 5.7032 8.8933 8.8933 10.0558 10.0558 11.0030 11.0030 12.0479 12.0479 12.7205 12.7205 13.9232 13.9232 14.1889 14.1889 k = 0.2946 0.0680 0.8387 ( 2056 PWs) bands (ev): -45.9923 -45.9923 -22.7046 -22.7046 -22.0871 -22.0871 -21.9976 -21.9976 1.8772 1.8772 2.9012 2.9012 5.6963 5.6963 8.8843 8.8843 10.0644 10.0644 11.0353 11.0353 12.0567 12.0567 12.7179 12.7179 14.0471 14.0471 14.1839 14.1839 k = 0.2890 0.0832 0.8387 ( 2056 PWs) bands (ev): -45.9924 -45.9924 -22.7046 -22.7046 -22.0872 -22.0872 -21.9972 -21.9972 1.8727 1.8727 2.8982 2.8982 5.6916 5.6916 8.8770 8.8770 10.0715 10.0715 11.0604 11.0604 12.0573 12.0573 12.7176 12.7176 14.1640 14.1640 14.1675 14.1675 k = 0.2835 0.0985 0.8387 ( 2052 PWs) bands (ev): -45.9924 -45.9924 -22.7045 -22.7045 -22.0873 -22.0873 -21.9971 -21.9971 1.8709 1.8709 2.8975 2.8975 5.6891 5.6891 8.8713 8.8713 10.0777 10.0777 11.0779 11.0779 12.0493 12.0493 12.7196 12.7196 14.1374 14.1374 14.2710 14.2710 k = 0.2779 0.1138 0.8387 ( 2047 PWs) bands (ev): -45.9923 -45.9923 -22.7046 -22.7046 -22.0873 -22.0873 -21.9971 -21.9971 1.8719 1.8719 2.8990 2.8990 5.6887 5.6887 8.8674 8.8674 10.0834 10.0834 11.0875 11.0875 12.0322 12.0322 12.7241 12.7241 14.0987 14.0987 14.3409 14.3409 k = 0.2724 0.1290 0.8387 ( 2048 PWs) bands (ev): -45.9923 -45.9923 -22.7046 -22.7046 -22.0873 -22.0873 -21.9973 -21.9973 1.8755 1.8755 2.9029 2.9029 5.6904 5.6904 8.8651 8.8651 10.0889 10.0889 11.0892 11.0892 12.0053 12.0053 12.7313 12.7313 14.0510 14.0510 14.3519 14.3519 k = 0.2668 0.1443 0.8387 ( 2046 PWs) bands (ev): -45.9923 -45.9923 -22.7047 -22.7047 -22.0873 -22.0873 -21.9977 -21.9977 1.8818 1.8818 2.9091 2.9091 5.6944 5.6944 8.8645 8.8645 10.0945 10.0945 11.0829 11.0829 11.9686 11.9686 12.7409 12.7409 13.9951 13.9951 14.3512 14.3512 k = 0.2613 0.1596 0.8387 ( 2044 PWs) bands (ev): -45.9922 -45.9922 -22.7049 -22.7049 -22.0872 -22.0872 -21.9982 -21.9982 1.8908 1.8908 2.9176 2.9176 5.7004 5.7004 8.8655 8.8655 10.1003 10.1003 11.0688 11.0688 11.9217 11.9217 12.7529 12.7529 13.9318 13.9318 14.3478 14.3478 k = 0.2557 0.1748 0.8387 ( 2048 PWs) bands (ev): -45.9921 -45.9921 -22.7051 -22.7051 -22.0871 -22.0871 -21.9990 -21.9990 1.9025 1.9025 2.9285 2.9285 5.7086 5.7086 8.8681 8.8681 10.1062 10.1062 11.0473 11.0473 11.8646 11.8646 12.7670 12.7670 13.8619 13.8619 14.3391 14.3391 k = 0.2502 0.1901 0.8387 ( 2046 PWs) bands (ev): -45.9920 -45.9920 -22.7053 -22.7053 -22.0870 -22.0870 -21.9999 -21.9999 1.9170 1.9170 2.9416 2.9416 5.7189 5.7189 8.8723 8.8723 10.1125 10.1125 11.0187 11.0187 11.7974 11.7974 12.7828 12.7828 13.7865 13.7865 14.3182 14.3182 k = 0.2446 0.2054 0.8387 ( 2045 PWs) bands (ev): -45.9918 -45.9918 -22.7056 -22.7056 -22.0869 -22.0869 -22.0010 -22.0010 1.9341 1.9341 2.9570 2.9570 5.7312 5.7312 8.8780 8.8780 10.1189 10.1189 10.9833 10.9833 11.7201 11.7201 12.8001 12.8001 13.7068 13.7068 14.2754 14.2754 k = 0.2391 0.2207 0.8387 ( 2045 PWs) bands (ev): -45.9917 -45.9917 -22.7059 -22.7059 -22.0867 -22.0867 -22.0022 -22.0022 1.9539 1.9539 2.9747 2.9747 5.7455 5.7455 8.8851 8.8851 10.1253 10.1253 10.9416 10.9416 11.6333 11.6333 12.8185 12.8185 13.6242 13.6242 14.2078 14.2078 k = 0.2335 0.2359 0.8387 ( 2045 PWs) bands (ev): -45.9915 -45.9915 -22.7062 -22.7062 -22.0865 -22.0865 -22.0036 -22.0036 1.9764 1.9764 2.9947 2.9947 5.7618 5.7618 8.8937 8.8937 10.1316 10.1316 10.8939 10.8939 11.5371 11.5371 12.8377 12.8377 13.5397 13.5397 14.1213 14.1213 k = 0.2280 0.2512 0.8387 ( 2045 PWs) bands (ev): -45.9913 -45.9913 -22.7066 -22.7066 -22.0863 -22.0863 -22.0051 -22.0051 2.0016 2.0016 3.0170 3.0170 5.7800 5.7800 8.9036 8.9036 10.1374 10.1374 10.8407 10.8407 11.4323 11.4323 12.8573 12.8573 13.4547 13.4547 14.0236 14.0236 k = 0.2224 0.2665 0.8387 ( 2049 PWs) bands (ev): -45.9911 -45.9911 -22.7070 -22.7070 -22.0861 -22.0861 -22.0068 -22.0068 2.0295 2.0295 3.0415 3.0415 5.8000 5.8000 8.9147 8.9147 10.1423 10.1423 10.7826 10.7826 11.3193 11.3193 12.8771 12.8771 13.3702 13.3702 13.9203 13.9203 k = 0.2168 0.2817 0.8387 ( 2050 PWs) bands (ev): -45.9909 -45.9909 -22.7075 -22.7075 -22.0859 -22.0859 -22.0086 -22.0086 2.0600 2.0600 3.0682 3.0682 5.8217 5.8217 8.9271 8.9271 10.1458 10.1458 10.7203 10.7203 11.1989 11.1989 12.8967 12.8967 13.2868 13.2868 13.8154 13.8154 k = 0.2113 0.2970 0.8387 ( 2049 PWs) bands (ev): -45.9906 -45.9906 -22.7080 -22.7080 -22.0856 -22.0856 -22.0104 -22.0104 2.0933 2.0933 3.0971 3.0971 5.8452 5.8452 8.9404 8.9404 10.1468 10.1468 10.6546 10.6546 11.0719 11.0719 12.9159 12.9159 13.2054 13.2054 13.7119 13.7119 k = 0.2057 0.3123 0.8387 ( 2049 PWs) bands (ev): -45.9904 -45.9904 -22.7085 -22.7085 -22.0853 -22.0853 -22.0124 -22.0124 2.1292 2.1292 3.1283 3.1283 5.8703 5.8703 8.9547 8.9547 10.1440 10.1440 10.5873 10.5873 10.9389 10.9389 12.9344 12.9344 13.1265 13.1265 13.6117 13.6117 k = 0.2002 0.3276 0.8387 ( 2049 PWs) bands (ev): -45.9901 -45.9901 -22.7091 -22.7091 -22.0850 -22.0850 -22.0146 -22.0146 2.1678 2.1678 3.1615 3.1615 5.8968 5.8968 8.9697 8.9697 10.1349 10.1349 10.5206 10.5206 10.8010 10.8010 12.9520 12.9520 13.0503 13.0503 13.5167 13.5167 k = 0.1946 0.3428 0.8387 ( 2051 PWs) bands (ev): -45.9899 -45.9899 -22.7096 -22.7096 -22.0847 -22.0847 -22.0168 -22.0168 2.2091 2.2091 3.1969 3.1969 5.9247 5.9247 8.9852 8.9852 10.1158 10.1158 10.4585 10.4585 10.6588 10.6588 12.9677 12.9677 12.9778 12.9778 13.4283 13.4283 k = 0.1891 0.3581 0.8387 ( 2059 PWs) bands (ev): -45.9896 -45.9896 -22.7103 -22.7103 -22.0844 -22.0844 -22.0191 -22.0191 2.2531 2.2531 3.2344 3.2344 5.9539 5.9539 9.0009 9.0009 10.0819 10.0819 10.4057 10.4057 10.5134 10.5134 12.9072 12.9072 12.9829 12.9829 13.3477 13.3477 k = 0.1835 0.3734 0.8387 ( 2063 PWs) bands (ev): -45.9893 -45.9893 -22.7110 -22.7110 -22.0842 -22.0842 -22.0214 -22.0214 2.2997 2.2997 3.2739 3.2739 5.9842 5.9842 9.0164 9.0164 10.0297 10.0297 10.3638 10.3638 10.3679 10.3679 12.8407 12.8407 12.9947 12.9947 13.2763 13.2763 k = 0.1780 0.3886 0.8387 ( 2063 PWs) bands (ev): -45.9890 -45.9890 -22.7117 -22.7117 -22.0838 -22.0838 -22.0238 -22.0238 2.3489 2.3489 3.3154 3.3154 6.0155 6.0155 9.0310 9.0310 9.9597 9.9597 10.2167 10.2167 10.3394 10.3394 12.7777 12.7777 13.0024 13.0024 13.2161 13.2161 k = 0.1724 0.4039 0.8387 ( 2059 PWs) bands (ev): -45.9887 -45.9887 -22.7123 -22.7123 -22.0835 -22.0835 -22.0262 -22.0262 2.4008 2.4008 3.3589 3.3589 6.0476 6.0476 9.0437 9.0437 9.8756 9.8756 10.0681 10.0681 10.3218 10.3218 12.7183 12.7183 13.0030 13.0030 13.1701 13.1701 k = 0.1669 0.4192 0.8387 ( 2059 PWs) bands (ev): -45.9883 -45.9883 -22.7130 -22.7130 -22.0832 -22.0832 -22.0286 -22.0286 2.4554 2.4554 3.4043 3.4043 6.0803 6.0803 9.0530 9.0530 9.7819 9.7819 9.9217 9.9217 10.3097 10.3097 12.6625 12.6625 12.9933 12.9933 13.1417 13.1417 k = 0.1613 0.4344 0.8387 ( 2058 PWs) bands (ev): -45.9880 -45.9880 -22.7138 -22.7138 -22.0829 -22.0829 -22.0310 -22.0310 2.5125 2.5125 3.4515 3.4515 6.1134 6.1134 9.0561 9.0561 9.6814 9.6814 9.7808 9.7808 10.3003 10.3003 12.6103 12.6103 12.9741 12.9741 13.1300 13.1300 k = 0.1558 0.4497 0.8387 ( 2060 PWs) bands (ev): -45.9877 -45.9877 -22.7145 -22.7145 -22.0827 -22.0827 -22.0334 -22.0334 2.5723 2.5723 3.5004 3.5004 6.1466 6.1466 9.0477 9.0477 9.5765 9.5765 9.6508 9.6508 10.2920 10.2920 12.5619 12.5619 12.9511 12.9511 13.1293 13.1293 k = 0.1502 0.4650 0.8387 ( 2062 PWs) bands (ev): -45.9874 -45.9874 -22.7153 -22.7153 -22.0825 -22.0825 -22.0358 -22.0358 2.6348 2.6348 3.5510 3.5510 6.1798 6.1798 9.0193 9.0193 9.4688 9.4688 9.5404 9.5404 10.2838 10.2838 12.5173 12.5173 12.9294 12.9294 13.1341 13.1341 k = 0.1447 0.4803 0.8387 ( 2058 PWs) bands (ev): -45.9870 -45.9870 -22.7161 -22.7161 -22.0822 -22.0822 -22.0381 -22.0381 2.6998 2.6998 3.6032 3.6032 6.2126 6.2126 8.9605 8.9605 9.3596 9.3596 9.4600 9.4600 10.2752 10.2752 12.4765 12.4765 12.9117 12.9117 13.1415 13.1415 k = 0.1391 0.4955 0.8387 ( 2059 PWs) bands (ev): -45.9867 -45.9867 -22.7169 -22.7169 -22.0821 -22.0821 -22.0404 -22.0404 2.7674 2.7674 3.6569 3.6569 6.2447 6.2447 8.8676 8.8676 9.2500 9.2500 9.4137 9.4137 10.2657 10.2657 12.4398 12.4398 12.8988 12.8988 13.1501 13.1501 k = 0.1336 0.5108 0.8387 ( 2065 PWs) bands (ev): -45.9864 -45.9864 -22.7177 -22.7177 -22.0820 -22.0820 -22.0427 -22.0427 2.8376 2.8376 3.7119 3.7119 6.2757 6.2757 8.7481 8.7481 9.1407 9.1407 9.3939 9.3939 10.2554 10.2554 12.4070 12.4070 12.8910 12.8910 13.1595 13.1595 k = 0.1280 0.5261 0.8387 ( 2061 PWs) bands (ev): -45.9860 -45.9860 -22.7185 -22.7185 -22.0819 -22.0819 -22.0448 -22.0448 2.9104 2.9104 3.7681 3.7681 6.3053 6.3053 8.6126 8.6126 9.0328 9.0328 9.3905 9.3905 10.2441 10.2441 12.3785 12.3785 12.8879 12.8879 13.1693 13.1693 k = 0.1225 0.5413 0.8387 ( 2065 PWs) bands (ev): -45.9857 -45.9857 -22.7193 -22.7193 -22.0819 -22.0819 -22.0468 -22.0468 2.9857 2.9857 3.8255 3.8255 6.3329 6.3329 8.4683 8.4683 8.9271 8.9271 9.3960 9.3960 10.2318 10.2318 12.3541 12.3541 12.8890 12.8890 13.1796 13.1796 k = 0.1169 0.5566 0.8387 ( 2067 PWs) bands (ev): -45.9854 -45.9854 -22.7201 -22.7201 -22.0820 -22.0820 -22.0487 -22.0487 3.0635 3.0635 3.8837 3.8837 6.3580 6.3580 8.3193 8.3193 8.8245 8.8245 9.4065 9.4065 10.2186 10.2186 12.3341 12.3341 12.8938 12.8938 13.1906 13.1906 k = 0.1114 0.5719 0.8387 ( 2073 PWs) bands (ev): -45.9851 -45.9851 -22.7210 -22.7210 -22.0822 -22.0822 -22.0506 -22.0506 3.1439 3.1439 3.9425 3.9425 6.3802 6.3802 8.1681 8.1681 8.7261 8.7261 9.4194 9.4194 10.2047 10.2047 12.3185 12.3185 12.9013 12.9013 13.2023 13.2023 k = 0.1058 0.5871 0.8387 ( 2077 PWs) bands (ev): -45.9848 -45.9848 -22.7218 -22.7218 -22.0824 -22.0824 -22.0522 -22.0522 3.2268 3.2268 4.0018 4.0018 6.3988 6.3988 8.0159 8.0159 8.6327 8.6327 9.4335 9.4335 10.1902 10.1902 12.3073 12.3073 12.9109 12.9109 13.2152 13.2152 k = 0.1003 0.6024 0.8387 ( 2075 PWs) bands (ev): -45.9845 -45.9845 -22.7225 -22.7225 -22.0826 -22.0826 -22.0537 -22.0537 3.3121 3.3121 4.0613 4.0613 6.4133 6.4133 7.8636 7.8636 8.5452 8.5452 9.4480 9.4480 10.1753 10.1753 12.3008 12.3008 12.9218 12.9218 13.2293 13.2293 k = 0.0947 0.6177 0.8387 ( 2076 PWs) bands (ev): -45.9843 -45.9843 -22.7232 -22.7232 -22.0830 -22.0830 -22.0551 -22.0551 3.3998 3.3998 4.1205 4.1205 6.4232 6.4232 7.7118 7.7118 8.4647 8.4647 9.4621 9.4621 10.1601 10.1601 12.2988 12.2988 12.9330 12.9330 13.2451 13.2451 k = 0.0892 0.6330 0.8387 ( 2074 PWs) bands (ev): -45.9840 -45.9840 -22.7239 -22.7239 -22.0834 -22.0834 -22.0562 -22.0562 3.4900 3.4900 4.1793 4.1793 6.4280 6.4280 7.5609 7.5609 8.3919 8.3919 9.4755 9.4755 10.1447 10.1447 12.3016 12.3016 12.9440 12.9440 13.2627 13.2627 k = 0.0836 0.6482 0.8387 ( 2070 PWs) bands (ev): -45.9837 -45.9837 -22.7246 -22.7246 -22.0839 -22.0839 -22.0572 -22.0572 3.5825 3.5825 4.2369 4.2369 6.4274 6.4274 7.4113 7.4113 8.3276 8.3276 9.4880 9.4880 10.1295 10.1295 12.3090 12.3090 12.9542 12.9542 13.2822 13.2822 k = 0.0780 0.6635 0.8387 ( 2070 PWs) bands (ev): -45.9835 -45.9835 -22.7252 -22.7252 -22.0845 -22.0845 -22.0581 -22.0581 3.6773 3.6773 4.2930 4.2930 6.4213 6.4213 7.2631 7.2631 8.2724 8.2724 9.4992 9.4992 10.1144 10.1144 12.3211 12.3211 12.9631 12.9631 13.3036 13.3036 k = 0.0725 0.6788 0.8387 ( 2067 PWs) bands (ev): -45.9833 -45.9833 -22.7258 -22.7258 -22.0850 -22.0850 -22.0588 -22.0588 3.7744 3.7744 4.3470 4.3470 6.4100 6.4100 7.1167 7.1167 8.2266 8.2266 9.5090 9.5090 10.0996 10.0996 12.3379 12.3379 12.9707 12.9707 13.3266 13.3266 k = 0.0669 0.6940 0.8387 ( 2067 PWs) bands (ev): -45.9831 -45.9831 -22.7264 -22.7264 -22.0856 -22.0856 -22.0595 -22.0595 3.8736 3.8736 4.3980 4.3980 6.3941 6.3941 6.9721 6.9721 8.1903 8.1903 9.5172 9.5172 10.0854 10.0854 12.3593 12.3593 12.9767 12.9767 13.3508 13.3508 k = 0.0614 0.7093 0.8387 ( 2068 PWs) bands (ev): -45.9829 -45.9829 -22.7269 -22.7269 -22.0862 -22.0862 -22.0600 -22.0600 3.9749 3.9749 4.4452 4.4452 6.3745 6.3745 6.8297 6.8297 8.1633 8.1633 9.5238 9.5238 10.0718 10.0718 12.3853 12.3853 12.9814 12.9814 13.3759 13.3759 k = 0.0558 0.7246 0.8387 ( 2068 PWs) bands (ev): -45.9827 -45.9827 -22.7274 -22.7274 -22.0868 -22.0868 -22.0604 -22.0604 4.0781 4.0781 4.4877 4.4877 6.3525 6.3525 6.6897 6.6897 8.1451 8.1451 9.5286 9.5286 10.0590 10.0590 12.4157 12.4157 12.9848 12.9848 13.4013 13.4013 k = 0.0503 0.7398 0.8387 ( 2072 PWs) bands (ev): -45.9826 -45.9826 -22.7279 -22.7279 -22.0874 -22.0874 -22.0607 -22.0607 4.1830 4.1830 4.5244 4.5244 6.3296 6.3296 6.5522 6.5522 8.1351 8.1351 9.5317 9.5317 10.0471 10.0471 12.4504 12.4504 12.9873 12.9873 13.4264 13.4264 k = 0.0447 0.7551 0.8387 ( 2074 PWs) bands (ev): -45.9824 -45.9824 -22.7283 -22.7283 -22.0880 -22.0880 -22.0610 -22.0610 4.2894 4.2894 4.5543 4.5543 6.3077 6.3077 6.4177 6.4177 8.1325 8.1325 9.5330 9.5330 10.0361 10.0361 12.4893 12.4893 12.9891 12.9891 13.4478 13.4478 k = 0.0392 0.7704 0.8387 ( 2074 PWs) bands (ev): -45.9823 -45.9823 -22.7286 -22.7286 -22.0884 -22.0884 -22.0612 -22.0612 4.3968 4.3968 4.5762 4.5762 6.2862 6.2862 6.2888 6.2888 8.1366 8.1366 9.5325 9.5325 10.0262 10.0262 12.5320 12.5320 12.9905 12.9905 13.3886 13.3886 k = 0.0336 0.7857 0.8387 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7289 -22.7289 -22.0888 -22.0888 -22.0614 -22.0614 4.5046 4.5046 4.5891 4.5891 6.1595 6.1595 6.2733 6.2733 8.1466 8.1466 9.5302 9.5302 10.0175 10.0175 12.5785 12.5785 12.9916 12.9916 13.3220 13.3220 k = 0.0281 0.8009 0.8387 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7291 -22.7291 -22.0891 -22.0891 -22.0615 -22.0615 4.5922 4.5922 4.6119 4.6119 6.0375 6.0375 6.2638 6.2638 8.1617 8.1617 9.5262 9.5262 10.0100 10.0100 12.6284 12.6284 12.9928 12.9928 13.2578 13.2578 k = 0.0281 0.8009 0.8387 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7291 -22.7291 -22.0891 -22.0891 -22.0615 -22.0615 4.5922 4.5922 4.6119 4.6119 6.0375 6.0375 6.2638 6.2638 8.1617 8.1617 9.5262 9.5262 10.0100 10.0100 12.6284 12.6284 12.9928 12.9928 13.2578 13.2578 k = 0.0211 0.8101 0.8290 ( 2078 PWs) bands (ev): -45.9821 -45.9821 -22.7293 -22.7293 -22.0895 -22.0895 -22.0616 -22.0616 4.5902 4.5902 4.7431 4.7431 5.8924 5.8924 6.2567 6.2567 8.1814 8.1814 9.5208 9.5208 10.0023 10.0023 12.6935 12.6935 12.9940 12.9940 13.1802 13.1802 k = 0.0140 0.8193 0.8194 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0616 -22.0616 4.5886 4.5886 4.8621 4.8621 5.7635 5.7635 6.2517 6.2517 8.1956 8.1956 9.5170 