Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:17: 0 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TiSi2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 39 39 11 870 870 137 Max 40 40 12 873 873 142 Sum 1435 1435 419 31359 31359 5011 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 = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 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: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 PseudoPot. # 2 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential 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 and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E 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 0.0984848), 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 0.2954545), 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 0.4015152), 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 0.5474275), 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 0.5677537), 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 0.1568185 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 0.3427084 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 0.4929577), 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 0.3370864), 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 0.4493407 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 0.3888805 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 0.3006729 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 0.5397780), 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 0.2124653 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 0.4711539), 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 0.1538462), 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 0.0961539 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: 31359 G-vectors FFT dimensions: ( 60, 60, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 224, 28) NL pseudopotentials 0.17 Mb ( 112, 102) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 871) G-vector shells 0.01 Mb ( 810) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.38 Mb ( 224, 112) Each subspace H/S matrix 0.01 Mb ( 28, 28) Each matrix 0.09 Mb ( 102, 2, 28) The potential is recalculated from file : ./TiSi2.save/charge-density.dat Starting wfc are 16 randomized atomic wfcs + 12 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.1 secs Computing kpt #: 2 total cpu time spent up to now is 7.5 secs Computing kpt #: 3 total cpu time spent up to now is 7.9 secs Computing kpt #: 4 total cpu time spent up to now is 8.2 secs Computing kpt #: 5 total cpu time spent up to now is 8.6 secs Computing kpt #: 6 total cpu time spent up to now is 8.9 secs Computing kpt #: 7 total cpu time spent up to now is 9.3 secs Computing kpt #: 8 total cpu time spent up to now is 9.6 secs Computing kpt #: 9 total cpu time spent up to now is 9.9 secs Computing kpt #: 10 total cpu time spent up to now is 10.2 secs Computing kpt #: 11 total cpu time spent up to now is 10.5 secs Computing kpt #: 12 total cpu time spent up to now is 10.8 secs Computing kpt #: 13 total cpu time spent up to now is 11.1 secs Computing kpt #: 14 total cpu time spent up to now is 11.4 secs Computing kpt #: 15 total cpu time spent up to now is 11.6 secs Computing kpt #: 16 total cpu time spent up to now is 11.9 secs Computing kpt #: 17 total cpu time spent up to now is 12.2 secs Computing kpt #: 18 total cpu time spent up to now is 12.4 secs Computing kpt #: 19 total cpu time spent up to now is 12.7 secs Computing kpt #: 20 total cpu time spent up to now is 12.9 secs Computing kpt #: 21 total cpu time spent up to now is 13.2 secs Computing kpt #: 22 total cpu time spent up to now is 13.4 secs Computing kpt #: 23 total cpu time spent up to now is 13.7 secs Computing kpt #: 24 total cpu time spent up to now is 13.9 secs Computing kpt #: 25 total cpu time spent up to now is 14.2 secs Computing kpt #: 26 total cpu time spent up to now is 14.4 secs Computing kpt #: 27 total cpu time spent up to now is 14.7 secs Computing kpt #: 28 total cpu time spent up to now is 14.9 secs Computing kpt #: 29 total cpu time spent up to now is 15.2 secs Computing kpt #: 30 total cpu time spent up to now is 15.4 secs Computing kpt #: 31 total cpu time spent up to now is 15.8 secs Computing kpt #: 32 total cpu time spent up to now is 16.1 secs Computing kpt #: 33 total cpu time spent up to now is 16.4 secs Computing kpt #: 34 total cpu time spent up to now is 16.7 secs Computing kpt #: 35 total cpu time spent up to now is 17.1 secs Computing kpt #: 36 total cpu time spent up to now is 17.4 secs Computing kpt #: 37 total cpu time spent up to now is 17.8 secs Computing kpt #: 38 total cpu time spent up to now is 18.2 secs Computing kpt #: 39 total cpu time spent up to now is 18.6 secs Computing kpt #: 40 total cpu time spent up to now is 19.0 secs Computing kpt #: 41 total cpu time spent up to now is 19.4 secs Computing kpt #: 42 total cpu time spent up to now is 19.7 secs Computing kpt #: 43 total cpu time spent up to now is 20.1 secs Computing kpt #: 44 total cpu time spent up to now is 20.5 secs Computing kpt #: 45 total cpu time spent up to now is 20.9 secs Computing kpt #: 46 total cpu time spent up to now is 21.3 secs Computing kpt #: 47 total cpu time spent up to now is 21.7 secs Computing kpt #: 48 total cpu time spent up to now is 22.1 secs Computing kpt #: 49 total cpu time spent up to now is 22.4 secs Computing kpt #: 50 total cpu time spent up to now is 22.7 secs Computing kpt #: 51 total cpu time spent up to now is 23.1 secs Computing kpt #: 52 total cpu time spent up to now is 23.4 secs Computing kpt #: 53 total cpu time spent up to now is 23.8 secs Computing kpt #: 54 total cpu time spent up to now is 24.2 secs Computing kpt #: 55 total cpu time spent up to now is 24.6 secs Computing kpt #: 56 total cpu time spent up to now is 25.0 secs Computing kpt #: 57 total cpu time spent up to now is 25.3 secs Computing kpt #: 58 total cpu time spent up to now is 25.7 secs Computing kpt #: 59 total cpu time spent up to now is 26.1 secs Computing kpt #: 60 total cpu time spent up to now is 26.4 secs Computing kpt #: 61 total cpu time spent up to now is 26.8 secs Computing kpt #: 62 total cpu time spent up to now is 27.2 secs Computing kpt #: 63 total cpu time spent up to now is 27.6 secs Computing kpt #: 64 total cpu time spent up to now is 28.0 secs Computing kpt #: 65 total cpu time spent up to now is 28.4 secs Computing kpt #: 66 total cpu time spent up to now is 28.7 secs Computing kpt #: 67 total cpu time spent up to now is 29.1 secs Computing kpt #: 68 total cpu time spent up to now is 29.4 secs Computing kpt #: 69 total cpu time spent up to now is 29.8 secs Computing kpt #: 70 total cpu time spent up to now is 30.2 secs Computing kpt #: 71 total cpu time spent up to now is 30.5 secs Computing kpt #: 72 total cpu time spent up to now is 30.9 secs Computing kpt #: 73 total cpu time spent up to now is 31.3 secs Computing kpt #: 74 total cpu time spent up to now is 31.6 secs Computing kpt #: 75 total cpu time spent up to now is 32.0 secs Computing kpt #: 76 total cpu time spent up to now is 32.3 secs Computing kpt #: 77 total cpu time spent up to now is 32.6 secs Computing kpt #: 78 total cpu time spent up to now is 32.9 secs Computing kpt #: 79 total cpu time spent up to now is 33.2 secs Computing kpt #: 80 total cpu time spent up to now is 33.4 secs Computing kpt #: 81 total cpu time spent up to now is 33.7 secs Computing kpt #: 82 total cpu time spent up to now is 33.9 secs Computing kpt #: 83 total cpu time spent up to now is 34.2 secs Computing kpt #: 84 total cpu time spent up to now is 34.4 secs Computing kpt #: 85 total cpu time spent up to now is 34.7 secs Computing kpt #: 86 total cpu time spent up to now is 34.9 secs Computing kpt #: 87 total cpu time spent up to now is 35.2 secs Computing kpt #: 88 total cpu time spent up to now is 35.5 secs Computing kpt #: 89 total cpu time spent up to now is 35.8 secs Computing kpt #: 90 total cpu time spent up to now is 36.1 secs Computing kpt #: 91 total cpu time spent up to now is 36.3 secs Computing kpt #: 92 total cpu time spent up to now is 36.6 secs Computing kpt #: 93 total cpu time spent up to now is 36.9 secs Computing kpt #: 94 total cpu time spent up to now is 37.2 secs Computing kpt #: 95 total cpu time spent up to now is 37.5 secs Computing kpt #: 96 total cpu time spent up to now is 37.8 secs Computing kpt #: 97 total cpu time spent up to now is 38.0 secs Computing kpt #: 98 total cpu time spent up to now is 38.3 secs Computing kpt #: 99 total cpu time spent up to now is 38.6 secs Computing kpt #: 100 total cpu time spent up to now is 38.9 secs Computing kpt #: 101 total cpu time spent up to now is 39.1 secs Computing kpt #: 102 total cpu time spent up to now is 39.4 secs Computing kpt #: 103 total cpu time spent up to now is 39.7 secs Computing kpt #: 104 total cpu time spent up to now is 39.9 secs Computing kpt #: 105 total cpu time spent up to now is 40.2 secs Computing kpt #: 106 total cpu time spent up to now is 40.5 secs Computing kpt #: 107 total cpu time spent up to now is 40.8 secs Computing kpt #: 108 total cpu time spent up to now is 41.1 secs Computing kpt #: 109 total cpu time spent up to now is 41.3 secs Computing kpt #: 110 total cpu time spent up to now is 41.6 secs Computing kpt #: 111 total cpu time spent up to now is 41.8 secs Computing kpt #: 112 total cpu time spent up to now is 42.1 secs Computing kpt #: 113 total cpu time spent up to now is 42.3 secs Computing kpt #: 114 total cpu time spent up to now is 42.6 secs Computing kpt #: 115 total cpu time spent up to now is 42.8 secs Computing kpt #: 116 total cpu time spent up to now is 43.1 secs Computing kpt #: 117 total cpu time spent up to now is 43.3 secs Computing kpt #: 118 total cpu time spent up to now is 43.6 secs Computing kpt #: 119 total cpu time spent up to now is 43.9 secs Computing kpt #: 120 total cpu time spent up to now is 44.1 secs Computing kpt #: 121 total cpu time spent up to now is 44.4 secs Computing kpt #: 122 total cpu time spent up to now is 44.7 secs Computing kpt #: 123 total cpu time spent up to now is 45.0 secs Computing kpt #: 124 total cpu time spent up to now is 45.4 secs Computing kpt #: 125 total cpu time spent up to now is 45.7 secs Computing kpt #: 126 total cpu time spent up to now is 46.1 secs Computing kpt #: 127 total cpu time spent up to now is 46.4 secs Computing kpt #: 128 total cpu time spent up to now is 46.8 secs Computing kpt #: 129 total cpu time spent up to now is 47.1 secs Computing kpt #: 130 total cpu time spent up to now is 47.4 secs Computing kpt #: 131 total cpu time spent up to now is 47.7 secs Computing kpt #: 132 total cpu time spent up to now is 48.0 secs Computing kpt #: 133 total cpu time spent up to now is 48.3 secs Computing kpt #: 134 total cpu time spent up to now is 48.6 secs Computing kpt #: 135 total cpu time spent up to now is 48.9 secs Computing kpt #: 136 total cpu time spent up to now is 49.1 secs Computing kpt #: 137 total cpu time spent up to now is 49.4 secs Computing kpt #: 138 total cpu time spent up to now is 49.7 secs Computing kpt #: 139 total cpu time spent up to now is 50.0 secs Computing kpt #: 140 total cpu time spent up to now is 50.4 secs Computing kpt #: 141 total cpu time spent up to now is 50.7 secs Computing kpt #: 142 total cpu time spent up to now is 51.0 secs Computing kpt #: 143 total cpu time spent up to now is 51.3 secs Computing kpt #: 144 total cpu time spent up to now is 51.6 secs Computing kpt #: 145 total cpu time spent up to now is 51.9 secs Computing kpt #: 146 total cpu time spent up to now is 52.3 secs Computing kpt #: 147 total cpu time spent up to now is 52.6 secs Computing kpt #: 148 total cpu time spent up to now is 52.9 secs Computing kpt #: 149 total cpu time spent up to now is 53.2 secs Computing kpt #: 150 total cpu time spent up to now is 53.5 secs Computing kpt #: 151 total cpu time spent up to now is 53.9 secs Computing kpt #: 152 total cpu time spent up to now is 54.2 secs Computing kpt #: 153 total cpu time spent up to now is 54.5 secs Computing kpt #: 154 total cpu time spent up to now is 54.8 secs Computing kpt #: 155 total cpu time spent up to now is 55.1 secs Computing kpt #: 156 total cpu time spent up to now is 55.5 secs Computing kpt #: 157 total cpu time spent up to now is 55.8 secs Computing kpt #: 158 total cpu time spent up to now is 56.2 secs Computing kpt #: 159 total cpu time spent up to now is 56.5 secs Computing kpt #: 160 total cpu time spent up to now is 56.9 secs Computing kpt #: 161 total cpu time spent up to now is 57.2 secs Computing kpt #: 162 total cpu time spent up to now is 57.6 secs Computing kpt #: 163 total cpu time spent up to now is 57.9 secs Computing kpt #: 164 total cpu time spent up to now is 58.3 secs Computing kpt #: 165 total cpu time spent up to now is 58.7 secs Computing kpt #: 166 total cpu time spent up to now is 59.0 secs Computing kpt #: 167 total cpu time spent up to now is 59.3 secs Computing kpt #: 168 total cpu time spent up to now is 59.5 secs Computing kpt #: 169 total cpu time spent up to now is 59.8 secs Computing kpt #: 170 total cpu time spent up to now is 60.0 secs Computing kpt #: 171 total cpu time spent up to now is 60.3 secs Computing kpt #: 172 total cpu time spent up to now is 60.5 secs Computing kpt #: 173 total cpu time spent up to now is 60.8 secs Computing kpt #: 174 total cpu time spent up to now is 