9.5170 9.9969 9.9969 12.7571 12.7571 12.9947 12.9947 13.1077 13.1077 k = 0.0070 0.8286 0.8097 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5877 4.5877 4.9536 4.9536 5.6660 5.6660 6.2487 6.2487 8.2043 8.2043 9.5146 9.5146 9.9936 9.9936 12.8133 12.8133 12.9944 12.9944 13.0468 13.0468 k = 0.0000 0.8378 0.8001 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5873 4.5873 4.9903 4.9903 5.6273 5.6273 6.2477 6.2477 8.2072 8.2072 9.5139 9.5139 9.9925 9.9925 12.8404 12.8404 12.9929 12.9929 13.0196 13.0196 k = 0.0000 0.8378 0.8001 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5873 4.5873 4.9903 4.9903 5.6273 5.6273 6.2477 6.2477 8.2072 8.2072 9.5139 9.5139 9.9925 9.9925 12.8404 12.8404 12.9929 12.9929 13.0196 13.0196 k = 0.0000 0.8260 0.7888 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5757 4.5757 4.9913 4.9913 5.6287 5.6287 6.2539 6.2539 8.2154 8.2154 9.5110 9.5110 9.9925 9.9925 12.8441 12.8441 12.9936 12.9936 13.0200 13.0200 k = 0.0000 0.8142 0.7775 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0616 -22.0616 4.5415 4.5415 4.9940 4.9940 5.6327 5.6327 6.2719 6.2719 8.2397 8.2397 9.5024 9.5024 9.9923 9.9923 12.8549 12.8549 12.9958 12.9958 13.0213 13.0213 k = 0.0000 0.8024 0.7663 ( 2078 PWs) bands (ev): -45.9821 -45.9821 -22.7293 -22.7293 -22.0895 -22.0895 -22.0616 -22.0616 4.4867 4.4867 4.9985 4.9985 5.6394 5.6394 6.3001 6.3001 8.2799 8.2799 9.4883 9.4883 9.9920 9.9920 12.8728 12.8728 12.9994 12.9994 13.0234 13.0234 k = 0.0000 0.7906 0.7550 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7291 -22.7291 -22.0892 -22.0892 -22.0614 -22.0614 4.4142 4.4142 5.0049 5.0049 5.6487 5.6487 6.3361 6.3361 8.3352 8.3352 9.4690 9.4690 9.9916 9.9916 12.8973 12.8973 13.0044 13.0044 13.0265 13.0265 k = 0.0000 0.7788 0.7437 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7289 -22.7289 -22.0889 -22.0889 -22.0613 -22.0613 4.3270 4.3270 5.0130 5.0130 5.6608 5.6608 6.3777 6.3777 8.4049 8.4049 9.4448 9.4448 9.9910 9.9910 12.9278 12.9278 13.0110 13.0110 13.0305 13.0305 k = 0.0000 0.7670 0.7325 ( 2074 PWs) bands (ev): -45.9823 -45.9823 -22.7286 -22.7286 -22.0884 -22.0884 -22.0611 -22.0611 4.2278 4.2278 5.0229 5.0229 5.6755 5.6755 6.4228 6.4228 8.4878 8.4878 9.4160 9.4160 9.9904 9.9904 12.9637 12.9637 13.0189 13.0189 13.0357 13.0357 k = 0.0000 0.7552 0.7212 ( 2074 PWs) bands (ev): -45.9825 -45.9825 -22.7282 -22.7282 -22.0880 -22.0880 -22.0608 -22.0608 4.1191 4.1191 5.0346 5.0346 5.6929 5.6929 6.4700 6.4700 8.5827 8.5827 9.3832 9.3832 9.9897 9.9897 13.0034 13.0034 13.0289 13.0289 13.0426 13.0426 k = 0.0000 0.7434 0.7099 ( 2074 PWs) bands (ev): -45.9826 -45.9826 -22.7278 -22.7278 -22.0874 -22.0874 -22.0605 -22.0605 4.0030 4.0030 5.0480 5.0480 5.7130 5.7130 6.5184 6.5184 8.6882 8.6882 9.3469 9.3469 9.9890 9.9890 13.0323 13.0323 13.0489 13.0489 13.0569 13.0569 k = 0.0000 0.7316 0.6987 ( 2074 PWs) bands (ev): -45.9828 -45.9828 -22.7274 -22.7274 -22.0868 -22.0868 -22.0602 -22.0602 3.8813 3.8813 5.0631 5.0631 5.7357 5.7357 6.5672 6.5672 8.8029 8.8029 9.3074 9.3074 9.9882 9.9882 13.0432 13.0432 13.0625 13.0625 13.1018 13.1018 k = 0.0000 0.7198 0.6874 ( 2076 PWs) bands (ev): -45.9830 -45.9830 -22.7269 -22.7269 -22.0861 -22.0861 -22.0599 -22.0599 3.7552 3.7552 5.0799 5.0799 5.7611 5.7611 6.6161 6.6161 8.9252 8.9252 9.2655 9.2655 9.9874 9.9874 13.0521 13.0521 13.0776 13.0776 13.1525 13.1525 k = 0.0000 0.7080 0.6761 ( 2070 PWs) bands (ev): -45.9831 -45.9831 -22.7263 -22.7263 -22.0853 -22.0853 -22.0594 -22.0594 3.6259 3.6259 5.0984 5.0984 5.7892 5.7892 6.6650 6.6650 9.0534 9.0534 9.2215 9.2215 9.9866 9.9866 13.0609 13.0609 13.0955 13.0955 13.2053 13.2053 k = 0.0000 0.6962 0.6649 ( 2070 PWs) bands (ev): -45.9834 -45.9834 -22.7257 -22.7257 -22.0845 -22.0845 -22.0590 -22.0590 3.4943 3.4943 5.1185 5.1185 5.8199 5.8199 6.7139 6.7139 9.1733 9.1733 9.1887 9.1887 9.9858 9.9858 13.0700 13.0700 13.1163 13.1163 13.2590 13.2590 k = 0.0000 0.6844 0.6536 ( 2070 PWs) bands (ev): -45.9836 -45.9836 -22.7250 -22.7250 -22.0837 -22.0837 -22.0585 -22.0585 3.3612 3.3612 5.1401 5.1401 5.8532 5.8532 6.7627 6.7627 9.1286 9.1286 9.3224 9.3224 9.9850 9.9850 13.0796 13.0796 13.1403 13.1403 13.3126 13.3126 k = 0.0000 0.6726 0.6423 ( 2070 PWs) bands (ev): -45.9838 -45.9838 -22.7243 -22.7243 -22.0828 -22.0828 -22.0578 -22.0578 3.2270 3.2270 5.1633 5.1633 5.8893 5.8893 6.8116 6.8116 9.0809 9.0809 9.4594 9.4594 9.9844 9.9844 13.0897 13.0897 13.1678 13.1678 13.3653 13.3653 k = 0.0000 0.6608 0.6310 ( 2066 PWs) bands (ev): -45.9841 -45.9841 -22.7235 -22.7235 -22.0819 -22.0819 -22.0572 -22.0572 3.0924 3.0924 5.1879 5.1879 5.9279 5.9279 6.8607 6.8607 9.0329 9.0329 9.5963 9.5963 9.9839 9.9839 13.1004 13.1004 13.1992 13.1992 13.4162 13.4162 k = 0.0000 0.6490 0.6198 ( 2064 PWs) bands (ev): -45.9844 -45.9844 -22.7227 -22.7227 -22.0809 -22.0809 -22.0565 -22.0565 2.9576 2.9576 5.2140 5.2140 5.9692 5.9692 6.9098 6.9098 8.9848 8.9848 9.7312 9.7312 9.9835 9.9835 13.1116 13.1116 13.2350 13.2350 13.4645 13.4645 k = 0.0000 0.6372 0.6085 ( 2064 PWs) bands (ev): -45.9847 -45.9847 -22.7219 -22.7219 -22.0800 -22.0800 -22.0557 -22.0557 2.8232 2.8232 5.2414 5.2414 6.0131 6.0131 6.9590 6.9590 8.9369 8.9369 9.8624 9.8624 9.9833 9.9833 13.1233 13.1233 13.2760 13.2760 13.5094 13.5094 k = 0.0000 0.6254 0.5972 ( 2066 PWs) bands (ev): -45.9850 -45.9850 -22.7210 -22.7210 -22.0790 -22.0790 -22.0548 -22.0548 2.6893 2.6893 5.2700 5.2700 6.0596 6.0596 7.0082 7.0082 8.8897 8.8897 9.9797 9.9797 9.9920 9.9920 13.1356 13.1356 13.3227 13.3227 13.5502 13.5502 k = 0.0000 0.6136 0.5860 ( 2062 PWs) bands (ev): -45.9853 -45.9853 -22.7201 -22.7201 -22.0780 -22.0780 -22.0538 -22.0538 2.5563 2.5563 5.2999 5.2999 6.1087 6.1087 7.0573 7.0573 8.8433 8.8433 9.9829 9.9829 10.1079 10.1079 13.1484 13.1484 13.3756 13.3756 13.5864 13.5864 k = 0.0000 0.6018 0.5747 ( 2058 PWs) bands (ev): -45.9856 -45.9856 -22.7191 -22.7191 -22.0770 -22.0770 -22.0528 -22.0528 2.4243 2.4243 5.3309 5.3309 6.1605 6.1605 7.1061 7.1061 8.7980 8.7980 9.9834 9.9834 10.2182 10.2182 13.1617 13.1617 13.4343 13.4343 13.6174 13.6174 k = 0.0000 0.5900 0.5634 ( 2054 PWs) bands (ev): -45.9860 -45.9860 -22.7181 -22.7181 -22.0759 -22.0759 -22.0517 -22.0517 2.2935 2.2935 5.3629 5.3629 6.2148 6.2148 7.1545 7.1545 8.7542 8.7542 9.9841 9.9841 10.3185 10.3185 13.1755 13.1755 13.4949 13.4949 13.6423 13.6423 k = 0.0000 0.5782 0.5522 ( 2058 PWs) bands (ev): -45.9863 -45.9863 -22.7171 -22.7171 -22.0750 -22.0750 -22.0505 -22.0505 2.1641 2.1641 5.3959 5.3959 6.2717 6.2717 7.2022 7.2022 8.7120 8.7120 9.9850 9.9850 10.4077 10.4077 13.1897 13.1897 13.5359 13.5359 13.6559 13.6559 k = 0.0000 0.5664 0.5409 ( 2062 PWs) bands (ev): -45.9867 -45.9867 -22.7161 -22.7161 -22.0741 -22.0741 -22.0492 -22.0492 2.0362 2.0362 5.4296 5.4296 6.3312 6.3312 7.2489 7.2489 8.6716 8.6716 9.9863 9.9863 10.4850 10.4850 13.2044 13.2044 13.5233 13.5233 13.6717 13.6717 k = 0.0000 0.5546 0.5296 ( 2062 PWs) bands (ev): -45.9871 -45.9871 -22.7150 -22.7150 -22.0731 -22.0731 -22.0478 -22.0478 1.9099 1.9099 5.4640 5.4640 6.3932 6.3932 7.2943 7.2943 8.6333 8.6333 9.9879 9.9879 10.5503 10.5503 13.2194 13.2194 13.4894 13.4894 13.6815 13.6815 k = 0.0000 0.5428 0.5184 ( 2062 PWs) bands (ev): -45.9875 -45.9875 -22.7139 -22.7139 -22.0722 -22.0722 -22.0463 -22.0463 1.7854 1.7854 5.4991 5.4991 6.4577 6.4577 7.3379 7.3379 8.5973 8.5973 9.9899 9.9899 10.6040 10.6040 13.2348 13.2348 13.4568 13.4568 13.6844 13.6844 k = 0.0000 0.5310 0.5071 ( 2066 PWs) bands (ev): -45.9879 -45.9879 -22.7128 -22.7128 -22.0713 -22.0713 -22.0447 -22.0447 1.6627 1.6627 5.5345 5.5345 6.5248 6.5248 7.3794 7.3794 8.5638 8.5638 9.9922 9.9922 10.6471 10.6471 13.2504 13.2504 13.4296 13.4296 13.6815 13.6815 k = 0.0000 0.5192 0.4958 ( 2062 PWs) bands (ev): -45.9883 -45.9883 -22.7116 -22.7116 -22.0704 -22.0704 -22.0430 -22.0430 1.5420 1.5420 5.5702 5.5702 6.5944 6.5944 7.4182 7.4182 8.5330 8.5330 9.9950 9.9950 10.6809 10.6809 13.2664 13.2664 13.4083 13.4083 13.6735 13.6735 k = 0.0000 0.5074 0.4846 ( 2058 PWs) bands (ev): -45.9887 -45.9887 -22.7104 -22.7104 -22.0695 -22.0695 -22.0412 -22.0412 1.4233 1.4233 5.6060 5.6060 6.6664 6.6664 7.4539 7.4539 8.5050 8.5050 9.9981 9.9981 10.7073 10.7073 13.2825 13.2825 13.3926 13.3926 13.6609 13.6609 k = 0.0000 0.4956 0.4733 ( 2048 PWs) bands (ev): -45.9891 -45.9891 -22.7091 -22.7091 -22.0686 -22.0686 -22.0393 -22.0393 1.3067 1.3067 5.6418 5.6418 6.7409 6.7409 7.4861 7.4861 8.4801 8.4801 10.0017 10.0017 10.7282 10.7282 13.2988 13.2988 13.3818 13.3818 13.6440 13.6440 k = 0.0000 0.4838 0.4620 ( 2044 PWs) bands (ev): -45.9896 -45.9896 -22.7079 -22.7079 -22.0678 -22.0678 -22.0374 -22.0374 1.1923 1.1923 5.6774 5.6774 6.8179 6.8179 7.5142 7.5142 8.4585 8.4585 10.0058 10.0058 10.7455 10.7455 13.3150 13.3150 13.3755 13.3755 13.6235 13.6235 k = 0.0000 0.4720 0.4507 ( 2050 PWs) bands (ev): -45.9900 -45.9900 -22.7067 -22.7067 -22.0670 -22.0670 -22.0354 -22.0354 1.0800 1.0800 5.7127 5.7127 6.8973 6.8973 7.5379 7.5379 8.4402 8.4402 10.0103 10.0103 10.7613 10.7613 13.3308 13.3308 13.3733 13.3733 13.5998 13.5998 k = 0.0000 0.4602 0.4395 ( 2054 PWs) bands (ev): -45.9904 -45.9904 -22.7055 -22.7055 -22.0663 -22.0663 -22.0334 -22.0334 0.9700 0.9700 5.7473 5.7473 6.9790 6.9790 7.5566 7.5566 8.4256 8.4256 10.0152 10.0152 10.7773 10.7773 13.3454 13.3454 13.3752 13.3752 13.5734 13.5734 k = 0.0000 0.4484 0.4282 ( 2058 PWs) bands (ev): -45.9909 -45.9909 -22.7043 -22.7043 -22.0656 -22.0656 -22.0313 -22.0313 0.8624 0.8624 5.7813 5.7813 7.0632 7.0632 7.5700 7.5700 8.4146 8.4146 10.0206 10.0206 10.7951 10.7951 13.3573 13.3573 13.3823 13.3823 13.5448 13.5448 k = 0.0000 0.4366 0.4169 ( 2060 PWs) bands (ev): -45.9913 -45.9913 -22.7030 -22.7030 -22.0648 -22.0648 -22.0292 -22.0292 0.7571 0.7571 5.8143 5.8143 7.1496 7.1496 7.5780 7.5780 8.4076 8.4076 10.0264 10.0264 10.8159 10.8159 13.3656 13.3656 13.3947 13.3947 13.5146 13.5146 k = 0.0000 0.4248 0.4057 ( 2056 PWs) bands (ev): -45.9918 -45.9918 -22.7018 -22.7018 -22.0641 -22.0641 -22.0270 -22.0270 0.6542 0.6542 5.8463 5.8463 7.2383 7.2383 7.5804 7.5804 8.4045 8.4045 10.0327 10.0327 10.8410 10.8410 13.3723 13.3723 13.4101 13.4101 13.4833 13.4833 k = 0.0000 0.4130 0.3944 ( 2060 PWs) bands (ev): -45.9922 -45.9922 -22.7005 -22.7005 -22.0634 -22.0634 -22.0248 -22.0248 0.5537 0.5537 5.8771 5.8771 7.3293 7.3293 7.5771 7.5771 8.4055 8.4055 10.0395 10.0395 10.8709 10.8709 13.3782 13.3782 13.4263 13.4263 13.4522 13.4522 k = 0.0000 0.4012 0.3831 ( 2060 PWs) bands (ev): -45.9927 -45.9927 -22.6993 -22.6993 -22.0627 -22.0627 -22.0226 -22.0226 0.4557 0.4557 5.9065 5.9065 7.4224 7.4224 7.5684 7.5684 8.4108 8.4108 10.0467 10.0467 10.9063 10.9063 13.3817 13.3817 13.4208 13.4208 13.4454 13.4454 k = 0.0000 0.3894 0.3719 ( 2052 PWs) bands (ev): -45.9931 -45.9931 -22.6980 -22.6980 -22.0619 -22.0619 -22.0203 -22.0203 0.3603 0.3603 5.9343 5.9343 7.5171 7.5171 7.5548 7.5548 8.4202 8.4202 10.0543 10.0543 10.9475 10.9475 13.3713 13.3713 13.4058 13.4058 13.4625 13.4625 k = 0.0000 0.3776 0.3606 ( 2056 PWs) bands (ev): -45.9936 -45.9936 -22.6967 -22.6967 -22.0613 -22.0613 -22.0180 -22.0180 0.2674 0.2674 5.9606 5.9606 7.5344 7.5344 7.6157 7.6157 8.4339 8.4339 10.0623 10.0623 10.9945 10.9945 13.3433 13.3433 13.4083 13.4083 13.4802 13.4802 k = 0.0000 0.3658 0.3493 ( 2058 PWs) bands (ev): -45.9940 -45.9940 -22.6955 -22.6955 -22.0606 -22.0606 -22.0157 -22.0157 0.1770 0.1770 5.9852 5.9852 7.5107 7.5107 7.7149 7.7149 8.4519 8.4519 10.0707 10.0707 11.0472 11.0472 13.3118 13.3118 13.4148 13.4148 13.4982 13.4982 k = 0.0000 0.3540 0.3381 ( 2058 PWs) bands (ev): -45.9945 -45.9945 -22.6943 -22.6943 -22.0599 -22.0599 -22.0134 -22.0134 0.0893 0.0893 6.0080 6.0080 7.4827 7.4827 7.8163 7.8163 8.4740 8.4740 10.0795 10.0795 11.1053 11.1053 13.2802 13.2802 13.4222 13.4222 13.5163 13.5163 k = 0.0000 0.3422 0.3268 ( 2058 PWs) bands (ev): -45.9949 -45.9949 -22.6931 -22.6931 -22.0593 -22.0593 -22.0112 -22.0112 0.0042 0.0042 6.0290 6.0290 7.4509 7.4509 7.9196 7.9196 8.5003 8.5003 10.0887 10.0887 11.1686 11.1686 13.2493 13.2493 13.4297 13.4297 13.5345 13.5345 k = 0.0000 0.3304 0.3155 ( 2051 PWs) bands (ev): -45.9953 -45.9953 -22.6918 -22.6918 -22.0586 -22.0586 -22.0088 -22.0088 -0.0782 -0.0782 6.0483 6.0483 7.4160 7.4160 8.0247 8.0247 8.5305 8.5305 10.0981 10.0981 11.2364 11.2364 13.2197 13.2197 13.4372 13.4372 13.5527 13.5527 k = 0.0000 0.3186 0.3043 ( 2049 PWs) bands (ev): -45.9958 -45.9958 -22.6907 -22.6907 -22.0579 -22.0579 -22.0066 -22.0066 -0.1580 -0.1580 6.0657 6.0657 7.3783 7.3783 8.1315 8.1315 8.5645 8.5645 10.1079 10.1079 11.3083 11.3083 13.1916 13.1916 13.4446 13.4446 13.5711 13.5711 k = 0.0000 0.3068 0.2930 ( 2045 PWs) bands (ev): -45.9962 -45.9962 -22.6895 -22.6895 -22.0572 -22.0572 -22.0043 -22.0043 -0.2350 -0.2350 6.0815 6.0815 7.3385 7.3385 8.2399 8.2399 8.6021 8.6021 10.1178 10.1178 11.3835 11.3835 13.1653 13.1653 13.4517 13.4517 13.5895 13.5895 k = 0.0000 0.2950 0.2817 ( 2045 PWs) bands (ev): -45.9966 -45.9966 -22.6883 -22.6883 -22.0566 -22.0566 -22.0021 -22.0021 -0.3093 -0.3093 6.0955 6.0955 7.2970 7.2970 8.3498 8.3498 8.6430 8.6430 10.1281 10.1281 11.4616 11.4616 13.1412 13.1412 13.4586 13.4586 13.6081 13.6081 k = 0.0000 0.2832 0.2704 ( 2037 PWs) bands (ev): -45.9970 -45.9970 -22.6872 -22.6872 -22.0559 -22.0559 -21.9999 -21.9999 -0.3809 -0.3809 6.1080 6.1080 7.2543 7.2543 8.4610 8.4610 8.6871 8.6871 10.1384 10.1384 11.5418 11.5418 13.1195 13.1195 13.4652 13.4652 13.6268 13.6268 k = 0.0000 0.2714 0.2592 ( 2037 PWs) bands (ev): -45.9974 -45.9974 -22.6861 -22.6861 -22.0553 -22.0553 -21.9978 -21.9978 -0.4497 -0.4497 6.1189 6.1189 7.2109 7.2109 8.5734 8.5734 8.7339 8.7339 10.1489 10.1489 11.6234 11.6234 13.1004 13.1004 13.4715 13.4715 13.6457 13.6457 k = 0.0000 0.2596 0.2479 ( 2041 PWs) bands (ev): -45.9978 -45.9978 -22.6851 -22.6851 -22.0547 -22.0547 -21.9958 -21.9958 -0.5157 -0.5157 6.1285 6.1285 7.1670 7.1670 8.6866 8.6866 8.7834 8.7834 10.1596 10.1596 11.7057 11.7057 13.0842 13.0842 13.4776 13.4776 13.6649 13.6649 k = 0.0000 0.2478 0.2366 ( 2041 PWs) bands (ev): -45.9981 -45.9981 -22.6840 -22.6840 -22.0541 -22.0541 -21.9938 -21.9938 -0.5789 -0.5789 6.1368 6.1368 7.1231 7.1231 8.7995 8.7995 8.8359 8.8359 10.1702 10.1702 11.7881 11.7881 13.0712 13.0712 