61.1 secs Computing kpt #: 175 total cpu time spent up to now is 61.3 secs Computing kpt #: 176 total cpu time spent up to now is 61.6 secs Computing kpt #: 177 total cpu time spent up to now is 61.9 secs Computing kpt #: 178 total cpu time spent up to now is 62.2 secs Computing kpt #: 179 total cpu time spent up to now is 62.6 secs Computing kpt #: 180 total cpu time spent up to now is 63.0 secs Computing kpt #: 181 total cpu time spent up to now is 63.3 secs Computing kpt #: 182 total cpu time spent up to now is 63.7 secs Computing kpt #: 183 total cpu time spent up to now is 64.1 secs Computing kpt #: 184 total cpu time spent up to now is 64.5 secs Computing kpt #: 185 total cpu time spent up to now is 64.9 secs Computing kpt #: 186 total cpu time spent up to now is 65.3 secs Computing kpt #: 187 total cpu time spent up to now is 65.6 secs Computing kpt #: 188 total cpu time spent up to now is 66.0 secs Computing kpt #: 189 total cpu time spent up to now is 66.4 secs Computing kpt #: 190 total cpu time spent up to now is 66.8 secs Computing kpt #: 191 total cpu time spent up to now is 67.2 secs Computing kpt #: 192 total cpu time spent up to now is 67.6 secs Computing kpt #: 193 total cpu time spent up to now is 68.0 secs Computing kpt #: 194 total cpu time spent up to now is 68.4 secs Computing kpt #: 195 total cpu time spent up to now is 68.8 secs Computing kpt #: 196 total cpu time spent up to now is 69.2 secs Computing kpt #: 197 total cpu time spent up to now is 69.6 secs Computing kpt #: 198 total cpu time spent up to now is 70.0 secs Computing kpt #: 199 total cpu time spent up to now is 70.3 secs Computing kpt #: 200 total cpu time spent up to now is 70.7 secs Computing kpt #: 201 total cpu time spent up to now is 71.0 secs Computing kpt #: 202 total cpu time spent up to now is 71.4 secs Computing kpt #: 203 total cpu time spent up to now is 71.8 secs Computing kpt #: 204 total cpu time spent up to now is 72.1 secs Computing kpt #: 205 total cpu time spent up to now is 72.4 secs Computing kpt #: 206 total cpu time spent up to now is 72.7 secs Computing kpt #: 207 total cpu time spent up to now is 72.9 secs Computing kpt #: 208 total cpu time spent up to now is 73.2 secs Computing kpt #: 209 total cpu time spent up to now is 73.4 secs Computing kpt #: 210 total cpu time spent up to now is 73.7 secs Computing kpt #: 211 total cpu time spent up to now is 74.0 secs Computing kpt #: 212 total cpu time spent up to now is 74.2 secs Computing kpt #: 213 total cpu time spent up to now is 74.5 secs Computing kpt #: 214 total cpu time spent up to now is 74.8 secs Computing kpt #: 215 total cpu time spent up to now is 75.0 secs Computing kpt #: 216 total cpu time spent up to now is 75.3 secs Computing kpt #: 217 total cpu time spent up to now is 75.5 secs Computing kpt #: 218 total cpu time spent up to now is 75.8 secs Computing kpt #: 219 total cpu time spent up to now is 76.0 secs Computing kpt #: 220 total cpu time spent up to now is 76.3 secs Computing kpt #: 221 total cpu time spent up to now is 76.5 secs Computing kpt #: 222 total cpu time spent up to now is 76.8 secs Computing kpt #: 223 total cpu time spent up to now is 77.0 secs Computing kpt #: 224 total cpu time spent up to now is 77.3 secs Computing kpt #: 225 total cpu time spent up to now is 77.5 secs Computing kpt #: 226 total cpu time spent up to now is 77.8 secs Computing kpt #: 227 total cpu time spent up to now is 78.1 secs Computing kpt #: 228 total cpu time spent up to now is 78.3 secs Computing kpt #: 229 total cpu time spent up to now is 78.6 secs Computing kpt #: 230 total cpu time spent up to now is 78.8 secs Computing kpt #: 231 total cpu time spent up to now is 79.1 secs Computing kpt #: 232 total cpu time spent up to now is 79.3 secs Computing kpt #: 233 total cpu time spent up to now is 79.6 secs Computing kpt #: 234 total cpu time spent up to now is 79.8 secs Computing kpt #: 235 total cpu time spent up to now is 80.1 secs Computing kpt #: 236 total cpu time spent up to now is 80.5 secs Computing kpt #: 237 total cpu time spent up to now is 80.8 secs Computing kpt #: 238 total cpu time spent up to now is 81.1 secs Computing kpt #: 239 total cpu time spent up to now is 81.5 secs Computing kpt #: 240 total cpu time spent up to now is 81.8 secs Computing kpt #: 241 total cpu time spent up to now is 82.2 secs Computing kpt #: 242 total cpu time spent up to now is 82.6 secs Computing kpt #: 243 total cpu time spent up to now is 83.0 secs Computing kpt #: 244 total cpu time spent up to now is 83.4 secs Computing kpt #: 245 total cpu time spent up to now is 83.8 secs Computing kpt #: 246 total cpu time spent up to now is 84.2 secs Computing kpt #: 247 total cpu time spent up to now is 84.6 secs Computing kpt #: 248 total cpu time spent up to now is 85.0 secs Computing kpt #: 249 total cpu time spent up to now is 85.4 secs Computing kpt #: 250 total cpu time spent up to now is 85.8 secs Computing kpt #: 251 total cpu time spent up to now is 86.2 secs Computing kpt #: 252 total cpu time spent up to now is 86.6 secs Computing kpt #: 253 total cpu time spent up to now is 86.9 secs Computing kpt #: 254 total cpu time spent up to now is 87.2 secs Computing kpt #: 255 total cpu time spent up to now is 87.5 secs Computing kpt #: 256 total cpu time spent up to now is 87.8 secs Computing kpt #: 257 total cpu time spent up to now is 88.0 secs Computing kpt #: 258 total cpu time spent up to now is 88.3 secs Computing kpt #: 259 total cpu time spent up to now is 88.5 secs Computing kpt #: 260 total cpu time spent up to now is 88.8 secs Computing kpt #: 261 total cpu time spent up to now is 89.0 secs Computing kpt #: 262 total cpu time spent up to now is 89.3 secs Computing kpt #: 263 total cpu time spent up to now is 89.5 secs Computing kpt #: 264 total cpu time spent up to now is 89.8 secs Computing kpt #: 265 total cpu time spent up to now is 90.0 secs Computing kpt #: 266 total cpu time spent up to now is 90.3 secs Computing kpt #: 267 total cpu time spent up to now is 90.5 secs Computing kpt #: 268 total cpu time spent up to now is 90.8 secs Computing kpt #: 269 total cpu time spent up to now is 91.0 secs Computing kpt #: 270 total cpu time spent up to now is 91.3 secs Computing kpt #: 271 total cpu time spent up to now is 91.5 secs Computing kpt #: 272 total cpu time spent up to now is 91.8 secs Computing kpt #: 273 total cpu time spent up to now is 92.0 secs Computing kpt #: 274 total cpu time spent up to now is 92.3 secs Computing kpt #: 275 total cpu time spent up to now is 92.5 secs Computing kpt #: 276 total cpu time spent up to now is 92.8 secs Computing kpt #: 277 total cpu time spent up to now is 93.0 secs Computing kpt #: 278 total cpu time spent up to now is 93.3 secs Computing kpt #: 279 total cpu time spent up to now is 93.5 secs Computing kpt #: 280 total cpu time spent up to now is 93.8 secs Computing kpt #: 281 total cpu time spent up to now is 94.0 secs Computing kpt #: 282 total cpu time spent up to now is 94.3 secs Computing kpt #: 283 total cpu time spent up to now is 94.6 secs Computing kpt #: 284 total cpu time spent up to now is 94.9 secs Computing kpt #: 285 total cpu time spent up to now is 95.2 secs Computing kpt #: 286 total cpu time spent up to now is 95.4 secs Computing kpt #: 287 total cpu time spent up to now is 95.7 secs Computing kpt #: 288 total cpu time spent up to now is 95.9 secs Computing kpt #: 289 total cpu time spent up to now is 96.2 secs Computing kpt #: 290 total cpu time spent up to now is 96.4 secs Computing kpt #: 291 total cpu time spent up to now is 96.7 secs Computing kpt #: 292 total cpu time spent up to now is 96.9 secs Computing kpt #: 293 total cpu time spent up to now is 97.2 secs Computing kpt #: 294 total cpu time spent up to now is 97.4 secs Computing kpt #: 295 total cpu time spent up to now is 97.7 secs Computing kpt #: 296 total cpu time spent up to now is 97.9 secs Computing kpt #: 297 total cpu time spent up to now is 98.2 secs Computing kpt #: 298 total cpu time spent up to now is 98.4 secs Computing kpt #: 299 total cpu time spent up to now is 98.7 secs Computing kpt #: 300 total cpu time spent up to now is 98.9 secs Computing kpt #: 301 total cpu time spent up to now is 99.2 secs Computing kpt #: 302 total cpu time spent up to now is 99.4 secs Computing kpt #: 303 total cpu time spent up to now is 99.9 secs Computing kpt #: 304 total cpu time spent up to now is 100.2 secs Computing kpt #: 305 total cpu time spent up to now is 100.4 secs Computing kpt #: 306 total cpu time spent up to now is 100.7 secs Computing kpt #: 307 total cpu time spent up to now is 100.9 secs Computing kpt #: 308 total cpu time spent up to now is 101.2 secs Computing kpt #: 309 total cpu time spent up to now is 101.5 secs Computing kpt #: 310 total cpu time spent up to now is 101.7 secs Computing kpt #: 311 total cpu time spent up to now is 102.0 secs Computing kpt #: 312 total cpu time spent up to now is 102.2 secs Computing kpt #: 313 total cpu time spent up to now is 102.5 secs Computing kpt #: 314 total cpu time spent up to now is 102.7 secs Computing kpt #: 315 total cpu time spent up to now is 103.0 secs Computing kpt #: 316 total cpu time spent up to now is 103.2 secs Computing kpt #: 317 total cpu time spent up to now is 103.5 secs Computing kpt #: 318 total cpu time spent up to now is 103.7 secs Computing kpt #: 319 total cpu time spent up to now is 104.0 secs Computing kpt #: 320 total cpu time spent up to now is 104.2 secs Computing kpt #: 321 total cpu time spent up to now is 104.5 secs Computing kpt #: 322 total cpu time spent up to now is 104.7 secs Computing kpt #: 323 total cpu time spent up to now is 104.9 secs Computing kpt #: 324 total cpu time spent up to now is 105.2 secs Computing kpt #: 325 total cpu time spent up to now is 105.4 secs Computing kpt #: 326 total cpu time spent up to now is 105.7 secs Computing kpt #: 327 total cpu time spent up to now is 105.9 secs Computing kpt #: 328 total cpu time spent up to now is 106.2 secs Computing kpt #: 329 total cpu time spent up to now is 106.5 secs Computing kpt #: 330 total cpu time spent up to now is 106.7 secs Computing kpt #: 331 total cpu time spent up to now is 107.0 secs Computing kpt #: 332 total cpu time spent up to now is 107.2 secs Computing kpt #: 333 total cpu time spent up to now is 107.5 secs Computing kpt #: 334 total cpu time spent up to now is 107.8 secs Computing kpt #: 335 total cpu time spent up to now is 108.0 secs Computing kpt #: 336 total cpu time spent up to now is 108.3 secs Computing kpt #: 337 total cpu time spent up to now is 108.6 secs Computing kpt #: 338 total cpu time spent up to now is 108.9 secs Computing kpt #: 339 total cpu time spent up to now is 109.1 secs Computing kpt #: 340 total cpu time spent up to now is 109.4 secs Computing kpt #: 341 total cpu time spent up to now is 109.7 secs Computing kpt #: 342 total cpu time spent up to now is 110.0 secs Computing kpt #: 343 total cpu time spent up to now is 110.2 secs Computing kpt #: 344 total cpu time spent up to now is 110.5 secs Computing kpt #: 345 total cpu time spent up to now is 110.8 secs Computing kpt #: 346 total cpu time spent up to now is 111.0 secs Computing kpt #: 347 total cpu time spent up to now is 111.3 secs Computing kpt #: 348 total cpu time spent up to now is 111.6 secs Computing kpt #: 349 total cpu time spent up to now is 111.8 secs Computing kpt #: 350 total cpu time spent up to now is 112.2 secs Computing kpt #: 351 total cpu time spent up to now is 112.7 secs Computing kpt #: 352 total cpu time spent up to now is 113.1 secs Computing kpt #: 353 total cpu time spent up to now is 113.5 secs Computing kpt #: 354 total cpu time spent up to now is 113.9 secs Computing kpt #: 355 total cpu time spent up to now is 114.3 secs Computing kpt #: 356 total cpu time spent up to now is 114.6 secs Computing kpt #: 357 total cpu time spent up to now is 115.0 secs Computing kpt #: 358 total cpu time spent up to now is 115.4 secs Computing kpt #: 359 total cpu time spent up to now is 115.8 secs Computing kpt #: 360 total cpu time spent up to now is 116.1 secs Computing kpt #: 361 total cpu time spent up to now is 116.5 secs Computing kpt #: 362 total cpu time spent up to now is 116.9 secs Computing kpt #: 363 total cpu time spent up to now is 117.2 secs Computing kpt #: 364 total cpu time spent up to now is 117.6 secs Computing kpt #: 365 total cpu time spent up to now is 118.0 secs Computing kpt #: 366 total cpu time spent up to now is 118.4 secs Computing kpt #: 367 total cpu time spent up to now is 118.8 secs Computing kpt #: 368 total cpu time spent up to now is 119.2 secs Computing kpt #: 369 total cpu time spent up to now is 119.6 secs Computing kpt #: 370 total cpu time spent up to now is 120.0 secs Computing kpt #: 371 total cpu time spent up to now is 120.4 secs Computing kpt #: 372 total cpu time spent up to now is 120.8 secs Computing kpt #: 373 total cpu time spent up to now is 121.1 secs Computing kpt #: 374 total cpu time spent up to now is 121.5 secs Computing kpt #: 375 total cpu time spent up to now is 121.9 secs Computing kpt #: 376 total cpu time spent up to now is 122.3 secs Computing kpt #: 377 total cpu time spent up to now is 122.6 secs Computing kpt #: 378 total cpu time spent up to now is 123.0 secs Computing kpt #: 379 total cpu time spent up to now is 123.3 secs Computing kpt #: 380 total cpu time spent up to now is 123.6 secs Computing kpt #: 381 total