13.4835 13.4835 13.6843 13.6843 k = 0.0000 0.2360 0.2254 ( 2041 PWs) bands (ev): -45.9985 -45.9985 -22.6831 -22.6831 -22.0535 -22.0535 -21.9918 -21.9918 -0.6393 -0.6393 6.1439 6.1439 7.0796 7.0796 8.8843 8.8843 8.9189 8.9189 10.1808 10.1808 11.8697 11.8697 13.0617 13.0617 13.4892 13.4892 13.7042 13.7042 k = 0.0000 0.2242 0.2141 ( 2043 PWs) bands (ev): -45.9988 -45.9988 -22.6821 -22.6821 -22.0530 -22.0530 -21.9899 -21.9899 -0.6968 -0.6968 6.1499 6.1499 7.0367 7.0367 8.9399 8.9399 9.0327 9.0327 10.1914 10.1914 11.9499 11.9499 13.0558 13.0558 13.4947 13.4947 13.7245 13.7245 k = 0.0000 0.2124 0.2028 ( 2035 PWs) bands (ev): -45.9992 -45.9992 -22.6812 -22.6812 -22.0524 -22.0524 -21.9880 -21.9880 -0.7515 -0.7515 6.1550 6.1550 6.9947 6.9947 8.9952 8.9952 9.1477 9.1477 10.2019 10.2019 12.0281 12.0281 13.0540 13.0540 13.5001 13.5001 13.7454 13.7454 k = 0.0000 0.2006 0.1916 ( 2035 PWs) bands (ev): -45.9995 -45.9995 -22.6803 -22.6803 -22.0519 -22.0519 -21.9862 -21.9862 -0.8033 -0.8033 6.1592 6.1592 6.9538 6.9538 9.0507 9.0507 9.2627 9.2627 10.2122 10.2122 12.1037 12.1037 13.0564 13.0564 13.5054 13.5054 13.7670 13.7670 k = 0.0000 0.1888 0.1803 ( 2031 PWs) bands (ev): -45.9998 -45.9998 -22.6794 -22.6794 -22.0514 -22.0514 -21.9845 -21.9845 -0.8522 -0.8522 6.1627 6.1627 6.9144 6.9144 9.1061 9.1061 9.3771 9.3771 10.2223 10.2223 12.1759 12.1759 13.0634 13.0634 13.5107 13.5107 13.7896 13.7896 k = 0.0000 0.1770 0.1690 ( 2027 PWs) bands (ev): -46.0001 -46.0001 -22.6786 -22.6786 -22.0509 -22.0509 -21.9829 -21.9829 -0.8982 -0.8982 6.1655 6.1655 6.8765 6.8765 9.1610 9.1610 9.4904 9.4904 10.2322 10.2322 12.2445 12.2445 13.0752 13.0752 13.5159 13.5159 13.8132 13.8132 k = 0.0000 0.1652 0.1578 ( 2027 PWs) bands (ev): -46.0003 -46.0003 -22.6779 -22.6779 -22.0504 -22.0504 -21.9813 -21.9813 -0.9413 -0.9413 6.1678 6.1678 6.8403 6.8403 9.2149 9.2149 9.6022 9.6022 10.2417 10.2417 12.3088 12.3088 13.0919 13.0919 13.5212 13.5212 13.8382 13.8382 k = 0.0000 0.1534 0.1465 ( 2031 PWs) bands (ev): -46.0006 -46.0006 -22.6772 -22.6772 -22.0500 -22.0500 -21.9799 -21.9799 -0.9815 -0.9815 6.1696 6.1696 6.8060 6.8060 9.2674 9.2674 9.7119 9.7119 10.2508 10.2508 12.3685 12.3685 13.1140 13.1140 13.5263 13.5263 13.8648 13.8648 k = 0.0000 0.1416 0.1352 ( 2037 PWs) bands (ev): -46.0008 -46.0008 -22.6766 -22.6766 -22.0497 -22.0497 -21.9786 -21.9786 -1.0187 -1.0187 6.1709 6.1709 6.7738 6.7738 9.3181 9.3181 9.8189 9.8189 10.2595 10.2595 12.4235 12.4235 13.1416 13.1416 13.5315 13.5315 13.8933 13.8933 k = 0.0000 0.1298 0.1240 ( 2033 PWs) bands (ev): -46.0011 -46.0011 -22.6760 -22.6760 -22.0493 -22.0493 -21.9773 -21.9773 -1.0530 -1.0530 6.1720 6.1720 6.7438 6.7438 9.3665 9.3665 9.9225 9.9225 10.2678 10.2678 12.4735 12.4735 13.1748 13.1748 13.5366 13.5366 13.9240 13.9240 k = 0.0000 0.1180 0.1127 ( 2041 PWs) bands (ev): -46.0013 -46.0013 -22.6755 -22.6755 -22.0490 -22.0490 -21.9762 -21.9762 -1.0844 -1.0844 6.1728 6.1728 6.7160 6.7160 9.4122 9.4122 10.0219 10.0219 10.2755 10.2755 12.5185 12.5185 13.2138 13.2138 13.5415 13.5415 13.9574 13.9574 k = 0.0000 0.1062 0.1014 ( 2037 PWs) bands (ev): -46.0015 -46.0015 -22.6749 -22.6749 -22.0486 -22.0486 -21.9751 -21.9751 -1.1128 -1.1128 6.1733 6.1733 6.6906 6.6906 9.4549 9.4549 10.1162 10.1162 10.2827 10.2827 12.5585 12.5585 13.2587 13.2587 13.5463 13.5463 13.9938 13.9938 k = 0.0000 0.0944 0.0901 ( 2041 PWs) bands (ev): -46.0016 -46.0016 -22.6745 -22.6745 -22.0484 -22.0484 -21.9742 -21.9742 -1.1382 -1.1382 6.1737 6.1737 6.6677 6.6677 9.4940 9.4940 10.2045 10.2045 10.2893 10.2893 12.5937 12.5937 13.3093 13.3093 13.5508 13.5508 14.0338 14.0338 k = 0.0000 0.0826 0.0789 ( 2041 PWs) bands (ev): -46.0018 -46.0018 -22.6741 -22.6741 -22.0481 -22.0481 -21.9734 -21.9734 -1.1607 -1.1607 6.1739 6.1739 6.6473 6.6473 9.5294 9.5294 10.2844 10.2844 10.2967 10.2967 12.6241 12.6241 13.3656 13.3656 13.5551 13.5551 14.0777 14.0777 k = 0.0000 0.0708 0.0676 ( 2041 PWs) bands (ev): -46.0019 -46.0019 -22.6737 -22.6737 -22.0479 -22.0479 -21.9726 -21.9726 -1.1801 -1.1801 6.1740 6.1740 6.6295 6.6295 9.5606 9.5606 10.2997 10.2997 10.3599 10.3599 12.6499 12.6499 13.4269 13.4269 13.5590 13.5590 14.1260 14.1260 k = 0.0000 0.0590 0.0563 ( 2037 PWs) bands (ev): -46.0020 -46.0020 -22.6734 -22.6734 -22.0476 -22.0476 -21.9720 -21.9720 -1.1966 -1.1966 6.1741 6.1741 6.6144 6.6144 9.5875 9.5875 10.3043 10.3043 10.4242 10.4242 12.6713 12.6713 13.4924 13.4924 13.5629 13.5629 14.1789 14.1789 k = 0.0000 0.0472 0.0451 ( 2045 PWs) bands (ev): -46.0021 -46.0021 -22.6732 -22.6732 -22.0475 -22.0475 -21.9715 -21.9715 -1.2101 -1.2101 6.1741 6.1741 6.6019 6.6019 9.6099 9.6099 10.3079 10.3079 10.4786 10.4786 12.6885 12.6885 13.5546 13.5546 13.5726 13.5726 14.2361 14.2361 k = 0.0000 0.0354 0.0338 ( 2041 PWs) bands (ev): -46.0022 -46.0022 -22.6730 -22.6730 -22.0474 -22.0474 -21.9711 -21.9711 -1.2206 -1.2206 6.1741 6.1741 6.5922 6.5922 9.6274 9.6274 10.3108 10.3108 10.5220 10.5220 12.7017 12.7017 13.5656 13.5656 13.6334 13.6334 14.2966 14.2966 k = 0.0000 0.0236 0.0225 ( 2041 PWs) bands (ev): -46.0022 -46.0022 -22.6729 -22.6729 -22.0473 -22.0473 -21.9708 -21.9708 -1.2281 -1.2281 6.1741 6.1741 6.5853 6.5853 9.6400 9.6400 10.3129 10.3129 10.5536 10.5536 12.7110 12.7110 13.5678 13.5678 13.6974 13.6974 14.3540 14.3540 k = 0.0000 0.0118 0.0113 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.2326 -1.2326 6.1741 6.1741 6.5811 6.5811 9.6476 9.6476 10.3141 10.3141 10.5729 10.5729 12.7166 12.7166 13.5690 13.5690 13.7468 13.7468 14.3192 14.3192 k = 0.0000 0.0000 0.0000 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2341 -1.2341 6.1741 6.1741 6.5797 6.5797 9.6502 9.6502 10.3146 10.3146 10.5793 10.5793 12.7184 12.7184 13.5693 13.5693 13.7662 13.7662 14.2941 14.2941 k = 0.0000 0.0000 0.0000 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2341 -1.2341 6.1741 6.1741 6.5797 6.5797 9.6502 9.6502 10.3146 10.3146 10.5793 10.5793 12.7184 12.7184 13.5693 13.5693 13.7662 13.7662 14.2941 14.2941 k = 0.0143 0.0052-0.0054 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2330 -1.2330 6.1201 6.1201 6.6349 6.6349 9.6513 9.6513 10.3139 10.3139 10.5803 10.5803 12.7185 12.7185 13.5301 13.5301 13.8067 13.8067 14.2807 14.2807 k = 0.0286 0.0104-0.0109 ( 2043 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2295 -1.2295 6.0030 6.0030 6.7557 6.7557 9.6547 9.6547 10.3119 10.3119 10.5833 10.5833 12.7185 12.7185 13.4529 13.4529 13.8879 13.8879 14.2422 14.2422 k = 0.0429 0.0156-0.0163 ( 2043 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.2239 -1.2239 5.8657 5.8657 6.8990 6.8990 9.6604 9.6604 10.3087 10.3087 10.5882 10.5882 12.7186 12.7186 13.3673 13.3673 13.9798 13.9798 14.1832 14.1832 k = 0.0571 0.0208-0.0218 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.2159 -1.2159 5.7220 5.7220 7.0512 7.0512 9.6683 9.6683 10.3041 10.3041 10.5951 10.5951 12.7187 12.7187 13.2808 13.2808 14.0751 14.0751 14.1091 14.1091 k = 0.0714 0.0260-0.0272 ( 2041 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.2058 -1.2058 5.5763 5.5763 7.2076 7.2076 9.6784 9.6784 10.2984 10.2984 10.6040 10.6040 12.7188 12.7188 13.1955 13.1955 14.0235 14.0235 14.1721 14.1721 k = 0.0857 0.0312-0.0326 ( 2035 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.1934 -1.1934 5.4305 5.4305 7.3664 7.3664 9.6908 9.6908 10.2915 10.2915 10.6149 10.6149 12.7187 12.7187 13.1126 13.1126 13.9307 13.9307 14.1635 14.1635 k = 0.1000 0.0364-0.0381 ( 2047 PWs) bands (ev): -46.0023 -46.0023 -22.6729 -22.6729 -22.0475 -22.0475 -21.9706 -21.9706 -1.1789 -1.1789 5.2855 5.2855 7.5264 7.5264 9.7055 9.7055 10.2836 10.2836 10.6277 10.6277 12.7183 12.7183 13.0329 13.0329 13.8329 13.8329 14.0862 14.0862 k = 0.1143 0.0416-0.0435 ( 2039 PWs) bands (ev): -46.0023 -46.0023 -22.6729 -22.6729 -22.0475 -22.0475 -21.9706 -21.9706 -1.1624 -1.1624 5.1419 5.1419 7.6871 7.6871 9.7223 9.7223 10.2747 10.2747 10.6425 10.6425 12.7172 12.7172 12.9572 12.9572 13.7318 13.7318 14.0052 14.0052 k = 0.1286 0.0467-0.0489 ( 2039 PWs) bands (ev): -46.0023 -46.0023 -22.6730 -22.6730 -22.0475 -22.0475 -21.9706 -21.9706 -1.1437 -1.1437 5.0000 5.0000 7.8480 7.8480 9.7414 9.7414 10.2649 10.2649 10.6592 10.6592 12.7145 12.7145 12.8869 12.8869 13.6285 13.6285 13.9216 13.9216 k = 0.1429 0.0519-0.0544 ( 2043 PWs) bands (ev): -46.0023 -46.0023 -22.6731 -22.6731 -22.0477 -22.0477 -21.9706 -21.9706 -1.1231 -1.1231 4.8601 4.8601 8.0084 8.0084 9.7627 9.7627 10.2543 10.2543 10.6778 10.6778 12.7078 12.7078 12.8249 12.8249 13.5240 13.5240 13.8361 13.8361 k = 0.1571 0.0571-0.0598 ( 2052 PWs) bands (ev): -46.0023 -46.0023 -22.6732 -22.6732 -22.0478 -22.0478 -21.9707 -21.9707 -1.1006 -1.1006 4.7224 4.7224 8.1681 8.1681 9.7861 9.7861 10.2431 10.2431 10.6984 10.6984 12.6900 12.6900 12.7786 12.7786 13.4188 13.4188 13.7494 13.7494 k = 0.1714 0.0623-0.0653 ( 2044 PWs) bands (ev): -46.0023 -46.0023 -22.6732 -22.6732 -22.0479 -22.0479 -21.9706 -21.9706 -1.0763 -1.0763 4.5872 4.5872 8.3265 8.3265 9.8117 9.8117 10.2313 10.2313 10.7209 10.7209 12.6540 12.6540 12.7556 12.7556 13.3135 13.3135 13.6621 13.6621 k = 0.1857 0.0675-0.0707 ( 2040 PWs) bands (ev): -46.0023 -46.0023 -22.6732 -22.6732 -22.0479 -22.0479 -21.9706 -21.9706 -1.0503 -1.0503 4.4546 4.4546 8.4831 8.4831 9.8394 9.8394 10.2190 10.2190 10.7452 10.7452 12.6089 12.6089 12.7473 12.7473 13.2085 13.2085 13.5744 13.5744 k = 0.2000 0.0727-0.0761 ( 2048 PWs) bands (ev): -46.0023 -46.0023 -22.6734 -22.6734 -22.0481 -22.0481 -21.9706 -21.9706 -1.0226 -1.0226 4.3247 4.3247 8.6374 8.6374 9.8692 9.8692 10.2064 10.2064 10.7715 10.7715 12.5644 12.5644 12.7443 12.7443 13.1039 13.1039 13.4867 13.4867 k = 0.2143 0.0779-0.0816 ( 2048 PWs) bands (ev): -46.0023 -46.0023 -22.6734 -22.6734 -22.0482 -22.0482 -21.9707 -21.9707 -0.9936 -0.9936 4.1979 4.1979 8.7887 8.7887 9.9010 9.9010 10.1936 10.1936 10.7995 10.7995 12.5244 12.5244 12.7434 12.7434 13.0001 13.0001 13.3992 13.3992 k = 0.2286 0.0831-0.0870 ( 2048 PWs) bands (ev): -46.0023 -46.0023 -22.6735 -22.6735 -22.0483 -22.0483 -21.9707 -21.9707 -0.9632 -0.9632 4.0743 4.0743 8.9363 8.9363 9.9349 9.9349 10.1807 10.1807 10.8295 10.8295 12.4906 12.4906 12.7433 12.7433 12.8973 12.8973 13.3121 13.3121 k = 0.2429 0.0883-0.0925 ( 2052 PWs) bands (ev): -46.0023 -46.0023 -22.6736 -22.6736 -22.0485 -22.0485 -21.9707 -21.9707 -0.9316 -0.9316 3.9541 3.9541 9.0795 9.0795 9.9707 9.9707 10.1677 10.1677 10.8612 10.8612 12.4642 12.4642 12.7433 12.7433 12.7961 12.7961 13.2257 13.2257 k = 0.2571 0.0935-0.0979 ( 2052 PWs) bands (ev): -46.0023 -46.0023 -22.6737 -22.6737 -22.0486 -22.0486 -21.9707 -21.9707 -0.8991 -0.8991 3.8375 3.8375 9.2174 9.2174 10.0084 10.0084 10.1549 10.1549 10.8946 10.8946 12.4459 12.4459 12.6937 12.6937 12.7460 12.7460 13.1400 13.1400 k = 0.2714 0.0987-0.1033 ( 2054 PWs) bands (ev): -46.0023 -46.0023 -22.6737 -22.6737 -22.0487 -22.0487 -21.9707 -21.9707 -0.8658 -0.8658 3.7248 3.7248 9.3492 9.3492 10.0480 10.0480 10.1423 10.1423 10.9298 10.9298 12.4366 12.4366 12.5953 12.5953 12.7464 12.7464 13.0552 13.0552 k = 0.2857 0.1039-0.1088 ( 2046 PWs) bands (ev): -46.0022 -46.0022 -22.6738 -22.6738 -22.0487 -22.0487 -21.9707 -21.9707 -0.8319 -0.8319 3.6163 3.6163 9.4739 9.4739 10.0892 10.0892 10.1300 10.1300 10.9667 10.9667 12.4370 12.4370 12.4979 12.4979 12.7473 12.7473 12.9715 12.9715 k = 0.3000 0.1091-0.1142 ( 2042 PWs) bands (ev): -46.0022 -46.0022 -22.6738 -22.6738 -22.0488 -22.0488 -21.9707 -21.9707 -0.7978 -0.7978 3.5121 3.5121 9.5906 9.5906 10.1169 10.1169 10.1333 10.1333 11.0052 11.0052 12.4021 12.4021 12.4479 12.4479 12.7483 12.7483 12.8890 12.8890 k = 0.3143 0.1143-0.1197 ( 2048 PWs) bands (ev): -46.0022 -46.0022 -22.6739 -22.6739 -22.0490 -22.0490 -21.9707 -21.9707 -0.7636 -0.7636 3.4127 3.4127 9.6985 9.6985 10.1060 10.1060 10.1773 10.1773 11.0453 11.0453 12.3083 12.3083 12.4696 12.4696 12.7488 12.7488 12.8083 12.8083 k = 0.3286 0.1195-0.1251 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6740 -22.6740 -22.0491 -22.0491 -21.9707 -21.9707 -0.7298 -0.7298 3.3182 3.3182 9.7969 9.7969 10.0951 10.0951 10.2232 10.2232 11.0868 11.0868 12.2166 12.2166 12.5024 12.5024 12.7246 12.7246 12.7537 12.7537 k = 0.3429 0.1247-0.1305 ( 2054 PWs) bands (ev): -46.0022 -46.0022 -22.6741 -22.6741 -22.0492 -22.0492 -21.9707 -21.9707 -0.6965 -0.6965 3.2292 3.2292 9.8853 9.8853 10.0847 10.0847 10.2703 10.2703 11.1297 11.1297 12.1272 12.1272 12.5464 12.5464 12.6482 12.6482 12.7529 12.7529 k = 0.3571 0.1299-0.1360 ( 2054 PWs) bands (ev): -46.0022 -46.0022 -22.6741 -22.6741 -22.0493 -22.0493 -21.9708 -21.9708 -0.6642 -0.6642 3.1459 3.1459 9.9636 9.9636 10.0750 10.0750 10.3185 10.3185 11.1738 11.1738 12.0404 12.0404 12.5716 12.5716 12.6014 12.6014 12.7538 12.7538 k = 0.3714 0.1350-0.1414 ( 2058 PWs) bands (ev): -46.0022 -46.0022 -22.6742 -22.6742 -22.0494 -22.0494 -21.9708 -21.9708 -0.6332 -0.6332 3.0687 3.0687 10.0317 10.0317 10.0661 10.0661 10.3673 10.3673 11.2189 11.2189 11.9566 11.9566 12.4972 12.4972 12.6658 12.6658 12.7548 12.7548 k = 0.3857 0.1402-0.1468 ( 2060 PWs) bands (ev): -46.0022 -46.0022 -22.6743 -22.6743 -22.0495 -22.0495 -21.9708 -21.9708 -0.6040 -0.6040 2.9981 2.9981 10.0579 10.0579 10.0899 10.0899 10.4163 10.4163 11.2648 11.2648 11.8761 11.8761 12.4249 12.4249 12.7383 12.7383 12.7564 12.7564 k = 0.4000 0.1454-0.1523 ( 2068 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0496 -22.0496 -21.9709 -21.9709 -0.5769 -0.5769 2.9345 2.9345 10.0506 10.0506 10.1389 10.1389 10.4651 10.4651 11.3111 11.3111 11.7996 11.7996 12.3553 12.3553 12.7562 12.7562 12.8191 12.8191 k = 0.4143 0.1506-0.1577 ( 2062 PWs) bands (ev): -46.0022 -46.0022 -22.6743 -22.6743 -22.0496 -22.0496 -21.9709 -21.9709 -0.5523 -0.5523 2.8783 2.8783 10.0441 10.0441 10.1792 10.1792 10.5127 10.5127 11.3572 11.3572 11.7279 11.7279 12.2888 12.2888 12.7571 12.7571 12.9029 12.9029 k = 0.4286 0.1558-0.1632 ( 2062 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0496 -22.0496 -21.9709 -21.9709 -0.5307 -0.5307 2.8298 2.8298 10.0386 10.0386 10.2117 10.2117 10.5582 10.5582 11.4024 11.4024 11.6620 11.6620 12.2264 12.2264 12.7578 12.7578 12.9877 12.9877 k = 0.4429 0.1610-0.1686 ( 2054 PWs) bands (ev): -46.0022 -46.0022 -22.6743 -22.6743 -22.0496 -22.0496 -21.9709 -21.9709 -0.5124 -0.5124 2.7896 2.7896 