cpu time spent up to now is 124.0 secs Computing kpt #: 382 total cpu time spent up to now is 124.2 secs Computing kpt #: 383 total cpu time spent up to now is 124.5 secs Computing kpt #: 384 total cpu time spent up to now is 124.8 secs Computing kpt #: 385 total cpu time spent up to now is 125.0 secs Computing kpt #: 386 total cpu time spent up to now is 125.3 secs Computing kpt #: 387 total cpu time spent up to now is 125.6 secs Computing kpt #: 388 total cpu time spent up to now is 125.8 secs Computing kpt #: 389 total cpu time spent up to now is 126.1 secs Computing kpt #: 390 total cpu time spent up to now is 126.3 secs Computing kpt #: 391 total cpu time spent up to now is 126.6 secs Computing kpt #: 392 total cpu time spent up to now is 126.8 secs Computing kpt #: 393 total cpu time spent up to now is 127.1 secs Computing kpt #: 394 total cpu time spent up to now is 127.4 secs Computing kpt #: 395 total cpu time spent up to now is 127.7 secs Computing kpt #: 396 total cpu time spent up to now is 127.9 secs Computing kpt #: 397 total cpu time spent up to now is 128.2 secs Computing kpt #: 398 total cpu time spent up to now is 128.5 secs Computing kpt #: 399 total cpu time spent up to now is 128.7 secs Computing kpt #: 400 total cpu time spent up to now is 129.0 secs Computing kpt #: 401 total cpu time spent up to now is 129.3 secs Computing kpt #: 402 total cpu time spent up to now is 129.6 secs Computing kpt #: 403 total cpu time spent up to now is 129.8 secs Computing kpt #: 404 total cpu time spent up to now is 130.1 secs Computing kpt #: 405 total cpu time spent up to now is 130.3 secs Computing kpt #: 406 total cpu time spent up to now is 130.6 secs Computing kpt #: 407 total cpu time spent up to now is 130.9 secs Computing kpt #: 408 total cpu time spent up to now is 131.1 secs Computing kpt #: 409 total cpu time spent up to now is 131.4 secs Computing kpt #: 410 total cpu time spent up to now is 131.6 secs Computing kpt #: 411 total cpu time spent up to now is 131.9 secs Computing kpt #: 412 total cpu time spent up to now is 132.1 secs Computing kpt #: 413 total cpu time spent up to now is 132.4 secs Computing kpt #: 414 total cpu time spent up to now is 132.6 secs Computing kpt #: 415 total cpu time spent up to now is 132.9 secs Computing kpt #: 416 total cpu time spent up to now is 133.1 secs Computing kpt #: 417 total cpu time spent up to now is 133.4 secs Computing kpt #: 418 total cpu time spent up to now is 133.6 secs Computing kpt #: 419 total cpu time spent up to now is 133.9 secs Computing kpt #: 420 total cpu time spent up to now is 134.1 secs Computing kpt #: 421 total cpu time spent up to now is 134.4 secs Computing kpt #: 422 total cpu time spent up to now is 134.6 secs Computing kpt #: 423 total cpu time spent up to now is 134.9 secs Computing kpt #: 424 total cpu time spent up to now is 135.1 secs Computing kpt #: 425 total cpu time spent up to now is 135.4 secs Computing kpt #: 426 total cpu time spent up to now is 135.6 secs Computing kpt #: 427 total cpu time spent up to now is 135.9 secs Computing kpt #: 428 total cpu time spent up to now is 136.1 secs Computing kpt #: 429 total cpu time spent up to now is 136.4 secs Computing kpt #: 430 total cpu time spent up to now is 136.6 secs Computing kpt #: 431 total cpu time spent up to now is 136.9 secs Computing kpt #: 432 total cpu time spent up to now is 137.1 secs Computing kpt #: 433 total cpu time spent up to now is 137.4 secs Computing kpt #: 434 total cpu time spent up to now is 137.6 secs Computing kpt #: 435 total cpu time spent up to now is 137.9 secs Computing kpt #: 436 total cpu time spent up to now is 138.1 secs Computing kpt #: 437 total cpu time spent up to now is 138.4 secs Computing kpt #: 438 total cpu time spent up to now is 138.6 secs Computing kpt #: 439 total cpu time spent up to now is 138.9 secs Computing kpt #: 440 total cpu time spent up to now is 139.2 secs Computing kpt #: 441 total cpu time spent up to now is 139.4 secs Computing kpt #: 442 total cpu time spent up to now is 139.7 secs Computing kpt #: 443 total cpu time spent up to now is 139.9 secs Computing kpt #: 444 total cpu time spent up to now is 140.2 secs Computing kpt #: 445 total cpu time spent up to now is 140.5 secs Computing kpt #: 446 total cpu time spent up to now is 140.7 secs Computing kpt #: 447 total cpu time spent up to now is 141.0 secs Computing kpt #: 448 total cpu time spent up to now is 141.3 secs Computing kpt #: 449 total cpu time spent up to now is 141.6 secs Computing kpt #: 450 total cpu time spent up to now is 141.9 secs Computing kpt #: 451 total cpu time spent up to now is 142.3 secs Computing kpt #: 452 total cpu time spent up to now is 142.8 secs Computing kpt #: 453 total cpu time spent up to now is 143.3 secs Computing kpt #: 454 total cpu time spent up to now is 143.7 secs Computing kpt #: 455 total cpu time spent up to now is 144.1 secs Computing kpt #: 456 total cpu time spent up to now is 144.5 secs Computing kpt #: 457 total cpu time spent up to now is 144.9 secs Computing kpt #: 458 total cpu time spent up to now is 145.3 secs Computing kpt #: 459 total cpu time spent up to now is 145.6 secs Computing kpt #: 460 total cpu time spent up to now is 146.0 secs Computing kpt #: 461 total cpu time spent up to now is 146.3 secs Computing kpt #: 462 total cpu time spent up to now is 146.7 secs Computing kpt #: 463 total cpu time spent up to now is 147.0 secs Computing kpt #: 464 total cpu time spent up to now is 147.4 secs Computing kpt #: 465 total cpu time spent up to now is 147.7 secs Computing kpt #: 466 total cpu time spent up to now is 148.1 secs Computing kpt #: 467 total cpu time spent up to now is 148.4 secs Computing kpt #: 468 total cpu time spent up to now is 148.8 secs Computing kpt #: 469 total cpu time spent up to now is 149.2 secs Computing kpt #: 470 total cpu time spent up to now is 149.5 secs Computing kpt #: 471 total cpu time spent up to now is 149.8 secs Computing kpt #: 472 total cpu time spent up to now is 150.2 secs Computing kpt #: 473 total cpu time spent up to now is 150.5 secs Computing kpt #: 474 total cpu time spent up to now is 150.9 secs Computing kpt #: 475 total cpu time spent up to now is 151.4 secs Computing kpt #: 476 total cpu time spent up to now is 151.7 secs Computing kpt #: 477 total cpu time spent up to now is 152.1 secs Computing kpt #: 478 total cpu time spent up to now is 152.6 secs Computing kpt #: 479 total cpu time spent up to now is 152.9 secs Computing kpt #: 480 total cpu time spent up to now is 153.2 secs Computing kpt #: 481 total cpu time spent up to now is 153.6 secs Computing kpt #: 482 total cpu time spent up to now is 153.9 secs Computing kpt #: 483 total cpu time spent up to now is 154.3 secs Computing kpt #: 484 total cpu time spent up to now is 154.6 secs Computing kpt #: 485 total cpu time spent up to now is 155.0 secs Computing kpt #: 486 total cpu time spent up to now is 155.3 secs Computing kpt #: 487 total cpu time spent up to now is 155.7 secs Computing kpt #: 488 total cpu time spent up to now is 156.0 secs Computing kpt #: 489 total cpu time spent up to now is 156.4 secs Computing kpt #: 490 total cpu time spent up to now is 156.7 secs Computing kpt #: 491 total cpu time spent up to now is 157.0 secs Computing kpt #: 492 total cpu time spent up to now is 157.3 secs Computing kpt #: 493 total cpu time spent up to now is 157.6 secs Computing kpt #: 494 total cpu time spent up to now is 157.9 secs Computing kpt #: 495 total cpu time spent up to now is 158.2 secs Computing kpt #: 496 total cpu time spent up to now is 158.6 secs Computing kpt #: 497 total cpu time spent up to now is 158.9 secs Computing kpt #: 498 total cpu time spent up to now is 159.3 secs Computing kpt #: 499 total cpu time spent up to now is 159.6 secs Computing kpt #: 500 total cpu time spent up to now is 159.9 secs Computing kpt #: 501 total cpu time spent up to now is 160.3 secs Computing kpt #: 502 total cpu time spent up to now is 160.6 secs Computing kpt #: 503 total cpu time spent up to now is 160.9 secs Computing kpt #: 504 total cpu time spent up to now is 161.3 secs Computing kpt #: 505 total cpu time spent up to now is 161.6 secs Computing kpt #: 506 total cpu time spent up to now is 161.9 secs Computing kpt #: 507 total cpu time spent up to now is 162.2 secs Computing kpt #: 508 total cpu time spent up to now is 162.6 secs Computing kpt #: 509 total cpu time spent up to now is 162.9 secs Computing kpt #: 510 total cpu time spent up to now is 163.2 secs Computing kpt #: 511 total cpu time spent up to now is 163.6 secs Computing kpt #: 512 total cpu time spent up to now is 163.9 secs Computing kpt #: 513 total cpu time spent up to now is 164.3 secs Computing kpt #: 514 total cpu time spent up to now is 164.6 secs Computing kpt #: 515 total cpu time spent up to now is 165.0 secs Computing kpt #: 516 total cpu time spent up to now is 165.4 secs Computing kpt #: 517 total cpu time spent up to now is 165.8 secs Computing kpt #: 518 total cpu time spent up to now is 166.1 secs Computing kpt #: 519 total cpu time spent up to now is 166.5 secs Computing kpt #: 520 total cpu time spent up to now is 166.9 secs Computing kpt #: 521 total cpu time spent up to now is 167.2 secs Computing kpt #: 522 total cpu time spent up to now is 167.6 secs Computing kpt #: 523 total cpu time spent up to now is 168.0 secs Computing kpt #: 524 total cpu time spent up to now is 168.3 secs Computing kpt #: 525 total cpu time spent up to now is 168.7 secs Computing kpt #: 526 total cpu time spent up to now is 169.1 secs Computing kpt #: 527 total cpu time spent up to now is 169.4 secs Computing kpt #: 528 total cpu time spent up to now is 169.8 secs Computing kpt #: 529 total cpu time spent up to now is 170.2 secs Computing kpt #: 530 total cpu time spent up to now is 170.6 secs Computing kpt #: 531 total cpu time spent up to now is 171.0 secs Computing kpt #: 532 total cpu time spent up to now is 171.4 secs Computing kpt #: 533 total cpu time spent up to now is 171.8 secs Computing kpt #: 534 total cpu time spent up to now is 172.2 secs Computing kpt #: 535 total cpu time spent up to now is 172.6 secs Computing kpt #: 536 total cpu time spent up to now is 173.0 secs ethr = 5.00E-08, avg # of iterations = 24.3 total cpu time spent up to now is 173.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1836 -1.1836 6.2176 6.2176 6.6319 6.6319 9.7032 9.7032 10.3755 10.3755 10.6320 10.6320 12.7715 12.7715 13.6210 13.6210 13.8078 13.8078 14.3480 14.3480 k = 0.0076-0.0099 0.0104 ( 3895 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9355 -21.9355 -1.1821 -1.1821 6.2180 6.2180 6.6333 6.6333 9.6987 9.6987 10.3757 10.3757 10.6292 10.6292 12.7674 12.7674 13.6209 13.6209 13.7940 13.7940 14.3372 14.3372 k = 0.0152-0.0199 0.0208 ( 3899 PWs) bands (ev): -45.9919 -45.9919 -22.6387 -22.6387 -22.0138 -22.0138 -21.9357 -21.9357 -1.1777 -1.1777 6.2193 6.2193 6.6372 6.6372 9.6852 9.6852 10.3761 10.3761 10.6209 10.6209 12.7552 12.7552 13.6208 13.6208 13.7569 13.7569 14.3085 14.3085 k = 0.0227-0.0298 0.0312 ( 3899 PWs) bands (ev): -45.9919 -45.9919 -22.6388 -22.6388 -22.0138 -22.0138 -21.9360 -21.9360 -1.1704 -1.1704 6.2214 6.2214 6.6437 6.6437 9.6629 9.6629 10.3769 10.3769 10.6072 10.6072 12.7349 12.7349 13.6204 13.6204 13.7051 13.7051 14.2693 14.2693 k = 0.0303-0.0398 0.0416 ( 3903 PWs) bands (ev): -45.9918 -45.9918 -22.6390 -22.6390 -22.0140 -22.0140 -21.9365 -21.9365 -1.1601 -1.1601 6.2243 6.2243 6.6529 6.6529 9.6322 9.6322 10.3779 10.3779 10.5882 10.5882 12.7067 12.7067 13.6190 13.6190 13.6472 13.6472 14.2260 14.2260 k = 0.0379-0.0497 0.0520 ( 3907 PWs) bands (ev): -45.9917 -45.9917 -22.6393 -22.6393 -22.0141 -22.0141 -21.9371 -21.9371 -1.1469 -1.1469 6.2281 6.2281 6.6646 6.6646 9.5935 9.5935 10.3793 10.3793 10.5639 10.5639 12.6709 12.6709 13.5831 13.5831 13.6218 13.6218 14.1820 14.1820 k = 0.0455-0.0596 0.0624 ( 3907 PWs) bands (ev): -45.9916 -45.9916 -22.6396 -22.6396 -22.0143 -22.0143 -21.9378 -21.9378 -1.1308 -1.1308 6.2327 6.2327 6.6788 6.6788 9.5473 9.5473 10.3809 10.3809 10.5345 10.5345 12.6276 12.6276 13.5237 13.5237 13.6207 13.6207 14.1392 14.1392 k = 0.0530-0.0696 0.0728 ( 3915 PWs) bands (ev): -45.9914 -45.9914 -22.6400 -22.6400 -22.0145 -22.0145 -21.9386 -21.9386 -1.1117 -1.1117 6.2381 6.2381 6.6955 6.6955 9.4942 9.4942 10.3829 10.3829 10.5004 10.5004 12.5774 12.5774 13.4665 13.4665 13.6201 13.6201 14.0984 14.0984 k = 0.0606-0.0795 0.0833 ( 3913 PWs) bands (ev): -45.9912 -45.9912 -22.6404 -22.6404 -22.0147 -22.0147 -21.9396 -21.9396 -1.0897 -1.0897 6.2444 6.2444 6.7146 6.7146 9.4348 9.4348 10.3850 10.3850 10.4616 10.4616 12.5205 12.5205 13.4131 13.4131 13.6196 13.6196 14.0599 14.0599 k = 0.0682-0.0895 0.0937 ( 3913 PWs) bands (ev): -45.9910 -45.9910 -22.6409 -22.6409 -22.0150 -22.0150 -21.9407 -21.9407 -1.0648 -1.0648 6.2514 6.2514 6.7361 6.7361 9.3697 9.3697 10.3870 10.3870 10.4190 10.4190 12.4575 12.4575 13.3640 13.3640 13.6190 13.6190 14.0237 14.0237 k = 0.0758-0.0994 0.1041 ( 3919 PWs) bands (ev): -45.9908 -45.9908 -22.6415 -22.6415 -22.0153 -22.0153 -21.9419 -21.9419 -1.0371 -1.0371 6.2592 6.2592 6.7599 6.7599 9.2996 9.2996 10.3695 10.3695 10.3923 10.3923 12.3887 12.3887 13.3196 13.3196 13.6183 13.6183 13.9898 13.9898 k = 0.0833-0.1093 0.1145 ( 3915 PWs) bands (ev): -45.9906 -45.9906 -22.6420 -22.6420 -22.0156 -22.0156 -21.9432 -21.9432 -1.0064 -1.0064 6.2677 6.2677 6.7860 6.7860 9.2251 9.2251 10.3196 10.3196 10.3946 10.3946 12.3147 