10.0341 10.0341 10.2370 10.2370 10.6001 10.6001 11.4454 11.4454 11.6034 11.6034 12.1693 12.1693 12.7584 12.7584 13.0696 13.0696 k = 0.4571 0.1662-0.1740 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0496 -22.0496 -21.9709 -21.9709 -0.4978 -0.4978 2.7579 2.7579 10.0305 10.0305 10.2560 10.2560 10.6365 10.6365 11.4843 11.4843 11.5540 11.5540 12.1194 12.1194 12.7588 12.7588 13.1435 13.1435 k = 0.4714 0.1714-0.1795 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0496 -22.0496 -21.9709 -21.9709 -0.4871 -0.4871 2.7350 2.7350 10.0280 10.0280 10.2691 10.2691 10.6653 10.6653 11.5149 11.5149 11.5175 11.5175 12.0794 12.0794 12.7592 12.7592 13.2035 13.2035 k = 0.4857 0.1766-0.1849 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4806 -0.4806 2.7212 2.7212 10.0264 10.0264 10.2768 10.2768 10.6839 10.6839 11.4917 11.4917 11.5383 11.5383 12.0529 12.0529 12.7594 12.7594 13.2431 13.2431 k = 0.5000 0.1818-0.1904 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4784 -0.4784 2.7166 2.7166 10.0259 10.0259 10.2793 10.2793 10.6903 10.6903 11.4834 11.4834 11.5460 11.5460 12.0436 12.0436 12.7594 12.7594 13.2570 13.2570 k = 0.5000 0.1818-0.1904 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4784 -0.4784 2.7166 2.7166 10.0259 10.0259 10.2793 10.2793 10.6903 10.6903 11.4834 11.4834 11.5460 11.5460 12.0436 12.0436 12.7594 12.7594 13.2570 13.2570 k = 0.5075 0.1720-0.1801 ( 2048 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4771 -0.4771 2.7180 2.7180 10.0170 10.0170 10.2748 10.2748 10.6967 10.6967 11.4820 11.4820 11.5424 11.5424 12.0398 12.0398 12.7611 12.7611 13.2625 13.2625 k = 0.5150 0.1621-0.1698 ( 2042 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9710 -21.9710 -0.4732 -0.4732 2.7222 2.7222 9.9914 9.9914 10.2612 10.2612 10.7149 10.7149 11.4778 11.4778 11.5319 11.5319 12.0289 12.0289 12.7659 12.7659 13.2788 13.2788 k = 0.5225 0.1523-0.1595 ( 2042 PWs) bands (ev): -46.0021 -46.0021 -22.6746 -22.6746 -22.0498 -22.0498 -21.9714 -21.9714 -0.4666 -0.4666 2.7292 2.7292 9.9515 9.9515 10.2385 10.2385 10.7424 10.7424 11.4709 11.4709 11.5159 11.5159 12.0113 12.0113 12.7728 12.7728 13.3052 13.3052 k = 0.5300 0.1425-0.1492 ( 2042 PWs) bands (ev): -46.0020 -46.0020 -22.6748 -22.6748 -22.0499 -22.0499 -21.9718 -21.9718 -0.4575 -0.4575 2.7390 2.7390 9.9002 9.9002 10.2066 10.2066 10.7766 10.7766 11.4612 11.4612 11.4959 11.4959 11.9879 11.9879 12.7805 12.7805 13.3409 13.3409 k = 0.5375 0.1327-0.1389 ( 2050 PWs) bands (ev): -46.0019 -46.0019 -22.6751 -22.6751 -22.0501 -22.0501 -21.9725 -21.9725 -0.4457 -0.4457 2.7516 2.7516 9.8400 9.8400 10.1655 10.1655 10.8152 10.8152 11.4487 11.4487 11.4741 11.4741 11.9598 11.9598 12.7877 12.7877 13.3849 13.3849 k = 0.5449 0.1228-0.1286 ( 2046 PWs) bands (ev): -46.0018 -46.0018 -22.6753 -22.6753 -22.0502 -22.0502 -21.9731 -21.9731 -0.4314 -0.4314 2.7670 2.7670 9.7730 9.7730 10.1155 10.1155 10.8563 10.8563 11.4334 11.4334 11.4522 11.4522 11.9279 11.9279 12.7931 12.7931 13.4359 13.4359 k = 0.5524 0.1130-0.1183 ( 2048 PWs) bands (ev): -46.0017 -46.0017 -22.6757 -22.6757 -22.0504 -22.0504 -21.9740 -21.9740 -0.4144 -0.4144 2.7851 2.7851 9.7007 9.7007 10.0568 10.0568 10.8987 10.8987 11.4154 11.4154 11.4316 11.4316 11.8932 11.8932 12.7959 12.7959 13.4931 13.4931 k = 0.5599 0.1032-0.1080 ( 2044 PWs) bands (ev): -46.0015 -46.0015 -22.6761 -22.6761 -22.0506 -22.0506 -21.9749 -21.9749 -0.3948 -0.3948 2.8058 2.8058 9.6243 9.6243 9.9901 9.9901 10.9416 10.9416 11.3952 11.3952 11.4130 11.4130 11.8564 11.8564 12.7953 12.7953 13.5554 13.5554 k = 0.5674 0.0933-0.0977 ( 2040 PWs) bands (ev): -46.0013 -46.0013 -22.6765 -22.6765 -22.0508 -22.0508 -21.9759 -21.9759 -0.3725 -0.3725 2.8293 2.8293 9.5445 9.5445 9.9159 9.9159 10.9845 10.9845 11.3731 11.3731 11.3968 11.3968 11.8184 11.8184 12.7910 12.7910 13.6220 13.6220 k = 0.5749 0.0835-0.0875 ( 2040 PWs) bands (ev): -46.0011 -46.0011 -22.6771 -22.6771 -22.0511 -22.0511 -21.9771 -21.9771 -0.3477 -0.3477 2.8554 2.8554 9.4621 9.4621 9.8353 9.8353 11.0271 11.0271 11.3488 11.3488 11.3838 11.3838 11.7796 11.7796 12.7829 12.7829 13.6921 13.6921 k = 0.5824 0.0737-0.0772 ( 2042 PWs) bands (ev): -46.0009 -46.0009 -22.6776 -22.6776 -22.0514 -22.0514 -21.9784 -21.9784 -0.3203 -0.3203 2.8841 2.8841 9.3775 9.3775 9.7490 9.7490 11.0693 11.0693 11.3223 11.3223 11.3740 11.3740 11.7407 11.7407 12.7711 12.7711 13.7651 13.7651 k = 0.5899 0.0639-0.0669 ( 2042 PWs) bands (ev): -46.0006 -46.0006 -22.6783 -22.6783 -22.0517 -22.0517 -21.9798 -21.9798 -0.2902 -0.2902 2.9154 2.9154 9.2913 9.2913 9.6581 9.6581 11.1109 11.1109 11.2935 11.2935 11.3674 11.3674 11.7019 11.7019 12.7558 12.7558 13.8403 13.8403 k = 0.5974 0.0540-0.0566 ( 2042 PWs) bands (ev): -46.0004 -46.0004 -22.6789 -22.6789 -22.0521 -22.0521 -21.9813 -21.9813 -0.2575 -0.2575 2.9492 2.9492 9.2039 9.2039 9.5634 9.5634 11.1519 11.1519 11.2627 11.2627 11.3636 11.3636 11.6636 11.6636 12.7372 12.7372 13.9168 13.9168 k = 0.6049 0.0442-0.0463 ( 2038 PWs) bands (ev): -46.0001 -46.0001 -22.6796 -22.6796 -22.0524 -22.0524 -21.9829 -21.9829 -0.2222 -0.2222 2.9854 2.9854 9.1155 9.1155 9.4659 9.4659 11.1919 11.1919 11.2303 11.2303 11.3623 11.3623 11.6261 11.6261 12.7156 12.7156 13.9941 13.9941 k = 0.6124 0.0344-0.0360 ( 2052 PWs) bands (ev): -45.9998 -45.9998 -22.6805 -22.6805 -22.0529 -22.0529 -21.9847 -21.9847 -0.1843 -0.1843 3.0239 3.0239 9.0265 9.0265 9.3662 9.3662 11.1942 11.1942 11.2334 11.2334 11.3629 11.3629 11.5896 11.5896 12.6915 12.6915 14.0711 14.0711 k = 0.6199 0.0246-0.0257 ( 2052 PWs) bands (ev): -45.9995 -45.9995 -22.6813 -22.6813 -22.0533 -22.0533 -21.9865 -21.9865 -0.1438 -0.1438 3.0648 3.0648 8.9370 8.9370 9.2651 9.2651 11.1583 11.1583 11.2725 11.2725 11.3652 11.3652 11.5542 11.5542 12.6653 12.6653 14.1468 14.1468 k = 0.6273 0.0147-0.0154 ( 2054 PWs) bands (ev): -45.9991 -45.9991 -22.6821 -22.6821 -22.0537 -22.0537 -21.9884 -21.9884 -0.1007 -0.1007 3.1079 3.1079 8.8474 8.8474 9.1632 9.1632 11.1205 11.1205 11.3113 11.3113 11.3688 11.3688 11.5202 11.5202 12.6374 12.6374 14.2195 14.2195 k = 0.6348 0.0049-0.0051 ( 2054 PWs) bands (ev): -45.9988 -45.9988 -22.6830 -22.6830 -22.0542 -22.0542 -21.9903 -21.9903 -0.0550 -0.0550 3.1532 3.1532 8.7578 8.7578 9.0611 9.0611 11.0812 11.0812 11.3476 11.3476 11.3749 11.3749 11.4878 11.4878 12.6084 12.6084 14.2870 14.2870 k = 0.6423-0.0049 0.0052 ( 2054 PWs) bands (ev): -45.9984 -45.9984 -22.6840 -22.6840 -22.0546 -22.0546 -21.9924 -21.9924 -0.0066 -0.0066 3.2005 3.2005 8.6685 8.6685 8.9592 8.9592 11.0405 11.0405 11.3677 11.3677 11.3965 11.3965 11.4575 11.4575 12.5788 12.5788 14.3459 14.3459 k = 0.6498-0.0148 0.0155 ( 2062 PWs) bands (ev): -45.9981 -45.9981 -22.6850 -22.6850 -22.0552 -22.0552 -21.9945 -21.9945 0.0443 0.0443 3.2497 3.2497 8.5796 8.5796 8.8580 8.8580 10.9987 10.9987 11.3715 11.3715 11.4235 11.4235 11.4389 11.4389 12.5492 12.5492 14.3908 14.3908 k = 0.6573-0.0246 0.0257 ( 2064 PWs) bands (ev): -45.9977 -45.9977 -22.6860 -22.6860 -22.0557 -22.0557 -21.9967 -21.9967 0.0978 0.0978 3.3008 3.3008 8.4912 8.4912 8.7579 8.7579 10.9559 10.9559 11.3688 11.3688 11.4037 11.4037 11.4738 11.4738 12.5203 12.5203 14.4135 14.4135 k = 0.6648-0.0344 0.0360 ( 2056 PWs) bands (ev): -45.9973 -45.9973 -22.6870 -22.6870 -22.0562 -22.0562 -21.9989 -21.9989 0.1540 0.1540 3.3536 3.3536 8.4035 8.4035 8.6592 8.6592 10.9121 10.9121 11.3558 11.3558 11.3897 11.3897 11.5131 11.5131 12.4928 12.4928 14.4027 14.4027 k = 0.6723-0.0442 0.0463 ( 2056 PWs) bands (ev): -45.9968 -45.9968 -22.6881 -22.6881 -22.0567 -22.0567 -22.0012 -22.0012 0.2128 0.2128 3.4079 3.4079 8.3167 8.3167 8.5623 8.5623 10.8676 10.8676 11.3345 11.3345 11.3825 11.3825 11.5531 11.5531 12.4672 12.4672 14.3482 14.3482 k = 0.6798-0.0541 0.0566 ( 2062 PWs) bands (ev): -45.9964 -45.9964 -22.6893 -22.6893 -22.0573 -22.0573 -22.0035 -22.0035 0.2741 0.2741 3.4637 3.4637 8.2309 8.2309 8.4676 8.4676 10.8224 10.8224 11.3113 11.3113 11.3752 11.3752 11.5936 11.5936 12.4444 12.4444 14.2473 14.2473 k = 0.6873-0.0639 0.0669 ( 2062 PWs) bands (ev): -45.9960 -45.9960 -22.6904 -22.6904 -22.0578 -22.0578 -22.0059 -22.0059 0.3381 0.3381 3.5207 3.5207 8.1461 8.1461 8.3752 8.3752 10.7766 10.7766 11.2882 11.2882 11.3651 11.3651 11.6347 11.6347 12.4249 12.4249 14.1080 14.1080 k = 0.6948-0.0737 0.0772 ( 2062 PWs) bands (ev): -45.9955 -45.9955 -22.6916 -22.6916 -22.0584 -22.0584 -22.0083 -22.0083 0.4047 0.4047 3.5788 3.5788 8.0624 8.0624 8.2856 8.2856 10.7305 10.7305 11.2656 11.2656 11.3514 11.3514 11.6763 11.6763 12.4094 12.4094 13.9419 13.9419 k = 0.7023-0.0835 0.0875 ( 2058 PWs) bands (ev): -45.9951 -45.9951 -22.6928 -22.6928 -22.0589 -22.0589 -22.0108 -22.0108 0.4738 0.4738 3.6377 3.6377 7.9801 7.9801 8.1989 8.1989 10.6840 10.6840 11.2433 11.2433 11.3334 11.3334 11.7186 11.7186 12.3981 12.3981 13.7593 13.7593 k = 0.7097-0.0934 0.0978 ( 2058 PWs) bands (ev): -45.9946 -45.9946 -22.6940 -22.6940 -22.0595 -22.0595 -22.0132 -22.0132 0.5456 0.5456 3.6973 3.6973 7.8991 7.8991 8.1154 8.1154 10.6374 10.6374 11.2209 11.2209 11.3111 11.3111 11.7615 11.7615 12.3915 12.3915 13.5672 13.5672 k = 0.7172-0.1032 0.1081 ( 2058 PWs) bands (ev): -45.9942 -45.9942 -22.6952 -22.6952 -22.0600 -22.0600 -22.0157 -22.0157 0.6200 0.6200 3.7574 3.7574 7.8195 7.8195 8.0355 8.0355 10.5907 10.5907 11.1980 11.1980 11.2842 11.2842 11.8051 11.8051 12.3894 12.3894 13.3702 13.3702 k = 0.7247-0.1130 0.1184 ( 2058 PWs) bands (ev): -45.9937 -45.9937 -22.6965 -22.6965 -22.0606 -22.0606 -22.0182 -22.0182 0.6969 0.6969 3.8176 3.8176 7.7414 7.7414 7.9594 7.9594 10.5441 10.5441 11.1737 11.1737 11.2531 11.2531 11.8494 11.8494 12.3920 12.3920 13.1718 13.1718 k = 0.7322-0.1229 0.1286 ( 2054 PWs) bands (ev): -45.9932 -45.9932 -22.6977 -22.6977 -22.0612 -22.0612 -22.0206 -22.0206 0.7764 0.7764 3.8778 3.8778 7.6649 7.6649 7.8873 7.8873 10.4976 10.4976 11.1469 11.1469 11.2180 11.2180 11.8946 11.8946 12.3988 12.3988 12.9750 12.9750 k = 0.7397-0.1327 0.1389 ( 2054 PWs) bands (ev): -45.9927 -45.9927 -22.6990 -22.6990 -22.0618 -22.0618 -22.0231 -22.0231 0.8586 0.8586 3.9375 3.9375 7.5901 7.5901 7.8197 7.8197 10.4513 10.4513 11.1162 11.1162 11.1794 11.1794 11.9405 11.9405 12.4096 12.4096 12.7824 12.7824 k = 0.7472-0.1425 0.1492 ( 2058 PWs) bands (ev): -45.9923 -45.9923 -22.7004 -22.7004 -22.0625 -22.0625 -22.0256 -22.0256 0.9433 0.9433 3.9966 3.9966 7.5169 7.5169 7.7567 7.7567 10.4054 10.4054 11.0793 11.0793 11.1374 11.1374 11.9872 11.9872 12.4239 12.4239 12.5970 12.5970 k = 0.7547-0.1523 0.1595 ( 2058 PWs) bands (ev): -45.9918 -45.9918 -22.7017 -22.7017 -22.0631 -22.0631 -22.0280 -22.0280 1.0306 1.0306 4.0547 4.0547 7.4454 7.4454 7.6987 7.6987 10.3600 10.3600 11.0335 11.0335 11.0925 11.0925 12.0348 12.0348 12.4224 12.4224 12.4414 12.4414 k = 0.7622-0.1622 0.1698 ( 2062 PWs) bands (ev): -45.9913 -45.9913 -22.7030 -22.7030 -22.0638 -22.0638 -22.0304 -22.0304 1.1204 1.1204 4.1114 4.1114 7.3757 7.3757 7.6460 7.6460 10.3150 10.3150 10.9752 10.9752 11.0452 11.0452 12.0832 12.0832 12.2631 12.2631 12.4614 12.4614 k = 0.7697-0.1720 0.1801 ( 2062 PWs) bands (ev): -45.9908 -45.9908 -22.7043 -22.7043 -22.0645 -22.0645 -22.0328 -22.0328 1.2129 1.2129 4.1664 4.1664 7.3079 7.3079 7.5988 7.5988 10.2707 10.2707 10.8999 10.8999 10.9961 10.9961 12.1218 12.1218 12.1339 12.1339 12.4837 12.4837 k = 0.7772-0.1818 0.1904 ( 2058 PWs) bands (ev): -45.9904 -45.9904 -22.7056 -22.7056 -22.0651 -22.0651 -22.0350 -22.0350 1.3078 1.3078 4.2193 4.2193 7.2419 7.2419 7.5575 7.5575 10.2271 10.2271 10.8039 10.8039 10.9461 10.9461 12.0064 12.0064 12.1828 12.1828 12.5078 12.5078 k = 0.7847-0.1917 0.2007 ( 2062 PWs) bands (ev): -45.9899 -45.9899 -22.7069 -22.7069 -22.0659 -22.0659 -22.0373 -22.0373 1.4054 1.4054 4.2698 4.2698 7.1778 7.1778 7.5223 7.5223 10.1843 10.1843 10.6855 10.6855 10.8955 10.8955 11.9149 11.9149 12.2337 12.2337 12.5334 12.5334 k = 0.7921-0.2015 0.2110 ( 2062 PWs) bands (ev): -45.9894 -45.9894 -22.7082 -22.7082 -22.0666 -22.0666 -22.0394 -22.0394 1.5055 1.5055 4.3176 4.3176 7.1157 7.1157 7.4935 7.4935 10.1423 10.1423 10.5460 10.5460 10.8445 10.8445 11.8476 11.8476 12.2855 12.2855 12.5601 12.5601 k = 0.7996-0.2113 0.2213 ( 2064 PWs) bands (ev): -45.9890 -45.9890 -22.7094 -22.7094 -22.0674 -22.0674 -22.0415 -22.0415 1.6082 1.6082 4.3622 4.3622 7.0556 7.0556 7.4713 7.4713 10.1012 10.1012 10.3886 10.3886 10.7936 10.7936 11.8015 11.8015 12.3381 12.3381 12.5875 12.5875 k = 0.8071-0.2211 0.2315 ( 2064 PWs) bands (ev): -45.9885 -45.9885 -22.7107 -22.7107 -22.0683 -22.0683 -22.0435 -22.0435 1.7134 1.7134 4.4035 4.4035 6.9974 6.9974 7.4559 7.4559 10.0611 10.0611 10.2174 10.2174 10.7429 10.7429 11.7728 11.7728 12.3915 12.3915 12.6155 12.6155 k = 0.8146-0.2310 0.2418 ( 2058 PWs) bands (ev): -45.9881 -45.9881 -22.7119 -22.7119 -22.0691 -22.0691 -22.0453 -22.0453 1.8211 1.8211 4.4412 4.4412 6.9413 6.9413 7.4472 7.4472 10.0221 10.0221 10.0359 10.0359 10.6926 10.6926 11.7579 11.7579 12.4456 12.4456 12.6437 12.6437 k = 0.8221-0.2408 0.2521 ( 2058 PWs) bands (ev): -45.9877 -45.9877 -22.7131 -22.7131 -22.0701 -22.0701 -22.0471 -22.0471 1.9314 1.9314 4.4752 4.4752 6.8872 6.8872 7.4454 7.4454 9.8472 9.8472 9.9842 9.9842 10.6431 10.6431 11.7540 11.7540 12.5004 12.5004 12.6719 12.6719 k = 0.8296-0.2506 0.2624 ( 2062 PWs) bands (ev): -45.9872 -45.9872 -22.7143 -22.7143 -22.0711 -22.0711 -22.0487 -22.0487 2.0442 2.0442 4.5052 4.5052 6.8352 6.8352 7.4504 7.4504 9.6536 9.6536 9.9475 9.9475 10.5945 10.5945 11.7588 11.7588 12.5558 12.5558 12.6998 12.6998 k = 0.8371-0.2604 0.2727 ( 2058 PWs) bands (ev): -45.9868 -45.9868 -22.7155 -22.7155 -22.0721 -22.0721 -22.0502 -22.0502 2.1595 2.1595 4.5314 4.5314 6.7853 6.7853 7.4619 7.4619 9.4568 9.4568 9.9120 9.9120 10.5470 10.5470 11.7708 11.7708 12.6118 12.6118 12.7273 12.7273 k = 0.8446-0.2703 0.2830 ( 2062 PWs) bands (ev): -45.9864 -45.9864 -22.7166 -22.7166 -22.0732 -22.0732 -22.0516 -22.0516 2.2772 2.2772 4.5537 4.5537 6.7376 6.7376 7.4798 7.4798 9.2581 9.2581 9.8777 9.8777 10.5007 10.5007 11.7887 11.7887 12.6683 12.6683 12.7542 12.7542 k = 0.8521-0.2801 0.2933 ( 2064 PWs) bands (ev): -45.9860 -45.9860 -22.7178 -22.7178 -22.0743 -22.0743 -22.0529 -22.0529 2.3975 2.3975 4.5723 4.5723 6.6920 6.6920 7.5036 7.5036 9.0583 9.0583 9.8448 9.8448 10.4559 10.4559 