12.3147 13.2801 13.2801 13.6175 13.6176 13.9578 13.9578 k = 0.0909-0.1193 0.1249 ( 3919 PWs) bands (ev): -45.9904 -45.9904 -22.6427 -22.6427 -22.0160 -22.0160 -21.9447 -21.9447 -0.9728 -0.9728 6.2770 6.2770 6.8141 6.8141 9.1468 9.1468 10.2658 10.2658 10.3979 10.3979 12.2359 12.2359 13.2453 13.2453 13.6167 13.6167 13.9277 13.9277 k = 0.0985-0.1292 0.1353 ( 3919 PWs) bands (ev): -45.9901 -45.9901 -22.6434 -22.6434 -22.0164 -22.0164 -21.9462 -21.9462 -0.9364 -0.9364 6.2870 6.2870 6.8443 6.8443 9.0652 9.0652 10.2089 10.2089 10.4017 10.4017 12.1531 12.1531 13.2152 13.2152 13.6157 13.6157 13.8992 13.8992 k = 0.1061-0.1391 0.1457 ( 3927 PWs) bands (ev): -45.9898 -45.9898 -22.6441 -22.6441 -22.0168 -22.0168 -21.9478 -21.9478 -0.8971 -0.8971 6.2977 6.2977 6.8764 6.8764 8.9809 8.9809 10.1497 10.1497 10.4059 10.4059 12.0665 12.0665 13.1895 13.1895 13.6145 13.6145 13.8721 13.8721 k = 0.1136-0.1491 0.1561 ( 3931 PWs) bands (ev): -45.9895 -45.9895 -22.6449 -22.6449 -22.0172 -22.0172 -21.9496 -21.9496 -0.8549 -0.8549 6.3090 6.3090 6.9103 6.9103 8.8945 8.8945 10.0884 10.0884 10.4103 10.4103 11.9769 11.9769 13.1680 13.1680 13.6132 13.6132 13.8462 13.8462 k = 0.1212-0.1590 0.1665 ( 3931 PWs) bands (ev): -45.9892 -45.9892 -22.6458 -22.6458 -22.0176 -22.0176 -21.9514 -21.9514 -0.8099 -0.8099 6.3209 6.3209 6.9458 6.9458 8.8062 8.8062 10.0256 10.0256 10.4151 10.4151 11.8847 11.8847 13.1505 13.1505 13.6117 13.6117 13.8213 13.8213 k = 0.1288-0.1690 0.1769 ( 3931 PWs) bands (ev): -45.9888 -45.9888 -22.6467 -22.6467 -22.0181 -22.0181 -21.9533 -21.9533 -0.7620 -0.7620 6.3335 6.3335 6.9827 6.9827 8.7167 8.7167 9.9617 9.9617 10.4202 10.4202 11.7904 11.7904 13.1366 13.1366 13.6101 13.6101 13.7974 13.7974 k = 0.1364-0.1789 0.1873 ( 3929 PWs) bands (ev): -45.9885 -45.9885 -22.6476 -22.6476 -22.0186 -22.0186 -21.9553 -21.9553 -0.7113 -0.7113 6.3465 6.3465 7.0209 7.0209 8.6261 8.6261 9.8970 9.8970 10.4256 10.4256 11.6946 11.6946 13.1260 13.1260 13.6082 13.6082 13.7742 13.7742 k = 0.1439-0.1888 0.1977 ( 3923 PWs) bands (ev): -45.9881 -45.9881 -22.6486 -22.6486 -22.0191 -22.0191 -21.9574 -21.9574 -0.6579 -0.6579 6.3600 6.3600 7.0602 7.0602 8.5349 8.5349 9.8320 9.8320 10.4313 10.4313 11.5976 11.5976 13.1183 13.1183 13.6061 13.6061 13.7516 13.7516 k = 0.1515-0.1988 0.2081 ( 3919 PWs) bands (ev): -45.9877 -45.9877 -22.6496 -22.6496 -22.0196 -22.0196 -21.9596 -21.9596 -0.6016 -0.6016 6.3739 6.3739 7.1003 7.1003 8.4434 8.4434 9.7670 9.7670 10.4373 10.4373 11.5000 11.5000 13.1134 13.1134 13.6038 13.6038 13.7297 13.7297 k = 0.1591-0.2087 0.2185 ( 3915 PWs) bands (ev): -45.9873 -45.9873 -22.6507 -22.6507 -22.0202 -22.0202 -21.9618 -21.9618 -0.5425 -0.5425 6.3882 6.3882 7.1410 7.1410 8.3519 8.3519 9.7025 9.7025 10.4436 10.4436 11.4021 11.4021 13.1108 13.1108 13.6012 13.6012 13.7082 13.7082 k = 0.1667-0.2187 0.2290 ( 3915 PWs) bands (ev): -45.9869 -45.9869 -22.6518 -22.6518 -22.0207 -22.0207 -21.9641 -21.9641 -0.4807 -0.4807 6.4027 6.4027 7.1820 7.1820 8.2605 8.2605 9.6387 9.6387 10.4502 10.4502 11.3044 11.3044 13.1102 13.1102 13.5982 13.5982 13.6873 13.6873 k = 0.1742-0.2286 0.2394 ( 3919 PWs) bands (ev): -45.9865 -45.9865 -22.6529 -22.6529 -22.0213 -22.0213 -21.9664 -21.9664 -0.4162 -0.4162 6.4175 6.4175 7.2230 7.2230 8.1696 8.1696 9.5760 9.5760 10.4571 10.4571 11.2073 11.2073 13.1114 13.1114 13.5948 13.5948 13.6668 13.6668 k = 0.1818-0.2385 0.2498 ( 3927 PWs) bands (ev): -45.9860 -45.9860 -22.6540 -22.6540 -22.0219 -22.0219 -21.9688 -21.9688 -0.3490 -0.3490 6.4323 6.4323 7.2636 7.2636 8.0794 8.0794 9.5147 9.5147 10.4642 10.4642 11.1111 11.1111 13.1139 13.1139 13.5909 13.5909 13.6470 13.6470 k = 0.1894-0.2485 0.2602 ( 3917 PWs) bands (ev): -45.9856 -45.9856 -22.6552 -22.6552 -22.0224 -22.0224 -21.9713 -21.9713 -0.2790 -0.2790 6.4472 6.4472 7.3036 7.3036 7.9899 7.9899 9.4551 9.4551 10.4717 10.4717 11.0161 11.0161 13.1176 13.1176 13.5860 13.5860 13.6280 13.6280 k = 0.1970-0.2584 0.2706 ( 3921 PWs) bands (ev): -45.9851 -45.9851 -22.6565 -22.6565 -22.0230 -22.0230 -21.9737 -21.9737 -0.2064 -0.2064 6.4620 6.4620 7.3426 7.3426 7.9014 7.9014 9.3975 9.3975 10.4793 10.4793 10.9226 10.9226 13.1220 13.1220 13.5793 13.5793 13.6107 13.6107 k = 0.2045-0.2684 0.2810 ( 3917 PWs) bands (ev): -45.9847 -45.9847 -22.6577 -22.6577 -22.0236 -22.0236 -21.9762 -21.9762 -0.1311 -0.1311 6.4766 6.4766 7.3800 7.3800 7.8141 7.8141 9.3422 9.3422 10.4873 10.4873 10.8308 10.8308 13.1269 13.1269 13.5693 13.5693 13.5967 13.5967 k = 0.2121-0.2783 0.2914 ( 3919 PWs) bands (ev): -45.9842 -45.9842 -22.6590 -22.6590 -22.0243 -22.0243 -21.9787 -21.9787 -0.0532 -0.0532 6.4908 6.4908 7.4155 7.4155 7.7280 7.7280 9.2895 9.2895 10.4954 10.4954 10.7410 10.7410 13.1319 13.1319 13.5549 13.5549 13.5867 13.5867 k = 0.2197-0.2882 0.3018 ( 3919 PWs) bands (ev): -45.9837 -45.9837 -22.6603 -22.6603 -22.0249 -22.0249 -21.9813 -21.9813 0.0273 0.0273 6.5047 6.5047 7.4486 7.4486 7.6434 7.6434 9.2395 9.2395 10.5037 10.5037 10.6533 10.6533 13.1368 13.1368 13.5379 13.5379 13.5792 13.5792 k = 0.2273-0.2982 0.3122 ( 3911 PWs) bands (ev): -45.9833 -45.9833 -22.6616 -22.6616 -22.0255 -22.0255 -21.9838 -21.9838 0.1104 0.1104 6.5180 6.5180 7.4787 7.4787 7.5604 7.5604 9.1926 9.1926 10.5118 10.5118 10.5680 10.5680 13.1411 13.1411 13.5198 13.5198 13.5723 13.5723 k = 0.2348-0.3081 0.3226 ( 3925 PWs) bands (ev): -45.9828 -45.9828 -22.6629 -22.6629 -22.0262 -22.0262 -21.9863 -21.9863 0.1961 0.1961 6.5306 6.5306 7.4772 7.4772 7.5072 7.5072 9.1490 9.1490 10.4822 10.4822 10.5226 10.5226 13.1447 13.1447 13.5013 13.5013 13.5653 13.5653 k = 0.2424-0.3180 0.3330 ( 3931 PWs) bands (ev): -45.9823 -45.9823 -22.6642 -22.6642 -22.0268 -22.0268 -21.9888 -21.9888 0.2842 0.2842 6.5424 6.5424 7.3982 7.3982 7.5296 7.5296 9.1089 9.1089 10.4013 10.4013 10.5308 10.5308 13.1470 13.1471 13.4828 13.4828 13.5575 13.5575 k = 0.2500-0.3280 0.3434 ( 3923 PWs) bands (ev): -45.9818 -45.9818 -22.6655 -22.6655 -22.0275 -22.0275 -21.9913 -21.9913 0.3749 0.3749 6.5533 6.5533 7.3201 7.3201 7.5485 7.5485 9.0725 9.0725 10.3213 10.3213 10.5398 10.5398 13.1479 13.1479 13.4643 13.4643 13.5485 13.5485 k = 0.2576-0.3379 0.3538 ( 3919 PWs) bands (ev): -45.9813 -45.9813 -22.6669 -22.6669 -22.0282 -22.0282 -21.9938 -21.9938 0.4680 0.4680 6.5632 6.5632 7.2437 7.2437 7.5629 7.5629 9.0400 9.0400 10.2426 10.2426 10.5490 10.5490 13.1470 13.1470 13.4459 13.4459 13.5375 13.5375 k = 0.2652-0.3479 0.3642 ( 3923 PWs) bands (ev): -45.9809 -45.9809 -22.6682 -22.6682 -22.0289 -22.0289 -21.9962 -21.9962 0.5635 0.5635 6.5718 6.5718 7.1693 7.1693 7.5723 7.5723 9.0116 9.0116 10.1648 10.1648 10.5584 10.5584 13.1439 13.1439 13.4277 13.4277 13.5234 13.5234 k = 0.2727-0.3578 0.3747 ( 3925 PWs) bands (ev): -45.9804 -45.9804 -22.6695 -22.6695 -22.0296 -22.0296 -21.9986 -21.9986 0.6613 0.6613 6.5792 6.5792 