11.8119 11.8119 12.7250 12.7250 12.7803 12.7803 k = 0.8596-0.2899 0.3036 ( 2060 PWs) bands (ev): -45.9857 -45.9857 -22.7188 -22.7188 -22.0754 -22.0754 -22.0540 -22.0540 2.5202 2.5202 4.5873 4.5873 6.6485 6.6485 7.5329 7.5329 8.8581 8.8581 9.8132 9.8132 10.4126 10.4126 11.8396 11.8396 12.7815 12.7815 12.8059 12.8059 k = 0.8670-0.2998 0.3139 ( 2064 PWs) bands (ev): -45.9853 -45.9853 -22.7199 -22.7199 -22.0765 -22.0765 -22.0551 -22.0551 2.6453 2.6453 4.5991 4.5991 6.6072 6.6072 7.5672 7.5672 8.6581 8.6581 9.7831 9.7831 10.3710 10.3710 11.8714 11.8714 12.8264 12.8264 12.8422 12.8422 k = 0.8745-0.3096 0.3242 ( 2068 PWs) bands (ev): -45.9850 -45.9850 -22.7209 -22.7209 -22.0777 -22.0777 -22.0560 -22.0560 2.7729 2.7729 4.6078 4.6078 6.5681 6.5681 7.6058 7.6058 8.4586 8.4586 9.7544 9.7544 10.3312 10.3312 11.9069 11.9069 12.8503 12.8503 12.8981 12.8981 k = 0.8820-0.3194 0.3345 ( 2060 PWs) bands (ev): -45.9846 -45.9846 -22.7218 -22.7218 -22.0788 -22.0788 -22.0568 -22.0568 2.9028 2.9028 4.6138 4.6138 6.5312 6.5312 7.6481 7.6481 8.2600 8.2600 9.7272 9.7272 10.2933 10.2933 11.9459 11.9459 12.8715 12.8715 12.9551 12.9551 k = 0.8895-0.3292 0.3447 ( 2066 PWs) bands (ev): -45.9843 -45.9843 -22.7227 -22.7227 -22.0800 -22.0800 -22.0575 -22.0575 3.0352 3.0352 4.6175 4.6175 6.4965 6.4965 7.6932 7.6932 8.0626 8.0626 9.7015 9.7015 10.2573 10.2573 11.9881 11.9881 12.8910 12.8910 13.0119 13.0119 k = 0.8970-0.3391 0.3550 ( 2060 PWs) bands (ev): -45.9840 -45.9840 -22.7235 -22.7235 -22.0811 -22.0811 -22.0581 -22.0581 3.1698 3.1698 4.6192 4.6192 6.4641 6.4641 7.7405 7.7405 7.8668 7.8668 9.6773 9.6773 10.2234 10.2234 12.0334 12.0334 12.9088 12.9088 13.0681 13.0681 k = 0.9045-0.3489 0.3653 ( 2068 PWs) bands (ev): -45.9838 -45.9838 -22.7244 -22.7244 -22.0823 -22.0823 -22.0587 -22.0587 3.3067 3.3067 4.6193 4.6193 6.4338 6.4338 7.6718 7.6718 7.7898 7.7898 9.6548 9.6548 10.1917 10.1917 12.0817 12.0817 12.9248 12.9248 13.1235 13.1235 k = 0.9120-0.3587 0.3756 ( 2064 PWs) bands (ev): -45.9835 -45.9835 -22.7251 -22.7251 -22.0833 -22.0833 -22.0592 -22.0592 3.4457 3.4457 4.6180 4.6180 6.4059 6.4059 7.4793 7.4793 7.8391 7.8391 9.6338 9.6338 10.1621 10.1621 12.1328 12.1328 12.9390 12.9390 13.1777 13.1777 k = 0.9195-0.3685 0.3859 ( 2064 PWs) bands (ev): -45.9832 -45.9832 -22.7258 -22.7258 -22.0843 -22.0843 -22.0596 -22.0596 3.5869 3.5869 4.6157 4.6157 6.3802 6.3802 7.2886 7.2886 7.8882 7.8882 9.6144 9.6144 10.1348 10.1348 12.1865 12.1865 12.9514 12.9514 13.2304 13.2304 k = 0.9270-0.3784 0.3962 ( 2062 PWs) bands (ev): -45.9830 -45.9830 -22.7264 -22.7264 -22.0852 -22.0852 -22.0600 -22.0600 3.7301 3.7301 4.6127 4.6127 6.3567 6.3567 7.1002 7.1002 7.9364 7.9364 9.5967 9.5967 10.1098 10.1098 12.2429 12.2429 12.9620 12.9620 13.2811 13.2811 k = 0.9345-0.3882 0.4065 ( 2070 PWs) bands (ev): -45.9828 -45.9828 -22.7271 -22.7271 -22.0861 -22.0861 -22.0604 -22.0604 3.8751 3.8751 4.6092 4.6092 6.3355 6.3355 6.9141 6.9141 7.9828 7.9828 9.5807 9.5807 10.0871 10.0871 12.3017 12.3017 12.9707 12.9707 13.3295 13.3295 k = 0.9420-0.3980 0.4168 ( 2070 PWs) bands (ev): -45.9827 -45.9827 -22.7276 -22.7276 -22.0869 -22.0869 -22.0607 -22.0607 4.0217 4.0217 4.6055 4.6055 6.3166 6.3166 6.7307 6.7307 8.0266 8.0266 9.5664 9.5664 10.0668 10.0668 12.3629 12.3629 12.9779 12.9779 13.3749 13.3749 k = 0.9494-0.4079 0.4271 ( 2070 PWs) bands (ev): -45.9825 -45.9825 -22.7280 -22.7280 -22.0876 -22.0876 -22.0609 -22.0609 4.1695 4.1695 4.6018 4.6018 6.3000 6.3000 6.5505 6.5505 8.0670 8.0670 9.5538 9.5538 10.0490 10.0490 12.4264 12.4264 12.9835 12.9835 13.4167 13.4167 k = 0.9569-0.4177 0.4374 ( 2078 PWs) bands (ev): -45.9824 -45.9824 -22.7285 -22.7285 -22.0882 -22.0882 -22.0612 -22.0612 4.3180 4.3180 4.5982 4.5982 6.2856 6.2856 6.3740 6.3740 8.1035 8.1035 9.5428 9.5428 10.0335 10.0335 12.4920 12.4920 12.9877 12.9877 13.4317 13.4317 k = 0.9644-0.4275 0.4476 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7288 -22.7288 -22.0887 -22.0887 -22.0614 -22.0614 4.4661 4.4661 4.5950 4.5950 6.2024 6.2024 6.2736 6.2736 8.1352 8.1352 9.5337 9.5337 10.0205 10.0205 12.5595 12.5595 12.9907 12.9907 13.3440 13.3440 k = 0.9719-0.4373 0.4579 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7291 -22.7291 -22.0891 -22.0891 -22.0615 -22.0615 4.5922 4.5922 4.6119 4.6119 6.0375 6.0375 6.2638 6.2638 8.1617 8.1617 9.5262 9.5262 10.0100 10.0100 12.6284 12.6284 12.9928 12.9928 13.2578 13.2578 k = 0.9719-0.4373 0.4579 ( 2078 PWs) bands (ev): -45.9822 -45.9822 -22.7291 -22.7291 -22.0891 -22.0891 -22.0615 -22.0615 4.5922 4.5922 4.6119 4.6119 6.0375 6.0375 6.2638 6.2638 8.1617 8.1617 9.5262 9.5262 10.0100 10.0100 12.6284 12.6284 12.9928 12.9928 13.2578 13.2578 k = 0.9628-0.4465 0.4676 ( 2078 PWs) bands (ev): -45.9821 -45.9821 -22.7292 -22.7292 -22.0893 -22.0893 -22.0615 -22.0615 4.5780 4.5780 4.6915 4.6915 5.9635 5.9635 6.2595 6.2595 8.1748 8.1748 9.5249 9.5249 10.0048 10.0048 12.6326 12.6326 12.9991 12.9991 13.2427 13.2427 k = 0.9536-0.4558 0.4772 ( 2076 PWs) bands (ev): -45.9821 -45.9821 -22.7293 -22.7293 -22.0894 -22.0894 -22.0616 -22.0616 4.5617 4.5617 4.7713 4.7713 5.8925 5.8925 6.2545 6.2545 8.1916 8.1916 9.5270 9.5270 9.9980 9.9980 12.5824 12.5824 13.0134 13.0134 13.2777 13.2777 k = 0.9445-0.4650 0.4869 ( 2078 PWs) bands (ev): -45.9821 -45.9821 -22.7294 -22.7294 -22.0896 -22.0896 -22.0616 -22.0616 4.5452 4.5452 4.8481 4.8481 5.8260 5.8260 6.2488 6.2488 8.2120 8.2120 9.5325 9.5325 9.9898 9.9898 12.4955 12.4955 13.0301 13.0301 13.3507 13.3507 k = 0.9353-0.4742 0.4965 ( 2078 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0897 -22.0897 -22.0617 -22.0617 4.5280 4.5280 4.9208 4.9208 5.7655 5.7655 6.2426 6.2426 8.2358 8.2358 9.5415 9.5415 9.9803 9.9803 12.3893 12.3893 13.0485 13.0485 13.4447 13.4447 k = 0.9261-0.4834 0.5062 ( 2080 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5095 4.5095 4.9880 4.9880 5.7134 5.7134 6.2358 6.2358 8.2627 8.2627 9.5538 9.5538 9.9696 9.9696 12.2739 12.2739 13.0699 13.0699 13.5446 13.5446 k = 0.9170-0.4926 0.5158 ( 2081 PWs) bands (ev): -45.9820 -45.9820 -22.7296 -22.7296 -22.0898 -22.0898 -22.0617 -22.0617 4.4887 4.4887 5.0474 5.0474 5.6728 5.6728 6.2285 6.2285 8.2923 8.2923 9.5695 9.5695 9.9579 9.9579 12.1544 12.1544 13.0950 13.0950 13.5606 13.5606 k = 0.9078-0.5018 0.5254 ( 2078 PWs) bands (ev): -45.9820 -45.9820 -22.7296 -22.7296 -22.0898 -22.0898 -22.0617 -22.0617 4.4649 4.4649 5.0965 5.0965 5.6472 5.6472 6.2208 6.2208 8.3243 8.3243 9.5884 9.5884 9.9450 9.9450 12.0340 12.0340 13.1237 13.1237 13.5633 13.5633 k = 0.8987-0.5110 0.5351 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4370 4.4370 5.1327 5.1327 5.6403 5.6403 6.2127 6.2127 8.3581 8.3581 9.6104 9.6104 9.9311 9.9311 11.9148 11.9148 13.1559 13.1559 13.5643 13.5643 k = 0.8987-0.5110 0.5351 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4370 4.4370 5.1327 5.1327 5.6403 5.6403 6.2127 6.2127 8.3581 8.3581 9.6104 9.6104 9.9311 9.9311 11.9148 11.9148 13.1559 13.1559 13.5643 13.5643 k = 0.8858-0.5106 0.5449 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4050 4.4050 5.1613 5.1613 5.6440 5.6440 6.2063 6.2063 8.3957 8.3957 9.6349 9.6349 9.9157 9.9157 11.7974 11.7974 13.1921 13.1921 13.5649 13.5649 k = 0.8730-0.5101 0.5547 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0616 -22.0616 4.3707 4.3707 5.1860 5.1860 5.6484 5.6484 6.2050 6.2050 8.4377 8.4377 9.6602 9.6602 9.8991 9.8991 11.6854 11.6854 13.2308 13.2308 13.5671 13.5671 k = 0.8601-0.5097 0.5645 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0897 -22.0897 -22.0616 -22.0616 4.3353 4.3353 5.2048 5.2048 5.6537 5.6537 6.2105 6.2105 8.4828 8.4828 9.6857 9.6857 9.8816 9.8816 11.5802 11.5802 13.2709 13.2709 13.5721 13.5721 k = 0.8472-0.5092 0.5743 ( 2070 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0616 -22.0616 4.2992 4.2992 5.2162 5.2162 5.6598 5.6598 6.2242 6.2242 8.5300 8.5300 9.7106 9.7106 9.8632 9.8632 11.4832 11.4832 13.3101 13.3101 13.5818 13.5818 k = 0.8344-0.5088 0.5840 ( 2068 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0615 -22.0615 4.2632 4.2632 5.2192 5.2192 5.6666 5.6666 6.2471 6.2471 8.5780 8.5780 9.7340 9.7340 9.8443 9.8443 11.3959 11.3959 13.3454 13.3454 13.5991 13.5991 k = 0.8215-0.5083 0.5938 ( 2062 PWs) bands (ev): -45.9821 -45.9821 -22.7292 -22.7292 -22.0895 -22.0895 -22.0614 -22.0614 4.2276 4.2276 5.2135 5.2135 5.6741 5.6741 6.2794 6.2794 8.6254 8.6254 9.7550 9.7550 9.8250 9.8250 11.3201 11.3201 13.3732 13.3732 13.6272 13.6272 k = 0.8087-0.5079 0.6036 ( 2060 PWs) bands (ev): -45.9821 -45.9821 -22.7292 -22.7292 -22.0893 -22.0893 -22.0614 -22.0614 4.1928 4.1928 5.1993 5.1993 5.6824 5.6824 6.3210 6.3210 8.6707 8.6707 9.7727 9.7727 9.8058 9.8058 11.2575 11.2575 13.3916 13.3916 13.6681 13.6681 k = 0.7958-0.5074 0.6134 ( 2061 PWs) bands (ev): -45.9821 -45.9821 -22.7291 -22.7291 -22.0892 -22.0892 -22.0613 -22.0613 4.1591 4.1591 5.1774 5.1774 5.6912 5.6912 6.3712 6.3712 8.7123 8.7123 9.7824 9.7824 9.7909 9.7909 11.2097 11.2097 13.4011 13.4011 13.7210 13.7210 k = 0.7829-0.5070 0.6232 ( 2063 PWs) bands (ev): -45.9821 -45.9821 -22.7290 -22.7290 -22.0891 -22.0891 -22.0613 -22.0613 4.1265 4.1265 5.1488 5.1488 5.7007 5.7007 6.4290 6.4290 8.7484 8.7484 9.7659 9.7659 9.7989 9.7989 11.1777 11.1777 13.4036 13.4036 13.7837 13.7837 k = 0.7701-0.5065 0.6330 ( 2059 PWs) bands (ev): -45.9822 -45.9822 -22.7289 -22.7289 -22.0889 -22.0889 -22.0612 -22.0612 4.0955 4.0955 5.1145 5.1145 5.7107 5.7107 6.4934 6.4934 8.7773 8.7773 9.7473 9.7473 9.8069 9.8069 11.1619 11.1619 13.4012 13.4012 13.8542 13.8542 k = 0.7572-0.5061 0.6428 ( 2061 PWs) bands (ev): -45.9822 -45.9822 -22.7288 -22.7288 -22.0888 -22.0888 -22.0611 -22.0611 4.0660 4.0660 5.0755 5.0755 5.7213 5.7213 6.5633 6.5633 8.7970 8.7970 9.7290 9.7290 9.8144 9.8144 11.1619 11.1619 13.3953 13.3953 13.9307 13.9307 k = 0.7444-0.5056 0.6526 ( 2062 PWs) bands (ev): -45.9823 -45.9823 -22.7286 -22.7286 -22.0886 -22.0886 -22.0610 -22.0610 4.0383 4.0383 5.0326 5.0326 5.7324 5.7324 6.6379 6.6379 8.8058 8.8058 9.7115 9.7115 9.8235 9.8235 11.1762 11.1762 13.3868 13.3868 13.9802 13.9802 k = 0.7315-0.5052 0.6624 ( 2062 PWs) bands (ev): -45.9823 -45.9823 -22.7285 -22.7285 -22.0884 -22.0884 -22.0610 -22.0610 4.0124 4.0124 4.9866 4.9866 5.7439 5.7439 6.7162 6.7162 8.8029 8.8029 9.6948 9.6948 9.8367 9.8367 11.2028 11.2028 13.3762 13.3762 13.8847 13.8847 k = 0.7186-0.5047 0.6722 ( 2062 PWs) bands (ev): -45.9823 -45.9823 -22.7284 -22.7284 -22.0882 -22.0882 -22.0609 -22.0609 3.9885 3.9885 4.9381 4.9381 5.7558 5.7558 6.7976 6.7976 8.7880 8.7880 9.6791 9.6791 9.8556 9.8556 11.2394 11.2394 13.3640 13.3640 13.7914 13.7914 k = 0.7058-0.5043 0.6820 ( 2066 PWs) bands (ev): -45.9824 -45.9824 -22.7282 -22.7282 -22.0880 -22.0880 -22.0608 -22.0608 3.9666 3.9666 4.8875 4.8875 5.7680 5.7680 6.8812 6.8812 8.7621 8.7621 9.6645 9.6645 9.8814 9.8814 11.2832 11.2832 13.3503 13.3503 13.7015 13.7015 k = 0.6929-0.5038 0.6918 ( 2067 PWs) bands (ev): -45.9825 -45.9825 -22.7281 -22.7281 -22.0878 -22.0878 -22.0607 -22.0607 3.9468 3.9468 4.8351 4.8351 5.7806 5.7806 6.9665 6.9665 8.7268 8.7268 9.6512 9.6512 9.9139 9.9139 11.3316 11.3316 13.3353 13.3353 13.6159 13.6159 k = 0.6800-0.5033 0.7016 ( 2066 PWs) bands (ev): -45.9825 -45.9825 -22.7279 -22.7279 -22.0876 -22.0876 -22.0606 -22.0606 3.9291 3.9291 4.7812 4.7812 5.7934 5.7934 7.0525 7.0525 8.6845 8.6845 9.6392 9.6392 9.9526 9.9526 11.3820 11.3820 13.3192 13.3192 13.5357 13.5357 k = 0.6672-0.5029 0.7113 ( 2066 PWs) bands (ev): -45.9826 -45.9826 -22.7277 -22.7277 -22.0873 -22.0873 -22.0605 -22.0605 3.9136 3.9136 4.7259 4.7259 5.8065 5.8065 7.1385 7.1385 8.6377 8.6377 9.6286 9.6286 9.9966 9.9966 11.4317 11.4317 13.3019 13.3019 13.4617 13.4617 k = 0.6543-0.5024 0.7211 ( 2063 PWs) bands (ev): -45.9826 -45.9826 -22.7275 -22.7275 -22.0870 -22.0870 -22.0603 -22.0603 3.9003 3.9003 4.6695 4.6695 5.8197 5.8197 7.2234 7.2234 8.5892 8.5892 9.6196 9.6196 10.0447 10.0447 11.4779 11.4779 13.2836 13.2836 13.3948 13.3948 k = 0.6415-0.5020 0.7309 ( 2059 PWs) bands (ev): -45.9827 -45.9827 -22.7273 -22.7273 -22.0867 -22.0867 -22.0602 -22.0602 3.8894 3.8894 4.6119 4.6119 5.8332 5.8332 7.3059 7.3059 8.5417 8.5417 9.6122 9.6122 10.0961 10.0961 11.5183 11.5183 13.2642 13.2642 13.3360 13.3360 k = 0.6286-0.5015 0.7407 ( 2057 PWs) bands (ev): -45.9828 -45.9828 -22.7271 -22.7271 -22.0864 -22.0864 -22.0600 -22.0600 3.8807 3.8807 4.5533 4.5533 5.8467 5.8467 7.3843 7.3843 8.4982 8.4982 9.6064 9.6064 10.1496 10.1496 11.5504 11.5504 13.2437 13.2437 13.2860 13.2860 k = 0.6157-0.5011 0.7505 ( 2053 PWs) bands (ev): -45.9829 -45.9829 -22.7268 -22.7268 -22.0861 -22.0861 -22.0598 -22.0598 3.8744 3.8744 4.4936 4.4936 5.8604 5.8604 7.4562 7.4562 8.4620 8.4620 9.6023 9.6023 10.2043 10.2043 11.5724 11.5724 13.2215 13.2215 13.2455 13.2455 k = 0.6029-0.5006 0.7603 ( 2045 PWs) bands (ev): -45.9829 -45.9829 -22.7265 -22.7265 -22.0857 -22.0857 -22.0596 -22.0596 3.8705 3.8705 4.4329 4.4329 5.8742 5.8742 7.5187 7.5187 8.4369 8.4369 9.5999 9.5999 10.2594 10.2594 11.5829 11.5829 13.1978 13.1978 13.2143 13.2143 k = 0.5900-0.5002 0.7701 ( 2052 PWs) bands (ev): -45.9830 -45.9830 -22.7264 -22.7264 -22.0855 -22.0855 -22.0595 -22.0595 3.8689 3.8689 4.3711 4.3711 5.8880 5.8880 7.5687 7.5687 8.4267 8.4267 9.5992 9.5992 10.3138 10.3138 11.5815 11.5815 13.1746 13.1746 13.1893 13.1893 k = 0.5772-0.4997 0.7799 ( 2056 PWs) bands (ev): -45.9831 -45.9831 -22.7261 -22.7261 -22.0852 -22.0852 -22.0594 -22.0594 3.8697 3.8697 4.3082 4.3082 5.9018 5.9018 7.6035 7.6035 8.4346 8.4346 9.6003 9.6003 10.3665 10.3665 11.5687 11.5687 13.1534 13.1534 13.1673 13.1673 k = 0.5643-0.4993 0.7897 ( 2058 PWs) bands (ev): -45.9832 -45.9832 -22.7259 -22.7259 -22.0848 -22.0848 -22.0592 -22.0592 3.8730 3.8730 4.2442 4.2442 5.9157 5.9157 7.6221 7.6221 8.4619 8.4619 9.6031 9.6031 10.4164 10.4164 11.5459 11.5459 13.1327 13.1327 13.1484 13.1484 k = 0.5514-0.4988 0.7995 ( 2057 PWs) bands (ev): -45.9833 -45.9833 -22.7256 -22.7256 -22.0845 -22.0845 -22.0590 -22.0590 3.8786 3.8786 4.1790 4.1790 5.9296 5.9296 7.6257 7.6257 8.5076 8.5076 9.6076 9.6076 10.4619 10.4619 11.5155 11.5155 13.1106 13.1106 13.1327 13.1327 k = 0.5386-0.4984 0.8093 ( 2059 PWs) bands (ev): -45.9834 -45.9834 -22.7254 -22.7254 -22.0842 -22.0842 -22.0588 -22.0588 3.8867 3.8867 4.1127 4.1127 5.9435 5.9435 7.6176 7.6176 8.5687 8.5687 9.6137 9.6137 10.5013 10.5013 11.4804 11.4804 13.0874 13.0874 13.1190 13.1190 k = 0.5257-0.4979 0.8191 ( 2057 PWs) bands (ev): -45.9835 -45.9835 -22.7251 -22.7251 -22.0838 -22.0838 -22.0586 -22.0586 3.8971 3.8971 4.0453 4.0453 5.9574 5.9574 7.6015 7.6015 8.6416 8.6416 9.6215 9.6215 10.5322 10.5322 11.4441 11.4441 13.0636 13.0636 13.1066 13.1066 k = 0.5129-0.4975 0.8289 ( 2054 PWs) bands (ev): -45.9836 -45.9836 -22.7248 -22.7248 -22.0834 -22.0834 -22.0584 -22.0584 3.9098 3.9098 3.9768 3.9768 5.9714 5.9714 7.5805 7.5805 8.7230 8.7230 9.6309 9.6309 10.5519 10.5519 11.4105 11.4105 13.0396 13.0396 13.0955 13.0955 k = 0.5000-0.4970 0.8387 ( 2050 PWs) bands (ev): -45.9837 -45.9837 -22.7245 -22.7245 -22.0830 -22.0830 -22.0581 -22.0581 3.9052 3.9052 3.9269 3.9269 5.9854 5.9854 7.5575 7.5575 8.8100 8.8100 9.6417 9.6417 10.5580 10.5580 11.3835 11.3835 13.0154 13.0154 13.0861 13.0861 k = 0.5000 0.8606 0.4579 ( 2050 PWs) bands (ev): -45.9837 -45.9837 -22.7245 -22.7245 -22.0830 -22.0830 -22.0581 -22.0581 3.9052 3.9052 3.9269 3.9269 5.9854 5.9854 7.5575 7.5575 8.8100 8.8100 9.6417 9.6417 10.5580 10.5580 11.3835 11.3835 13.0154 13.0154 13.0861 13.0861 k = 0.5000 0.8489 0.4468 ( 2050 PWs) bands (ev): -45.9839 -45.9839 -22.7238 -22.7238 -22.0821 -22.0821 -22.0576 -22.0576 3.7573 3.7573 3.9534 3.9534 6.0185 6.0185 7.5023 7.5023 9.0140 9.0140 9.6689 9.6689 10.5563 10.5563 11.3329 11.3329 12.9604 12.9604 13.0665 13.0665 k = 0.5000 0.8372 0.4356 ( 2060 PWs) bands (ev): -45.9842 -45.9842 -22.7231 -22.7231 -22.0813 -22.0813 -22.0570 -22.0570 3.6117 3.6117 3.9810 3.9810 6.0540 6.0540 7.4444 7.4444 9.2189 9.2189 9.6979 9.6979 10.5590 10.5590 11.2848 11.2848 12.9058 12.9058 13.0451 13.0451 k = 0.5000 0.8255 0.4244 ( 2060 PWs) bands (ev): -45.9845 -45.9845 -22.7223 -22.7223 -22.0803 -22.0803 -22.0563 -22.0563 3.4685 3.4685 4.0092 4.0092 6.0918 6.0918 7.3843 7.3843 9.4242 9.4242 9.7288 9.7288 10.5662 10.5662 11.2395 11.2395 12.8518 12.8518 13.0219 13.0219 k = 0.5000 0.8138 0.4132 ( 2064 PWs) bands (ev): -45.9848 -45.9848 -22.7215 -22.7215 -22.0794 -22.0794 -22.0555 -22.0555 3.3276 3.3276 4.0379 4.0379 6.1318 6.1318 7.3226 7.3226 9.6293 9.6293 9.7613 9.7613 10.5780 10.5780 11.1977 11.1977 12.7986 12.7986 12.9970 12.9970 k = 0.5000 0.8021 0.4021 ( 2064 PWs) bands (ev): -45.9851 -45.9851 -22.7207 -22.7207 -22.0784 -22.0784 -22.0547 -22.0547 3.1893 3.1893 4.0668 4.0668 6.1742 6.1742 7.2600 7.2600 9.7955 9.7955 9.8334 9.8334 10.5943 10.5943 11.1601 11.1601 12.7464 12.7464 12.9705 12.9705 k = 0.5000 0.7904 0.3909 ( 2068 PWs) bands (ev): -45.9854 -45.9854 -22.7198 -22.7198 -22.0775 -22.0775 -22.0537 -22.0537 3.0533 3.0533 4.0954 4.0954 6.2188 6.2188 7.1971 7.1971 9.8315 9.8315 10.0347 10.0347 10.6151 10.6151 11.1283 11.1283 12.6952 12.6952 12.9425 12.9425 k = 0.5000 0.7787 0.3797 ( 2068 PWs) bands (ev): -45.9858 -45.9858 -22.7189 -22.7189 -22.0765 -22.0765 -22.0527 -22.0527 2.9198 2.9198 4.1234 4.1234 6.2657 6.2657 7.1347 7.1347 9.8691 9.8691 10.2304 10.2304 10.6403 10.6403 11.1055 11.1055 12.6451 12.6451 12.9130 12.9130 k = 0.5000 0.7670 0.3685 ( 2066 PWs) bands (ev): -45.9861 -45.9861 -22.7179 -22.7179 -22.0756 -22.0756 -22.0516 -22.0516 2.7888 2.7888 4.1504 4.1504 6.3148 6.3148 7.0737 7.0737 9.9083 9.9083 10.4137 10.4137 10.6695 10.6695 11.0979 11.0979 12.5962 12.5962 12.8822 12.8822 k = 0.5000 0.7553 0.3573 ( 2062 PWs) bands (ev): -45.9865 -45.9865 -22.7169 -22.7169 -22.0746 -22.0746 -22.0504 -22.0504 2.6602 2.6602 4.1758 4.1758 6.3662 6.3662 7.0149 7.0149 9.9491 9.9491 10.5707 10.5707 10.7030 10.7030 11.1195 11.1195 12.5486 12.5486 12.8501 12.8501 k = 0.5000 0.7436 0.3462 ( 2058 PWs) bands (ev): -45.9869 -45.9869 -22.7158 -22.7158 -22.0737 -22.0737 -22.0490 -22.0490 2.5342 2.5342 4.1991 4.1991 6.4197 6.4197 6.9591 6.9591 9.9914 9.9914 10.6789 10.6789 10.7409 10.7409 11.1918 11.1918 12.5023 12.5023 12.8169 12.8169 k = 0.5000 0.7319 0.3350 ( 2058 PWs) bands (ev): -45.9872 -45.9872 -22.7147 -22.7147 -22.0728 -22.0728 -22.0476 -22.0476 2.4107 2.4107 4.2197 4.2197 6.4755 6.4755 6.9074 6.9074 10.0351 10.0351 10.7309 10.7309 10.7820 10.7820 11.3233 11.3233 12.4574 12.4574 12.7826 12.7826 k = 0.5000 0.7202 0.3238 ( 2054 PWs) bands (ev): -45.9876 -45.9876 -22.7136 -22.7136 -22.0719 -22.0719 -22.0461 -22.0461 2.2897 2.2897 4.2370 4.2370 6.5334 6.5334 6.8606 6.8606 10.0803 10.0803 10.7469 10.7469 10.8245 10.8245 11.4951 11.4951 12.4138 12.4138 12.7475 12.7475 k = 0.5000 0.7085 0.3126 ( 2054 PWs) bands (ev): -45.9880 -45.9880 -22.7125 -22.7125 -22.0711 -22.0711 -22.0445 -22.0445 2.1712 2.1712 4.2504 4.2504 6.5935 6.5935 6.8197 6.8197 10.1268 10.1268 10.7451 10.7451 10.8698 10.8698 11.6872 11.6872 12.3715 12.3715 12.7116 12.7116 k = 0.5000 0.6968 0.3015 ( 2054 PWs) bands (ev): -45.9884 -45.9884 -22.7114 -22.7114 -22.0703 -22.0703 -22.0428 -22.0428 2.0552 2.0552 4.2593 4.2593 6.6557 6.6557 6.7854 6.7854 10.1746 10.1746 10.7354 10.7354 10.9178 10.9178 11.8892 11.8892 12.3307 12.3307 12.6750 12.6750 k = 0.5000 0.6851 0.2903 ( 2054 PWs) bands (ev): -45.9888 -45.9888 -22.7103 -22.7103 -22.0695 -22.0695 -22.0410 -22.0410 1.9418 1.9418 4.2631 4.2631 6.7200 6.7200 6.7588 6.7588 10.2237 10.2237 10.7227 10.7227 10.9681 10.9681 12.0962 12.0962 12.2913 12.2913 12.6381 12.6381 k = 0.5000 0.6734 0.2791 ( 2052 PWs) bands (ev): -45.9893 -45.9893 -22.7091 -22.7091 -22.0688 -22.0688 -22.0391 -22.0391 1.8310 1.8310 4.2614 4.2614 6.7398 6.7398 6.7867 6.7867 10.2739 10.2739 10.7093 10.7093 11.0202 11.0202 12.2533 12.2533 12.3057 12.3057 12.6009 12.6009 k = 0.5000 0.6617 0.2679 ( 2052 PWs) bands (ev): -45.9897 -45.9897 -22.7079 -22.7079 -22.0680 -22.0680 -22.0372 -22.0372 1.7227 1.7227 4.2538 4.2538 6.7300 6.7300 6.8551 6.8551 10.3252 10.3252 10.6964 10.6964 11.0736 11.0736 12.2167 12.2167 12.5160 12.5160 12.5640 12.5640 k = 0.5000 0.6500 0.2567 ( 2052 PWs) bands (ev): -45.9901 -45.9901 -22.7067 -22.7067 -22.0673 -22.0673 -22.0352 -22.0352 1.6169 1.6169 4.2401 4.2401 6.7293 6.7293 6.9256 6.9256 10.3775 10.3775 10.6847 10.6847 11.1279 11.1279 12.1815 12.1815 12.5263 12.5263 12.7276 12.7276 k = 0.5000 0.6382 0.2456 ( 2050 PWs) bands (ev): -45.9906 -45.9906 -22.7055 -22.7055 -22.0666 -22.0666 -22.0331 -22.0331 1.5138 1.5138 4.2204 4.2204 6.7378 6.7378 6.9980 6.9980 10.4308 10.4308 10.6745 10.6745 11.1828 11.1828 12.1477 12.1477 12.4897 12.4897 12.9379 12.9379 k = 0.5000 0.6265 0.2344 ( 2052 PWs) bands (ev): -45.9910 -45.9910 -22.7043 -22.7043 -22.0660 -22.0660 -22.0310 -22.0310 1.4132 1.4132 4.1948 4.1948 6.7555 6.7555 7.0725 7.0725 10.4849 10.4849 10.6661 10.6661 11.2375 11.2375 12.1153 12.1153 12.4538 12.4538 13.1472 13.1472 k = 0.5000 0.6148 0.2232 ( 2062 PWs) bands (ev): -45.9915 -45.9915 -22.7032 -22.7032 -22.0654 -22.0654 -22.0289 -22.0289 1.3151 1.3151 4.1636 4.1636 6.7824 6.7824 7.1488 7.1488 10.5397 10.5397 10.6597 10.6597 11.2916 11.2916 12.0843 12.0843 12.4191 12.4191 13.3547 13.3547 k = 0.5000 0.6031 0.2120 ( 2064 PWs) bands (ev): -45.9919 -45.9919 -22.7020 -22.7020 -22.0648 -22.0648 -22.0267 -22.0267 1.2197 1.2197 4.1271 4.1271 6.8181 6.8181 7.2270 7.2270 10.5950 10.5950 10.6555 10.6555 11.3443 11.3443 12.0545 12.0545 12.3861 12.3861 13.5597 13.5597 k = 0.5000 0.5914 0.2009 ( 2064 PWs) bands (ev): -45.9923 -45.9923 -22.7008 -22.7008 -22.0642 -22.0642 -22.0245 -22.0245 1.1268 1.1268 4.0861 4.0861 6.8621 6.8621 7.3070 7.3070 10.6459 10.6459 10.6584 10.6584 11.3949 11.3949 12.0261 12.0261 12.3554 12.3554 13.7612 13.7612 k = 0.5000 0.5797 0.1897 ( 2076 PWs) bands (ev): -45.9928 -45.9928 -22.6997 -22.6997 -22.0636 -22.0636 -22.0223 -22.0223 1.0366 1.0366 4.0409 4.0409 6.9141 6.9141 7.3888 7.3888 10.6517 10.6517 10.7092 10.7092 11.4424 11.4424 11.9990 11.9990 12.3276 12.3276 13.9583 13.9583 k = 0.5000 0.5680 0.1785 ( 2076 PWs) bands (ev): -45.9932 -45.9932 -22.6985 -22.6985 -22.0630 -22.0630 -22.0201 -22.0201 0.9489 0.9489 3.9922 3.9922 6.9734 6.9734 7.4723 7.4723 10.6541 10.6541 10.7659 10.7659 11.4858 11.4858 11.9731 11.9731 12.3037 12.3037 14.1494 14.1494 k = 0.5000 0.5563 0.1673 ( 2080 PWs) bands (ev): -45.9937 -45.9937 -22.6973 -22.6973 -22.0624 -22.0624 -22.0178 -22.0178 0.8638 0.8638 3.9406 3.9406 7.0396 7.0396 7.5574 7.5574 10.6585 10.6585 10.8232 10.8232 11.5238 11.5238 11.9485 11.9485 12.2847 12.2847 14.3323 14.3323 k = 0.5000 0.5446 0.1561 ( 2080 PWs) bands (ev): -45.9941 -45.9941 -22.6961 -22.6961 -22.0618 -22.0618 -22.0156 -22.0156 0.7814 0.7814 3.8867 3.8867 7.1122 7.1122 7.6441 7.6441 10.6651 10.6651 10.8806 10.8806 11.5551 11.5551 11.9250 11.9250 12.2717 12.2717 14.5039 14.5039 k = 0.5000 0.5329 0.1450 ( 2080 PWs) bands (ev): -45.9946 -45.9946 -22.6949 -22.6949 -22.0612 -22.0612 -22.0133 -22.0133 0.7015 0.7015 3.8311 3.8311 7.1905 7.1905 7.7323 7.7323 10.6739 10.6739 10.9381 10.9381 11.5787 11.5787 11.9027 11.9027 12.2655 12.2655 14.6595 14.6595 k = 0.5000 0.5212 0.1338 ( 2078 PWs) bands (ev): -45.9950 -45.9950 -22.6938 -22.6938 -22.0606 -22.0606 -22.0110 -22.0110 0.6242 0.6242 3.7741 3.7741 7.2742 7.2742 7.8219 7.8219 10.6849 10.6849 10.9956 10.9956 11.5938 11.5938 11.8814 11.8814 12.2668 12.2668 14.7927 14.7927 k = 0.5000 0.5095 0.1226 ( 2074 PWs) bands (ev): -45.9954 -45.9954 -22.6926 -22.6926 -22.0600 -22.0600 -22.0087 -22.0087 0.5496 0.5496 3.7164 3.7164 7.3628 7.3628 7.9129 7.9129 10.6981 10.6981 11.0528 11.0528 11.6001 11.6001 11.8612 11.8612 12.2755 12.2755 14.8953 14.8953 k = 0.5000 0.4978 0.1114 ( 2074 PWs) bands (ev): -45.9958 -45.9958 -22.6915 -22.6915 -22.0594 -22.0594 -22.0065 -22.0065 0.4775 0.4775 3.6583 3.6583 7.4559 7.4559 8.0050 8.0050 10.7135 10.7135 11.1097 11.1097 11.5982 11.5982 11.8420 11.8420 12.2912 12.2912 14.9600 14.9600 k = 0.5000 0.4861 0.1003 ( 2074 PWs) bands (ev): -45.9962 -45.9962 -22.6904 -22.6904 -22.0588 -22.0588 -22.0043 -22.0043 0.4080 0.4080 3.6002 3.6002 7.5530 7.5530 8.0983 8.0983 10.7310 10.7310 11.1661 11.1661 11.5890 11.5890 11.8237 11.8237 12.3125 12.3125 14.9837 14.9837 k = 0.5000 0.4744 0.0891 ( 2078 PWs) bands (ev): -45.9966 -45.9966 -22.6893 -22.6893 -22.0583 -22.0583 -22.0021 -22.0021 0.3412 0.3412 3.5424 3.5424 7.6540 7.6540 8.1925 8.1925 10.7506 10.7506 11.2219 11.2219 11.5737 11.5737 11.8064 11.8064 12.3382 12.3382 14.9701 14.9701 k = 0.5000 0.4627 0.0779 ( 2078 PWs) bands (ev): -45.9970 -45.9970 -22.6882 -22.6882 -22.0577 -22.0577 -22.0000 -22.0000 0.2770 0.2770 3.4853 3.4853 7.7583 7.7583 8.2876 8.2876 10.7724 10.7724 11.2769 11.2769 11.5536 11.5536 11.7899 11.7899 12.3670 12.3670 14.9276 14.9276 k = 0.5000 0.4510 0.0667 ( 2078 PWs) bands (ev): -45.9974 -45.9974 -22.6872 -22.6872 -22.0572 -22.0572 -21.9979 -21.9979 0.2154 0.2154 3.4290 3.4290 7.8658 7.8658 8.3834 8.3834 10.7961 10.7961 11.3310 11.3310 11.5298 11.5298 11.7742 11.7742 12.3975 12.3975 14.8646 14.8646 k = 0.5000 0.4393 0.0555 ( 2074 PWs) bands (ev): -45.9978 -45.9978 -22.6862 -22.6862 -22.0566 -22.0566 -21.9958 -21.9958 0.1564 0.1564 3.3740 3.3740 7.9760 7.9760 8.4797 8.4797 10.8218 10.8218 11.3840 11.3840 11.5034 11.5034 11.7592 11.7592 12.4287 12.4287 14.7880 14.7880 k = 0.5000 0.4276 0.0444 ( 2058 PWs) bands (ev): -45.9982 -45.9982 -22.6851 -22.6851 -22.0560 -22.0560 -21.9937 -21.9937 0.1000 0.1000 3.3202 3.3202 8.0888 8.0888 8.5764 8.5764 10.8493 10.8493 11.4347 11.4347 11.4759 11.4759 11.7449 11.7449 12.4600 12.4600 14.7027 14.7027 k = 0.5000 0.4159 0.0332 ( 2054 PWs) bands (ev): -45.9985 -45.9985 -22.6841 -22.6841 -22.0554 -22.0554 -21.9918 -21.9918 0.0463 0.0463 3.2680 3.2680 8.2038 8.2038 8.6732 8.6732 10.8787 10.8787 11.4420 11.4420 11.4890 11.4890 11.7313 11.7313 12.4907 12.4907 14.6120 14.6120 k = 0.5000 0.4042 0.0220 ( 2042 PWs) bands (ev): -45.9988 -45.9988 -22.6832 -22.6832 -22.0548 -22.0548 -21.9898 -21.9898 -0.0049 -0.0049 3.2175 3.2175 8.3208 8.3208 8.7698 8.7698 10.9097 10.9097 11.4115 11.4115 11.5371 11.5371 11.7182 11.7182 12.5203 12.5203 14.5180 14.5180 k = 0.5000 0.3925 0.0108 ( 2038 PWs) bands (ev): -45.9992 -45.9992 -22.6823 -22.6823 -22.0543 -22.0543 -21.9880 -21.9880 -0.0534 -0.0534 3.1689 3.1689 8.4394 8.4394 8.8662 8.8662 10.9423 10.9423 11.3794 11.3794 11.5845 11.5845 11.7056 11.7056 12.5485 12.5485 14.4225 14.4225 k = 0.5000 0.3808-0.0003 ( 2042 PWs) bands (ev): -45.9995 -45.9995 -22.6815 -22.6815 -22.0539 -22.0539 -21.9863 -21.9863 -0.0993 -0.0993 3.1223 3.1223 8.5593 8.5593 8.9619 8.9619 10.9764 10.9764 11.3464 11.3464 11.6301 11.6301 11.6937 11.6937 12.5751 12.5751 14.3265 14.3265 k = 0.5000 0.3691-0.0115 ( 2040 PWs) bands (ev): -45.9998 -45.9998 -22.6807 -22.6807 -22.0534 -22.0534 -21.9846 -21.9846 -0.1426 -0.1426 3.0778 3.0778 8.6803 8.6803 9.0566 9.0566 11.0117 11.0117 11.3129 11.3129 11.6707 11.6707 11.6852 11.6852 12.5999 12.5999 14.2310 14.2310 k = 0.5000 0.3574-0.0227 ( 2042 PWs) bands (ev): -46.0001 -46.0001 -22.6799 -22.6799 -22.0530 -22.0530 -21.9830 -21.9830 -0.1832 -0.1832 3.0356 3.0356 8.8020 8.8020 9.1500 9.1500 11.0481 11.0481 11.2788 11.2788 11.6686 11.6686 11.7178 11.7178 12.6228 12.6228 14.1367 14.1367 k = 0.5000 0.3456-0.0339 ( 2042 PWs) bands (ev): -46.0003 -46.0003 -22.6792 -22.6792 -22.0526 -22.0526 -21.9815 -21.9815 -0.2213 -0.2213 2.9957 2.9957 8.9241 8.9241 9.2418 9.2418 11.0852 11.0852 11.2443 11.2443 11.6577 11.6577 11.7574 11.7574 12.6438 12.6438 14.0441 14.0441 k = 0.5000 0.3339-0.0450 ( 2040 PWs) bands (ev): -46.0006 -46.0006 -22.6786 -22.6786 -22.0522 -22.0522 -21.9800 -21.9800 -0.2567 -0.2567 2.9582 2.9582 9.0462 9.0462 9.3313 9.3313 11.1223 11.1223 11.2099 11.2099 11.6467 11.6467 11.7950 11.7950 12.6628 12.6628 13.9539 13.9539 k = 0.5000 0.3222-0.0562 ( 2044 PWs) bands (ev): -46.0008 -46.0008 -22.6780 -22.6780 -22.0519 -22.0519 -21.9787 -21.9787 -0.2895 -0.2895 2.9232 2.9232 9.1678 9.1678 9.4183 9.4183 11.1524 11.1524 11.1820 11.1820 11.6358 11.6358 11.8304 11.8304 12.6799 12.6799 13.8665 13.8665 k = 0.5000 0.3105-0.0674 ( 2044 PWs) bands (ev): -46.0010 -46.0010 -22.6774 -22.6774 -22.0515 -22.0515 -21.9775 -21.9775 -0.3197 -0.3197 2.8907 2.8907 9.2885 9.2885 9.5021 9.5021 11.1308 11.1308 11.2049 11.2049 11.6250 11.6250 11.8634 11.8634 12.6950 12.6950 13.7824 13.7824 k = 0.5000 0.2988-0.0786 ( 2040 PWs) bands (ev): -46.0012 -46.0012 -22.6769 -22.6769 -22.0512 -22.0512 -21.9763 -21.9763 -0.3472 -0.3472 2.8609 2.8609 9.4078 9.4078 9.5823 9.5823 11.0938 11.0938 11.2418 11.2418 11.6144 11.6144 11.8939 11.8939 12.7083 12.7083 13.7023 13.7023 k = 0.5000 0.2871-0.0898 ( 2048 PWs) bands (ev): -46.0014 -46.0014 -22.6764 -22.6764 -22.0509 -22.0509 -21.9753 -21.9753 -0.3721 -0.3721 2.8338 2.8338 9.5251 9.5251 9.6580 9.6580 11.0543 11.0543 11.2790 11.2790 11.6041 11.6041 11.9218 11.9218 12.7197 12.7197 13.6266 13.6266 k = 0.5000 0.2754-0.1009 ( 2048 PWs) bands (ev): -46.0016 -46.0016 -22.6760 -22.6760 -22.0507 -22.0507 -21.9744 -21.9744 -0.3944 -0.3944 2.8094 2.8094 9.6398 9.6398 9.7288 9.7288 11.0129 11.0129 11.3151 11.3151 11.5941 11.5941 11.9469 11.9469 12.7294 12.7294 13.5559 13.5559 k = 0.5000 0.2637-0.1121 ( 2052 PWs) bands (ev): -46.0017 -46.0017 -22.6756 -22.6756 -22.0505 -22.0505 -21.9736 -21.9736 -0.4141 -0.4141 2.7878 2.7878 9.7509 9.7509 9.7939 9.7939 10.9696 10.9696 11.3495 11.3495 11.5845 11.5845 11.9693 11.9693 12.7375 12.7375 13.4910 13.4910 k = 0.5000 0.2520-0.1233 ( 2056 PWs) bands (ev): -46.0019 -46.0019 -22.6753 -22.6753 -22.0503 -22.0503 -21.9729 -21.9729 -0.4312 -0.4312 2.7690 2.7690 9.8500 9.8500 9.8603 9.8603 10.9243 10.9243 11.3815 11.3815 11.5756 11.5756 11.9888 11.9888 12.7441 12.7441 13.4325 13.4325 k = 0.5000 0.2403-0.1345 ( 2054 PWs) bands (ev): -46.0020 -46.0020 -22.6750 -22.6750 -22.0501 -22.0501 -21.9723 -21.9723 -0.4456 -0.4456 2.7530 2.7530 9.9028 9.9028 9.9603 9.9603 10.8772 10.8772 11.4104 11.4104 11.5674 11.5674 12.0054 12.0054 12.7492 12.7492 13.3811 13.3811 k = 0.5000 0.2286-0.1456 ( 2054 PWs) bands (ev): -46.0021 -46.0021 -22.6748 -22.6748 -22.0499 -22.0499 -21.9718 -21.9718 -0.4574 -0.4574 2.7400 2.7400 9.9461 9.9461 10.0547 10.0547 10.8288 10.8288 11.4354 11.4354 11.5602 11.5602 12.0191 12.0191 12.7532 12.7532 13.3377 13.3377 k = 0.5000 0.2169-0.1568 ( 2054 PWs) bands (ev): -46.0021 -46.0021 -22.6746 -22.6746 -22.0498 -22.0498 -21.9714 -21.9714 -0.4666 -0.4666 2.7297 2.7297 9.9805 9.9805 10.1396 10.1396 10.7809 10.7809 11.4557 11.4557 11.5542 11.5542 12.0298 12.0298 12.7561 12.7561 13.3030 13.3030 k = 0.5000 0.2052-0.1680 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6745 -22.6745 -22.0497 -22.0497 -21.9711 -21.9711 -0.4732 -0.4732 2.7224 2.7224 10.0056 10.0056 10.2108 10.2108 10.7368 10.7368 11.4709 11.4709 11.5498 11.5498 12.0374 12.0374 12.7580 12.7580 13.2776 13.2776 k = 0.5000 0.1935-0.1792 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4771 -0.4771 2.7181 2.7181 10.0208 10.0208 10.2607 10.2607 10.7033 10.7033 11.4802 11.4802 11.5470 11.5470 12.0420 12.0420 12.7591 12.7591 13.2622 13.2622 k = 0.5000 0.1818-0.1904 ( 2052 PWs) bands (ev): -46.0022 -46.0022 -22.6744 -22.6744 -22.0497 -22.0497 -21.9709 -21.9709 -0.4784 -0.4784 2.7166 2.7166 10.0259 10.0259 10.2793 10.2793 10.6903 10.6903 11.4834 11.4834 11.5460 11.5460 12.0436 12.0436 12.7594 12.7594 13.2570 13.2570 k = 0.0000 0.8378 0.8001 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5873 4.5873 4.9903 4.9903 5.6273 5.6273 6.2477 6.2477 8.2072 8.2072 9.5139 9.5139 9.9925 9.9925 12.8404 12.8404 12.9929 12.9929 13.0196 13.0196 k = 0.0127 0.8424 0.7953 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5842 4.5842 4.9932 4.9932 5.6275 5.6275 6.2471 6.2471 8.2098 8.2098 9.5154 9.5154 9.9915 9.9915 12.7690 12.7690 13.0181 13.0181 13.0672 13.0672 k = 0.0253 0.8470 0.7904 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5752 4.5752 5.0017 5.0017 5.6281 5.6281 6.2454 6.2454 8.2174 8.2174 9.5200 9.5200 9.9885 9.9885 12.6520 12.6520 13.0255 13.0255 13.1814 13.1814 k = 0.0380 0.8516 0.7856 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.5608 4.5608 5.0151 5.0151 5.6292 5.6292 6.2425 6.2425 8.2299 8.2299 9.5277 9.5277 9.9834 9.9834 12.5286 12.5286 13.0367 13.0367 13.3010 13.3010 k = 0.0507 0.8562 0.7808 ( 2078 PWs) bands (ev): -45.9820 -45.9820 -22.7296 -22.7296 -22.0899 -22.0899 -22.0617 -22.0617 4.5420 4.5420 5.0328 5.0328 5.6306 5.6306 6.2386 6.2386 8.2473 8.2473 9.5384 9.5384 9.9765 9.9765 12.4038 12.4038 13.0522 13.0522 13.4204 13.4204 k = 0.0633 0.8608 0.7760 ( 2078 PWs) bands (ev): -45.9820 -45.9820 -22.7296 -22.7296 -22.0898 -22.0898 -22.0617 -22.0617 4.5195 4.5195 5.0539 5.0539 5.6325 5.6325 6.2336 6.2336 8.2691 8.2691 9.5521 9.5521 9.9677 9.9677 12.2794 12.2794 13.0720 13.0720 13.5363 13.5363 k = 0.0760 0.8654 0.7711 ( 2082 PWs) bands (ev): -45.9820 -45.9820 -22.7296 -22.7296 -22.0899 -22.0899 -22.0617 -22.0617 4.4941 4.4941 5.0779 5.0779 5.6347 5.6347 6.2275 6.2275 8.2952 8.2952 9.5687 9.5687 9.9571 9.9571 12.1559 12.1559 13.0959 13.0959 13.5637 13.5637 k = 0.0887 0.8700 0.7663 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4664 4.4664 5.1043 5.1043 5.6373 5.6373 6.2205 6.2205 8.3250 8.3250 9.5882 9.5882 9.9448 9.9448 12.0342 12.0342 13.1239 13.1239 13.5641 13.5641 k = 0.1013 0.8746 0.7615 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4370 4.4370 5.1327 5.1327 5.6403 5.6403 6.2127 6.2127 8.3581 8.3581 9.6104 9.6104 9.9311 9.9311 11.9148 11.9148 13.1559 13.1559 13.5643 13.5643 k = 0.8987-0.5110 0.5351 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4370 4.4370 5.1327 5.1327 5.6403 5.6403 6.2127 6.2127 8.3581 8.3581 9.6104 9.6104 9.9311 9.9311 11.9148 11.9148 13.1559 13.1559 13.5643 13.5643 k = 0.8844-0.5162 0.5405 ( 2076 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.4024 4.4024 5.1669 5.1669 5.6441 5.6441 6.2029 6.2029 8.3986 8.3986 9.6385 9.6385 9.9140 9.9140 11.7841 11.7841 13.1965 13.1965 13.5644 13.5644 k = 0.8702-0.5214 0.5459 ( 2074 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.3665 4.3665 5.2031 5.2031 5.6483 5.6483 6.1921 6.1921 8.4415 8.4415 9.6699 9.6699 9.8953 9.8953 11.6581 11.6581 13.2417 13.2417 13.5646 13.5646 k = 0.8560-0.5265 0.5513 ( 2078 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0617 -22.0617 4.3299 4.3299 5.2413 5.2413 5.6528 5.6528 6.1805 6.1805 8.4859 8.4859 9.7042 9.7042 9.8753 9.8753 11.5377 11.5377 13.2914 13.2914 13.5647 13.5647 k = 0.8417-0.5317 0.5568 ( 2070 PWs) bands (ev): -45.9820 -45.9820 -22.7295 -22.7295 -22.0898 -22.0898 -22.0616 -22.0616 4.2928 4.2928 5.2813 5.2813 5.6577 5.6577 6.1683 6.1683 8.5304 8.5304 9.7415 9.7415 9.8541 9.8541 11.4242 11.4242 13.3453 13.3453 13.5649 13.5649 k = 0.8275-0.5369 0.5622 ( 2066 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0616 -22.0616 4.2555 4.2555 5.3232 5.3232 5.6630 5.6630 6.1555 6.1555 8.5735 8.5735 9.7813 9.7813 9.8322 9.8322 11.3190 11.3190 13.4032 13.4032 13.5651 13.5651 k = 0.8132-0.5421 0.5676 ( 2058 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0615 -22.0615 4.2183 4.2183 5.3669 5.3669 5.6685 5.6685 6.1422 6.1422 8.6137 8.6137 9.8086 9.8086 9.8246 9.8246 11.2236 11.2236 13.4648 13.4648 13.5655 13.5655 k = 0.7990-0.5473 0.5730 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0615 -22.0615 4.1814 4.1814 5.4123 5.4123 5.6742 5.6742 6.1286 6.1286 8.6490 8.6490 9.7858 9.7858 9.8688 9.8688 11.1396 11.1396 13.5290 13.5290 13.5669 13.5669 k = 0.7848-0.5524 0.5785 ( 2056 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0615 -22.0615 4.1450 4.1450 5.4596 5.4596 5.6802 5.6802 6.1148 6.1148 8.6775 8.6775 9.7623 9.7623 9.9155 9.9155 11.0688 11.0688 13.5630 13.5630 13.6020 13.6020 k = 0.7705-0.5576 0.5839 ( 2056 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0897 -22.0897 -22.0615 -22.0615 4.1094 4.1094 5.5085 5.5085 5.6863 5.6863 6.1009 6.1009 8.6975 8.6975 9.7386 9.7386 9.9640 9.9640 11.0131 11.0131 13.5644 13.5644 13.6727 13.6727 k = 0.7563-0.5628 0.5893 ( 2058 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0896 -22.0896 -22.0615 -22.0615 4.0747 4.0747 5.5591 5.5591 5.6925 5.6925 6.0871 6.0871 8.7071 8.7071 9.7150 9.7150 10.0141 10.0141 10.9738 10.9738 13.5647 13.5647 13.7475 13.7475 k = 0.7421-0.5680 0.5947 ( 2058 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0896 -22.0896 -22.0615 -22.0615 4.0410 4.0410 5.6112 5.6112 5.6987 5.6987 6.0734 6.0734 8.7053 8.7053 9.6917 9.6917 10.0655 10.0655 10.9521 10.9521 13.5650 13.5650 13.8251 13.8251 k = 0.7278-0.5731 0.6001 ( 2060 PWs) bands (ev): -45.9820 -45.9820 -22.7294 -22.7294 -22.0896 -22.0896 -22.0615 -22.0615 4.0086 4.0086 5.6649 5.6649 5.7050 5.7050 6.0599 6.0599 8.6912 8.6912 9.6688 9.6688 10.1180 10.1180 10.9485 10.9485 13.5651 13.5651 13.9051 13.9051 k = 0.7136-0.5783 0.6056 ( 2060 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0615 -22.0615 3.9775 3.9775 5.7112 5.7112 5.7199 5.7199 6.0468 6.0468 8.6652 8.6652 9.6464 9.6464 10.1711 10.1711 10.9627 10.9627 13.5652 13.5652 13.9392 13.9392 k = 0.6993-0.5835 0.6110 ( 2058 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.9479 3.9479 5.7173 5.7173 5.7760 5.7760 6.0341 6.0341 8.6280 8.6280 9.6248 9.6248 10.2246 10.2246 10.9937 10.9937 13.5653 13.5653 13.8433 13.8433 k = 0.6851-0.5887 0.6164 ( 2062 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0615 -22.0615 3.9199 3.9199 5.7233 5.7233 5.8332 5.8332 6.0219 6.0219 8.5809 8.5809 9.6041 9.6041 10.2782 10.2782 11.0401 11.0401 13.5653 13.5653 13.7501 13.7501 k = 0.6709-0.5938 0.6218 ( 2062 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.8935 3.8935 5.7291 5.7291 5.8910 5.8910 6.0103 6.0103 8.5259 8.5259 9.5844 9.5844 10.3314 10.3314 11.0999 11.0999 13.5650 13.5650 13.6606 13.6606 k = 0.6566-0.5990 0.6272 ( 2062 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.8690 3.8690 5.7346 5.7346 5.9491 5.9491 5.9994 5.9994 8.4647 8.4647 9.5658 9.5658 10.3837 10.3837 11.1711 11.1711 13.5604 13.5604 13.5793 13.5793 k = 0.6424-0.6042 0.6327 ( 2056 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.8464 3.8464 5.7398 5.7398 5.9889 5.9889 6.0076 6.0076 8.3993 8.3993 9.5484 9.5484 10.4347 10.4347 11.2516 11.2516 13.4913 13.4913 13.5669 13.5669 k = 0.6281-0.6094 0.6381 ( 2060 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.8257 3.8257 5.7447 5.7447 5.9797 5.9797 6.0649 6.0649 8.3318 8.3318 9.5324 9.5324 10.4839 10.4839 11.3392 11.3392 13.4151 13.4151 13.5664 13.5664 k = 0.6139-0.6146 0.6435 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0895 -22.0895 -22.0614 -22.0614 3.8070 3.8070 5.7492 5.7492 5.9711 5.9711 6.1211 6.1211 8.2638 8.2638 9.5178 9.5178 10.5307 10.5307 11.4320 11.4320 13.3441 13.3441 13.5662 13.5662 k = 0.5997-0.6197 0.6489 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0614 -22.0614 3.7903 3.7903 5.7533 5.7533 5.9635 5.9635 6.1753 6.1753 8.1973 8.1973 9.5047 9.5047 10.5744 10.5744 11.5276 11.5276 13.2789 13.2789 13.5656 13.5656 k = 0.5854-0.6249 0.6543 ( 2060 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.7758 3.7758 5.7569 5.7569 5.9568 5.9568 6.2264 6.2264 8.1340 8.1340 9.4932 9.4932 10.6143 10.6143 11.6238 11.6238 13.2205 13.2205 13.5461 13.5461 k = 0.5712-0.6301 0.6598 ( 2056 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0613 -22.0613 3.7635 3.7635 5.7601 5.7601 5.9510 5.9510 6.2734 6.2734 8.0758 8.0758 9.4833 9.4833 10.6497 10.6497 11.7178 11.7178 13.1694 13.1694 13.4600 13.4600 k = 0.5570-0.6353 0.6652 ( 2058 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0895 -22.0895 -22.0613 -22.0613 3.7533 3.7533 5.7626 5.7626 5.9463 5.9463 6.3148 6.3148 8.0245 8.0245 9.4752 9.4752 10.6799 10.6799 11.8062 11.8062 13.1263 13.1263 13.3762 13.3762 k = 0.5427-0.6404 0.6706 ( 2062 PWs) bands (ev): -45.9820 -45.9820 -22.7293 -22.7293 -22.0896 -22.0896 -22.0614 -22.0614 3.7454 3.7454 5.7647 5.7647 5.9425 5.9425 6.3492 6.3492 7.9821 7.9821 9.4689 9.4689 10.7043 10.7043 11.8846 11.8846 13.0920 13.0920 13.3015 13.3015 k = 0.5285-0.6456 0.6760 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0613 -22.0613 3.7397 3.7397 5.7662 5.7662 5.9399 5.9399 6.3751 6.3751 7.9502 7.9502 9.4643 9.4643 10.7222 10.7222 11.9475 11.9475 13.0670 13.0670 13.2412 13.2412 k = 0.5142-0.6508 0.6814 ( 2054 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0613 -22.0613 3.7363 3.7363 5.7671 5.7671 5.9383 5.9383 6.3912 6.3912 7.9304 7.9304 9.4615 9.4615 10.7331 10.7331 11.9889 11.9889 13.0517 13.0517 13.2016 13.2016 k = 0.5000-0.6560 0.6869 ( 2046 PWs) bands (ev): -45.9820 -45.9820 -22.7292 -22.7292 -22.0895 -22.0895 -22.0612 -22.0612 3.7352 3.7352 5.7674 5.7674 5.9377 5.9377 6.3967 6.3967 7.9236 7.9236 9.4606 9.4606 10.7368 10.7368 12.0034 12.0034 13.0466 13.0466 13.1877 13.1877 k = 0.5000 0.1818 0.6483 ( 2040 PWs) bands (ev): -45.9919 -45.9919 -22.7059 -22.7059 -22.0893 -22.0893 -21.9970 -21.9970 2.2771 2.2771 2.3517 2.3517 7.0888 7.0888 7.2865 7.2865 10.1045 10.1045 11.0462 11.0462 12.0231 12.0231 13.1617 13.1617 13.9202 13.9202 13.9233 13.9233 k = 0.4904 0.1783 0.6358 ( 2041 PWs) bands (ev): -45.9920 -45.9920 -22.7058 -22.7058 -22.0892 -22.0892 -21.9970 -21.9970 2.1850 2.1850 2.4452 2.4452 7.0728 7.0728 7.3044 7.3044 10.1033 10.1033 11.0466 11.0466 12.0206 12.0206 13.1612 13.1612 13.9184 13.9184 13.9230 13.9230 k = 0.4808 0.1748 0.6234 ( 2041 PWs) bands (ev): -45.9920 -45.9920 -22.7057 -22.7057 -22.0891 -22.0891 -21.9970 -21.9970 2.0651 2.0651 2.5690 2.5690 7.0358 7.0358 7.3476 7.3476 10.0996 10.0996 11.0475 11.0475 12.0130 12.0130 13.1598 13.1598 13.9142 13.9142 13.9210 13.9210 k = 0.4712 0.1713 0.6109 ( 2042 PWs) bands (ev): -45.9920 -45.9920 -22.7056 -22.7056 -22.0888 -22.0888 -21.9970 -21.9970 1.9451 1.9451 2.6957 2.6957 6.9913 6.9913 7.4024 7.4024 10.0936 10.0936 11.0490 11.0490 12.0005 12.0005 13.1573 13.1573 13.9082 13.9082 13.9163 13.9163 k = 0.4615 0.1678 0.5984 ( 2043 PWs) bands (ev): -45.9921 -45.9921 -22.7053 -22.7053 -22.0884 -22.0884 -21.9970 -21.9970 1.8261 1.8261 2.8239 2.8239 6.9450 6.9450 7.4629 7.4629 10.0851 10.0851 11.0512 11.0512 11.9835 11.9835 13.1537 13.1537 13.9006 13.9006 13.9085 13.9085 k = 0.4519 0.1643 0.5860 ( 2045 PWs) bands (ev): -45.9922 -45.9922 -22.7050 -22.7050 -22.0880 -22.0880 -21.9970 -21.9970 1.7086 1.7086 2.9531 2.9531 6.8995 6.8995 7.5266 7.5266 10.0743 10.0743 11.0540 11.0540 11.9623 11.9623 13.1489 13.1489 13.8904 13.8904 13.8982 13.8982 k = 0.4423 0.1608 0.5735 ( 2048 PWs) bands (ev): -45.9923 -45.9923 -22.7047 -22.7047 -22.0874 -22.0874 -21.9970 -21.9970 1.5928 1.5928 3.0831 3.0831 6.8558 6.8558 7.5922 7.5922 10.0612 10.0612 11.0573 11.0573 11.9375 11.9375 13.1427 13.1427 13.8746 13.8746 13.8880 13.8880 k = 0.4327 0.1573 0.5610 ( 2047 PWs) bands (ev): -45.9924 -45.9924 -22.7042 -22.7042 -22.0868 -22.0868 -21.9969 -21.9969 1.4786 1.4786 3.2137 3.2137 6.8148 6.8148 7.6590 7.6590 10.0460 10.0460 11.0611 11.0611 11.9097 11.9097 13.1348 13.1348 13.8523 13.8523 13.8784 13.8784 k = 0.4231 0.1538 0.5486 ( 2047 PWs) bands (ev): -45.9925 -45.9925 -22.7037 -22.7037 -22.0860 -22.0860 -21.9969 -21.9969 1.3663 1.3663 3.3445 3.3445 6.7767 6.7767 7.7263 7.7263 10.0287 10.0287 11.0653 11.0653 11.8795 11.8795 13.1252 13.1252 13.8241 13.8241 13.8690 13.8690 k = 0.4135 0.1503 0.5361 ( 2047 PWs) bands (ev): -45.9927 -45.9927 -22.7031 -22.7031 -22.0851 -22.0851 -21.9968 -21.9968 1.2559 1.2559 3.4755 3.4755 6.7421 6.7421 7.7935 7.7935 10.0097 10.0097 11.0696 11.0696 11.8477 11.8477 13.1135 13.1135 13.7909 13.7909 13.8599 13.8599 k = 0.4038 0.1468 0.5236 ( 2046 PWs) bands (ev): -45.9929 -45.9929 -22.7025 -22.7025 -22.0842 -22.0842 -21.9967 -21.9967 1.1474 1.1474 3.6063 3.6063 6.7112 6.7112 7.8601 7.8601 9.9893 9.9893 11.0738 11.0738 11.8150 11.8150 13.0995 13.0995 13.7539 13.7539 13.8511 13.8511 k = 0.3942 0.1433 0.5112 ( 2044 PWs) bands (ev): -45.9931 -45.9931 -22.7018 -22.7018 -22.0832 -22.0832 -21.9966 -21.9966 1.0408 1.0408 3.7365 3.7365 6.6844 6.6844 7.9255 7.9255 9.9677 9.9677 11.0775 11.0775 11.7823 11.7823 13.0831 13.0831 13.7148 13.7148 13.8428 13.8428 k = 0.3846 0.1398 0.4987 ( 2044 PWs) bands (ev): -45.9933 -45.9933 -22.7011 -22.7011 -22.0821 -22.0821 -21.9965 -21.9965 0.9363 0.9363 3.8658 3.8658 6.6622 6.6622 7.9888 7.9888 9.9457 9.9457 11.0803 11.0803 11.7507 11.7507 13.0641 13.0641 13.6753 13.6753 13.8354 13.8354 k = 0.3750 0.1363 0.4862 ( 2046 PWs) bands (ev): -45.9935 -45.9935 -22.7003 -22.7003 -22.0809 -22.0809 -21.9964 -21.9964 0.8339 0.8339 3.9938 3.9938 6.6449 6.6449 8.0494 8.0494 9.9236 9.9236 11.0813 11.0813 11.7211 11.7211 13.0425 13.0425 13.6369 13.6369 13.8291 13.8291 k = 0.3654 0.1328 0.4738 ( 2045 PWs) bands (ev): -45.9937 -45.9937 -22.6995 -22.6995 -22.0797 -22.0797 -21.9962 -21.9962 0.7336 0.7336 4.1199 4.1199 6.6330 6.6330 8.1064 8.1064 9.9023 9.9023 11.0800 11.0800 11.6947 11.6947 13.0186 13.0186 13.6010 13.6010 13.8241 13.8241 k = 0.3558 0.1294 0.4613 ( 2043 PWs) bands (ev): -45.9939 -45.9939 -22.6986 -22.6986 -22.0784 -22.0784 -21.9960 -21.9960 0.6354 0.6354 4.2437 4.2437 6.6271 6.6271 8.1589 8.1589 9.8827 9.8827 11.0754 11.0754 11.6727 11.6727 12.9927 12.9927 13.5681 13.5681 13.8207 13.8207 k = 0.3462 0.1259 0.4488 ( 2042 PWs) bands (ev): -45.9942 -45.9942 -22.6977 -22.6977 -22.0770 -22.0770 -21.9958 -21.9958 0.5395 0.5395 4.3644 4.3644 6.6275 6.6275 8.2058 8.2058 9.8655 9.8655 11.0669 11.0669 11.6561 11.6561 12.9654 12.9654 13.5388 13.5388 13.8190 13.8190 k = 0.3365 0.1224 0.4364 ( 2041 PWs) bands (ev): -45.9944 -45.9944 -22.6968 -22.6968 -22.0756 -22.0756 -21.9955 -21.9955 0.4457 0.4457 4.4814 4.4814 6.6351 6.6351 8.2462 8.2462 9.8517 9.8517 11.0538 11.0538 11.6457 11.6457 12.9373 12.9373 13.5131 13.5131 13.8192 13.8192 k = 0.3269 0.1189 0.4239 ( 2038 PWs) bands (ev): -45.9947 -45.9947 -22.6958 -22.6958 -22.0742 -22.0742 -21.9952 -21.9952 0.3542 0.3542 4.5939 4.5939 6.6504 6.6504 8.2791 8.2791 9.8422 9.8422 11.0358 11.0358 11.6420 11.6420 12.9093 12.9093 13.4909 13.4909 13.8215 13.8215 k = 0.3173 0.1154 0.4114 ( 2042 PWs) bands (ev): -45.9950 -45.9950 -22.6949 -22.6949 -22.0728 -22.0728 -21.9949 -21.9949 0.2650 0.2650 4.7012 4.7012 6.6740 6.6740 8.3036 8.3036 9.8378 9.8378 11.0131 11.0131 11.6449 11.6449 12.8821 12.8821 13.4720 13.4720 13.8260 13.8260 k = 0.3077 0.1119 0.3990 ( 2041 PWs) bands (ev): -45.9953 -45.9953 -22.6939 -22.6939 -22.0713 -22.0713 -21.9945 -21.9945 0.1782 0.1782 4.8025 4.8025 6.7065 6.7065 8.3193 8.3193 9.8390 9.8390 10.9862 10.9862 11.6543 11.6543 12.8564 12.8564 13.4563 13.4563 13.8328 13.8328 k = 0.2981 0.1084 0.3865 ( 2043 PWs) bands (ev): -45.9956 -45.9956 -22.6929 -22.6929 -22.0698 -22.0698 -21.9941 -21.9941 0.0937 0.0937 4.8972 4.8972 6.7482 6.7482 8.3259 8.3259 9.8460 9.8460 10.9558 10.9558 11.6696 11.6696 12.8329 12.8329 13.4436 13.4436 13.8421 13.8421 k = 0.2885 0.1049 0.3740 ( 2044 PWs) bands (ev): -45.9959 -45.9959 -22.6919 -22.6919 -22.0684 -22.0684 -21.9937 -21.9937 0.0116 0.0116 4.9848 4.9848 6.7994 6.7994 8.3237 8.3237 9.8588 9.8588 10.9225 10.9225 11.6899 11.6899 12.8122 12.8122 13.4336 13.4336 13.8539 13.8539 k = 0.2788 0.1014 0.3615 ( 2043 PWs) bands (ev): -45.9962 -45.9962 -22.6909 -22.6909 -22.0669 -22.0669 -21.9931 -21.9931 -0.0681 -0.0681 5.0651 5.0651 6.8599 6.8599 8.3132 8.3132 9.8769 9.8769 10.8873 10.8873 11.7147 11.7147 12.7946 12.7946 13.4263 13.4263 13.8683 13.8683 k = 0.2692 0.0979 0.3491 ( 2042 PWs) bands (ev): -45.9965 -45.9965 -22.6899 -22.6899 -22.0655 -22.0655 -21.9926 -21.9926 -0.1454 -0.1454 5.1380 5.1380 6.9290 6.9290 8.2955 8.2955 9.8994 9.8994 10.8506 10.8506 11.7434 11.7434 12.7806 12.7806 13.4215 13.4215 13.8855 13.8855 k = 0.2596 0.0944 0.3366 ( 2040 PWs) bands (ev): -45.9968 -45.9968 -22.6888 -22.6888 -22.0641 -22.0641 -21.9919 -21.9919 -0.2202 -0.2202 5.2038 5.2038 7.0059 7.0059 8.2722 8.2722 9.9255 9.9255 10.8133 10.8133 11.7752 11.7752 12.7704 12.7704 13.4192 13.4192 13.9054 13.9054 k = 0.2500 0.0909 0.3241 ( 2040 PWs) bands (ev): -45.9971 -45.9971 -22.6878 -22.6878 -22.0627 -22.0627 -21.9912 -21.9912 -0.2925 -0.2925 5.2631 5.2631 7.0887 7.0887 8.2451 8.2451 9.9541 9.9541 10.7757 10.7757 11.8099 11.8099 12.7641 12.7641 13.4192 13.4192 13.9282 13.9282 k = 0.2404 0.0874 0.3117 ( 2041 PWs) bands (ev): -45.9974 -45.9974 -22.6868 -22.6868 -22.0614 -22.0614 -21.9905 -21.9905 -0.3622 -0.3622 5.3165 5.3165 7.1751 7.1751 8.2169 8.2169 9.9842 9.9842 10.7384 10.7384 11.8469 11.8469 12.7619 12.7619 13.4216 13.4216 13.9538 13.9538 k = 0.2308 0.0839 0.2992 ( 2042 PWs) bands (ev): -45.9977 -45.9977 -22.6859 -22.6859 -22.0601 -22.0601 -21.9897 -21.9897 -0.4295 -0.4295 5.3648 5.3648 7.2615 7.2615 8.1908 8.1908 10.0148 10.0148 10.7017 10.7017 11.8858 11.8858 12.7637 12.7637 13.4261 13.4261 13.9820 13.9820 k = 0.2212 0.0804 0.2867 ( 2043 PWs) bands (ev): -45.9980 -45.9980 -22.6849 -22.6849 -22.0589 -22.0589 -21.9888 -21.9888 -0.4941 -0.4941 5.4088 5.4088 7.3430 7.3430 8.1717 8.1717 10.0450 10.0450 10.6660 10.6660 11.9265 11.9265 12.7694 12.7694 13.4327 13.4327 14.0125 14.0125 k = 0.2115 0.0769 0.2743 ( 2044 PWs) bands (ev): -45.9984 -45.9984 -22.6840 -22.6840 -22.0577 -22.0577 -21.9879 -21.9879 -0.5562 -0.5562 5.4494 5.4494 7.4128 7.4128 8.1660 8.1660 10.0741 10.0741 10.6316 10.6316 11.9685 11.9685 12.7790 12.7790 13.4411 13.4411 14.0443 14.0443 k = 0.2019 0.0734 0.2618 ( 2043 PWs) bands (ev): -45.9987 -45.9987 -22.6831 -22.6831 -22.0566 -22.0566 -21.9870 -21.9870 -0.6157 -0.6157 5.4874 5.4874 7.4632 7.4632 8.1812 8.1812 10.1017 10.1017 10.5987 10.5987 12.0117 12.0117 12.7921 12.7921 13.4511 13.4511 14.0760 14.0760 k = 0.1923 0.0699 0.2493 ( 2044 PWs) bands (ev): -45.9990 -45.9990 -22.6822 -22.6822 -22.0556 -22.0556 -21.9860 -21.9860 -0.6725 -0.6725 5.5233 5.5233 7.4882 7.4882 8.2226 8.2226 10.1271 10.1271 10.5678 10.5678 12.0558 12.0558 12.8086 12.8086 13.4624 13.4624 14.1057 14.1057 k = 0.1827 0.0664 0.2369 ( 2042 PWs) bands (ev): -45.9992 -45.9992 -22.6813 -22.6813 -22.0546 -22.0546 -21.9849 -21.9849 -0.7267 -0.7267 5.5578 5.5578 7.4875 7.4875 8.2902 8.2902 10.1502 10.1502 10.5390 10.5390 12.1006 12.1006 12.8284 12.8284 13.4749 13.4749 14.1316 14.1316 k = 0.1731 0.0629 0.2244 ( 2045 PWs) bands (ev): -45.9995 -45.9995 -22.6805 -22.6805 -22.0537 -22.0537 -21.9839 -21.9839 -0.7782 -0.7782 5.5914 5.5914 7.4657 7.4657 8.3786 8.3786 10.1709 10.1709 10.5125 10.5125 12.1459 12.1459 12.8512 12.8512 13.4882 13.4882 14.1533 14.1533 k = 0.1635 0.0594 0.2119 ( 2041 PWs) bands (ev): -45.9998 -45.9998 -22.6797 -22.6797 -22.0529 -22.0529 -21.9828 -21.9828 -0.8270 -0.8270 5.6245 5.6245 7.4289 7.4289 8.4813 8.4813 10.1890 10.1890 10.4888 10.4888 12.1916 12.1916 12.8769 12.8769 13.5021 13.5021 14.1714 14.1714 k = 0.1538 0.0559 0.1995 ( 2041 PWs) bands (ev): -46.0001 -46.0001 -22.6789 -22.6789 -22.0521 -22.0521 -21.9817 -21.9817 -0.8732 -0.8732 5.6575 5.6575 7.3821 7.3821 8.5925 8.5925 10.2048 10.2048 10.4680 10.4680 12.2373 12.2373 12.9054 12.9054 13.5163 13.5163 14.1871 14.1871 k = 0.1442 0.0524 0.1870 ( 2036 PWs) bands (ev): -46.0003 -46.0003 -22.6782 -22.6782 -22.0514 -22.0514 -21.9806 -21.9806 -0.9166 -0.9166 5.6907 5.6907 7.3289 7.3289 8.7078 8.7078 10.2185 10.2185 10.4504 10.4504 12.2828 12.2828 12.9366 12.9366 13.5307 13.5307 14.2014 14.2014 k = 0.1346 0.0489 0.1745 ( 2037 PWs) bands (ev): -46.0005 -46.0005 -22.6775 -22.6775 -22.0508 -22.0508 -21.9795 -21.9795 -0.9573 -0.9573 5.7242 5.7242 7.2715 7.2715 8.8240 8.8240 10.2303 10.2303 10.4361 10.4361 12.3279 12.3279 12.9707 12.9707 13.5450 13.5450 14.2149 14.2149 k = 0.1250 0.0454 0.1621 ( 2038 PWs) bands (ev): -46.0008 -46.0008 -22.6769 -22.6769 -22.0502 -22.0502 -21.9784 -21.9784 -0.9952 -0.9952 5.7583 5.7583 7.2116 7.2116 8.9384 8.9384 10.2410 10.2410 10.4254 10.4254 12.3722 12.3722 13.0078 13.0078 13.5591 13.5591 14.2281 14.2281 k = 0.1154 0.0420 0.1496 ( 2039 PWs) bands (ev): -46.0010 -46.0010 -22.6763 -22.6763 -22.0497 -22.0497 -21.9774 -21.9774 -1.0304 -1.0304 5.7931 5.7931 7.1502 7.1502 9.0487 9.0487 10.2509 10.2509 10.4184 10.4184 12.4155 12.4155 13.0478 13.0478 13.5728 13.5728 14.2412 14.2412 k = 0.1058 0.0385 0.1371 ( 2041 PWs) bands (ev): -46.0012 -46.0012 -22.6757 -22.6757 -22.0493 -22.0493 -21.9765 -21.9765 -1.0628 -1.0628 5.8287 5.8287 7.0883 7.0883 9.1529 9.1529 10.2606 10.2606 10.4153 10.4153 12.4574 12.4574 13.0911 13.0911 13.5863 13.5863 14.2545 14.2545 k = 0.0962 0.0350 0.1247 ( 2037 PWs) bands (ev): -46.0014 -46.0014 -22.6752 -22.6752 -22.0489 -22.0489 -21.9755 -21.9755 -1.0925 -1.0925 5.8650 5.8650 7.0264 7.0264 9.2490 9.2490 10.2704 10.2704 10.4166 10.4166 12.4975 12.4975 13.1377 13.1377 13.5993 13.5993 14.2681 14.2681 k = 0.0865 0.0315 0.1122 ( 2038 PWs) bands (ev): -46.0015 -46.0015 -22.6747 -22.6747 -22.0486 -22.0486 -21.9746 -21.9746 -1.1193 -1.1193 5.9020 5.9020 6.9651 6.9651 9.3355 9.3355 10.2801 10.2801 10.4227 10.4227 12.5355 12.5355 13.1878 13.1878 13.6121 13.6121 14.2819 14.2819 k = 0.0769 0.0280 0.0997 ( 2039 PWs) bands (ev): -46.0017 -46.0017 -22.6743 -22.6743 -22.0483 -22.0483 -21.9738 -21.9738 -1.1434 -1.1434 5.9397 5.9397 6.9050 6.9050 9.4110 9.4110 10.2892 10.2892 10.4344 10.4344 12.5709 12.5709 13.2412 13.2412 13.6247 13.6247 14.2958 14.2958 k = 0.0673 0.0245 0.0873 ( 2043 PWs) bands (ev): -46.0018 -46.0018 -22.6740 -22.6740 -22.0480 -22.0480 -21.9731 -21.9731 -1.1646 -1.1646 5.9777 5.9777 6.8465 6.8465 9.4749 9.4749 10.2970 10.2970 10.4515 10.4515 12.6034 12.6034 13.2975 13.2975 13.6374 13.6374 14.3097 14.3097 k = 0.0577 0.0210 0.0748 ( 2042 PWs) bands (ev): -46.0019 -46.0019 -22.6737 -22.6737 -22.0478 -22.0478 -21.9724 -21.9724 -1.1830 -1.1830 6.0158 6.0158 6.7902 6.7902 9.5272 9.5272 10.3031 10.3031 10.4734 10.4734 12.6325 12.6325 13.3557 13.3557 13.6507 13.6507 14.3229 14.3229 k = 0.0481 0.0175 0.0623 ( 2043 PWs) bands (ev): -46.0020 -46.0020 -22.6734 -22.6734 -22.0476 -22.0476 -21.9719 -21.9719 -1.1986 -1.1986 6.0532 6.0532 6.7371 6.7371 9.5686 9.5686 10.3075 10.3075 10.4982 10.4982 12.6579 12.6579 13.4137 13.4137 13.6656 13.6656 14.3338 14.3338 k = 0.0385 0.0140 0.0499 ( 2042 PWs) bands (ev): -46.0021 -46.0021 -22.6732 -22.6732 -22.0475 -22.0475 -21.9714 -21.9714 -1.2114 -1.2114 6.0890 6.0890 6.6883 6.6883 9.6001 9.6001 10.3105 10.3105 10.5232 10.5232 12.6793 12.6793 13.4680 13.4680 13.6839 13.6839 14.3382 14.3382 k = 0.0288 0.0105 0.0374 ( 2043 PWs) bands (ev): -46.0022 -46.0022 -22.6730 -22.6730 -22.0474 -22.0474 -21.9711 -21.9711 -1.2213 -1.2213 6.1217 6.1217 6.6454 6.6454 9.6230 9.6230 10.3125 10.3125 10.5458 10.5458 12.6962 12.6962 13.5135 13.5135 13.7069 13.7069 14.3306 14.3306 k = 0.0192 0.0070 0.0249 ( 2043 PWs) bands (ev): -46.0022 -46.0022 -22.6729 -22.6729 -22.0473 -22.0473 -21.9708 -21.9708 -1.2284 -1.2284 6.1489 6.1489 6.6108 6.6108 9.6384 9.6384 10.3137 10.3137 10.5638 10.5638 12.7085 12.7085 13.5457 13.5457 13.7336 13.7336 14.3148 14.3148 k = 0.0096 0.0035 0.0125 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0473 -22.0473 -21.9706 -21.9706 -1.2327 -1.2327 6.1674 6.1674 6.5878 6.5878 9.6473 9.6473 10.3144 10.3144 10.5753 10.5753 12.7159 12.7159 13.5637 13.5637 13.7568 13.7568 14.3000 14.3000 k = 0.0000 0.0000 0.0000 ( 2045 PWs) bands (ev): -46.0023 -46.0023 -22.6728 -22.6728 -22.0472 -22.0472 -21.9706 -21.9706 -1.2341 -1.2341 6.1741 6.1741 6.5797 6.5797 9.6502 9.6502 10.3146 10.3146 10.5793 10.5793 12.7184 12.7184 13.5693 13.5693 13.7662 13.7662 14.2941 14.2941 Writing output data file TiSi2.save init_run : 3.52s CPU 12.92s WALL ( 1 calls) electrons : 332.20s CPU 337.35s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.38s CPU 1.53s WALL ( 1 calls) Called by electrons: c_bands : 332.14s CPU 337.13s WALL ( 1 calls) v_of_rho : 0.20s CPU 1.05s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.19s CPU 0.64s WALL ( 1 calls) newd : 0.39s CPU 0.53s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.06s WALL ( 536 calls) cegterg : 277.53s CPU 279.72s WALL ( 823 calls) Called by sum_band: Called by *egterg: h_psi : 165.09s CPU 171.66s WALL ( 14219 calls) s_psi : 7.92s CPU 9.05s WALL ( 14219 calls) g_psi : 0.21s CPU 0.32s WALL ( 12860 calls) cdiaghg : 76.82s CPU 74.98s WALL ( 13396 calls) cegterg:over : 21.27s CPU 18.00s WALL ( 12860 calls) cegterg:upda : 1.70s CPU 3.54s WALL ( 12860 calls) cegterg:last : 1.94s CPU 2.82s WALL ( 2765 calls) Called by h_psi: h_psi:vloc : 146.65s CPU 153.35s WALL ( 14219 calls) h_psi:vnl : 18.35s CPU 18.05s WALL ( 14219 calls) add_vuspsi : 3.60s CPU 6.53s WALL ( 14219 calls) General routines calbec : 14.70s CPU 11.42s WALL ( 14219 calls) fft : 0.24s CPU 1.41s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 137.50s CPU 142.75s WALL ( 935220 calls) interpolate : 0.01s CPU 0.02s WALL ( 4 calls) davcio : 0.05s CPU 2.08s WALL ( 1072 calls) Parallel routines fft_scatter : 77.54s CPU 80.15s WALL ( 935243 calls) PWSCF : 6m20.57s CPU 8m21.31s WALL This run was terminated on: 4:11: 1 21Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=