7.0968 7.0968 7.5765 7.5765 8.9873 8.9873 10.0872 10.0872 10.5678 10.5678 13.1384 13.1384 13.4097 13.4097 13.5044 13.5044 k = 0.2803-0.3677 0.3851 ( 3925 PWs) bands (ev): -45.9799 -45.9799 -22.6709 -22.6709 -22.0303 -22.0303 -22.0010 -22.0010 0.7615 0.7615 6.5853 6.5853 7.0263 7.0263 7.5752 7.5752 8.9674 8.9674 10.0092 10.0092 10.5774 10.5774 13.1301 13.1301 13.3919 13.3919 13.4784 13.4784 k = 0.2879-0.3777 0.3955 ( 3921 PWs) bands (ev): -45.9794 -45.9794 -22.6722 -22.6722 -22.0311 -22.0311 -22.0032 -22.0032 0.8640 0.8640 6.5899 6.5899 6.9578 6.9578 7.5682 7.5682 8.9518 8.9518 9.9301 9.9301 10.5870 10.5870 13.1187 13.1187 13.3743 13.3743 13.4431 13.4431 k = 0.2955-0.3876 0.4059 ( 3921 PWs) bands (ev): -45.9790 -45.9790 -22.6735 -22.6735 -22.0318 -22.0318 -22.0054 -22.0054 0.9687 0.9687 6.5931 6.5931 6.8915 6.8915 7.5556 7.5556 8.9407 8.9407 9.8493 9.8493 10.5966 10.5966 13.1040 13.1040 13.3566 13.3566 13.3987 13.3987 k = 0.3030-0.3976 0.4163 ( 3921 PWs) bands (ev): -45.9785 -45.9785 -22.6748 -22.6748 -22.0327 -22.0327 -22.0075 -22.0075 1.0755 1.0755 6.5948 6.5948 6.8273 6.8273 7.5373 7.5373 8.9340 8.9340 9.7659 9.7659 10.6062 10.6062 13.0857 13.0857 13.3364 13.3364 13.3516 13.3516 k = 0.3106-0.4075 0.4267 ( 3925 PWs) bands (ev): -45.9781 -45.9781 -22.6761 -22.6761 -22.0335 -22.0335 -22.0095 -22.0095 1.1844 1.1844 6.5951 6.5951 6.7653 6.7653 7.5134 7.5134 8.9317 8.9317 9.6796 9.6796 10.6158 10.6158 13.0636 13.0636 13.2946 13.2946 13.3262 13.3262 k = 0.3182-0.4174 0.4371 ( 3923 PWs) bands (ev): -45.9776 -45.9776 -22.6774 -22.6774 -22.0344 -22.0344 -22.0115 -22.0115 1.2954 1.2954 6.5939 6.5939 6.7055 6.7055 7.4838 7.4838 8.9337 8.9337 9.5900 9.5900 10.6253 10.6253 13.0378 13.0378 13.2496 13.2496 13.3094 13.3094 k = 0.3258-0.4274 0.4475 ( 3923 PWs) bands (ev): -45.9772 -45.9772 -22.6786 -22.6786 -22.0353 -22.0353 -22.0132 -22.0132 1.4083 1.4083 6.5914 6.5914 6.6480 6.6480 7.4489 7.4489 8.9400 8.9400 9.4969 9.4969 10.6348 10.6348 13.0080 13.0080 13.2118 13.2118 13.2936 13.2936 k = 0.3333-0.4373 0.4579 ( 3919 PWs) bands (ev): -45.9768 -45.9768 -22.6798 -22.6798 -22.0363 -22.0363 -22.0149 -22.0149 1.5231 1.5231 6.5874 6.5874 6.5930 6.5930 7.4086 7.4086 8.9504 8.9504 9.4006 9.4006 10.6441 10.6441 12.9744 12.9744 13.1830 13.1830 13.2783 13.2783 k = 0.3409-0.4473 0.4683 ( 3917 PWs) bands (ev): -45.9764 -45.9764 -22.6810 -22.6810 -22.0373 -22.0373 -22.0165 -22.0165 1.6396 1.6396 6.5397 6.5397 6.5828 6.5828 7.3631 7.3631 8.9646 8.9646 9.3016 9.3016 10.6532 10.6532 12.9370 12.9370 13.1633 13.1633 13.2636 13.2636 k = 0.3485-0.4572 0.4787 ( 3913 PWs) bands (ev): -45.9760 -45.9760 -22.6821 -22.6821 -22.0384 -22.0384 -22.0179 -22.0179 1.7577 1.7577 6.4891 6.4891 6.5768 6.5768 7.3124 7.3124 8.9825 8.9825 9.2003 9.2003 10.6622 10.6622 12.8960 12.8960 13.1522 13.1522 13.2494 13.2494 k = 0.3561-0.4671 0.4891 ( 3909 PWs) bands (ev): -45.9756 -45.9756 -22.6832 -22.6832 -22.0395 -22.0395 -22.0192 -22.0192 1.8774 1.8774 6.4408 6.4408 6.5699 6.5699 7.2566 7.2566 9.0038 9.0038 9.0978 9.0978 10.6710 10.6710 12.8516 12.8516 13.1484 13.1484 13.2358 13.2358 k = 0.3636-0.4771 0.4995 ( 3909 PWs) bands (ev): -45.9752 -45.9752 -22.6843 -22.6843 -22.0406 -22.0406 -22.0203 -22.0203 1.9984 1.9984 6.3949 6.3949 6.5622 6.5622 7.1956 7.1956 8.9948 8.9948 9.0286 9.0286 10.6796 10.6796 12.8041 12.8041 13.1505 13.1505 13.2228 13.2228 k = 0.3712-0.4870 0.5099 ( 3913 PWs) bands (ev): -45.9749 -45.9749 -22.6853 -22.6853 -22.0417 -22.0417 -22.0214 -22.0214 2.1206 2.1206 6.3514 6.3514 6.5540 6.5540 7.1295 7.1295 8.8930 8.8930 9.0557 9.0557 10.6879 10.6879 12.7538 12.7538 13.1567 13.1567 13.2104 13.2104 k = 0.3788-0.4969 0.5204 ( 3913 PWs) bands (ev): -45.9745 -45.9745 -22.6863 -22.6863 -22.0429 -22.0429 -22.0223 -22.0223 2.2437 2.2437 6.3103 6.3103 6.5453 6.5453 7.0582 7.0582 8.7930 8.7930 9.0855 9.0855 10.6959 10.6959 12.7011 12.7011 13.1653 13.1653 13.1989 13.1989 k = 0.3864-0.5069 0.5308 ( 3917 PWs) bands (ev): -45.9742 -45.9742 -22.6873 -22.6873 -22.0440 -22.0440 -22.0232 -22.0232 2.3676 2.3676 6.2716 6.2716 6.5363 6.5363 6.9818 6.9818 8.6962 8.6962 9.1173 9.1173 10.7035 10.7035 12.6465 12.6465 13.1738 13.1738 13.1893 13.1893 k = 0.3939-0.5168 0.5412 ( 3917 PWs) bands (ev): -45.9739 -45.9739 -22.6882 -22.6882 -22.0452 -22.0452 -22.0239 -22.0239 2.4919 2.4919 6.2354 6.2354 6.5271 6.5271 6.9003 6.9003 8.6035 8.6035 9.1509 9.1509 10.7109 10.7109 12.5906 12.5906 13.1731 13.1731 13.1897 13.1897 k = 0.4015-0.5268 0.5516 ( 3917 PWs) bands (ev): -45.9736 -45.9736 -22.6890 -22.6890 -22.0463 -22.0463 -22.0246 -22.0246 2.6163 2.6163 6.2016 6.2016 6.5180 6.5180 6.8140 6.8140 8.5159 8.5159 9.1857 9.1857 10.7178 10.7178 12.5339 12.5339 13.1646 13.1646 13.1980 13.1980 k = 0.4091-0.5367 0.5620 ( 3921 PWs) bands (ev): -45.9733 -45.9733 -22.6898 -22.6898 -22.0473 -22.0473 -22.0252 -22.0252 2.7403 2.7403 6.1702 6.1702 6.5090 6.5090 6.7234 6.7234 8.4341 8.4341 9.2214 9.2214 10.7243 10.7243 12.4771 12.4771 13.1556 13.1556 13.2063 13.2063 k = 0.4167-0.5466 0.5724 ( 3921 PWs) bands (ev): -45.9731 -45.9731 -22.6905 -22.6905 -22.0483 -22.0483 -22.0257 -22.0257 2.8634 2.8634 6.1414 6.1414 6.5002 6.5002 6.6289 6.6289 8.3587 8.3587 9.2574 9.2574 10.7304 10.7304 12.4209 12.4209 13.1471 13.1471 13.2137 13.2137 k = 0.4242-0.5566 0.5828 ( 3925 PWs) bands (ev): -45.9729 -45.9729 -22.6912 -22.6912 -22.0492 -22.0492 -22.0261 -22.0261 2.9849 2.9849 6.1150 6.1150 6.4918 6.4918 6.5317 6.5317 8.2900 8.2900 9.2931 9.2931 10.7361 10.7361 12.3660 12.3660 13.1392 13.1392 13.2200 13.2200 k = 0.4318-0.5665 0.5932 ( 3928 PWs) bands (ev): -45.9726 -45.9726 -22.6918 -22.6918 -22.0501 -22.0501 -22.0265 -22.0265 3.1041 3.1041 6.0911 6.0911 6.4326 6.4326 6.4839 6.4839 8.2283 8.2283 9.3282 9.3282 10.7413 10.7413 12.3130 12.3130 13.1320 13.1320 13.2252 13.2252 k = 0.4394-0.5765 0.6036 ( 3940 PWs) bands (ev): -45.9725 -45.9725 -22.6924 -22.6924 -22.0509 -22.0509 -22.0269 -22.0269 3.2198 3.2198 6.0697 6.0697 6.3333 6.3333 6.4766 6.4766 8.1736 8.1736 9.3618 9.3618 10.7460 10.7460 12.2628 12.2628 13.1255 13.1255 13.2293 13.2293 k = 0.4470-0.5864 0.6140 ( 3940 PWs) bands (ev): -45.9723 -45.9723 -22.6929 -22.6929 -22.0516 -22.0516 -22.0272 -22.0272 3.3308 3.3308 6.0508 6.0508 6.2354 6.2354 6.4699 6.4699 8.1258 8.1258 9.3936 9.3936 10.7502 10.7502 12.2161 12.2161 13.1197 13.1197 13.2327 13.2327 k = 0.4545-0.5963 0.6244 ( 3926 PWs) bands (ev): -45.9721 -45.9721 -22.6933 -22.6933 -22.0523 -22.0523 -22.0274 -22.0274 3.4354 3.4354 6.0344 6.0344 6.1410 6.1410 6.4640 6.4640 8.0849 8.0849 9.4227 9.4227 10.7538 10.7538 12.1737 12.1737 13.1147 13.1147 13.2353 13.2353 k = 0.4621-0.6063 0.6348 ( 3930 PWs) bands (ev): -45.9720 -45.9720 -22.6937 -22.6937 -22.0528 -22.0528 -22.0276 -22.0276 3.5315 3.5315 6.0205 6.0205 6.0528 6.0528 6.4589 6.4589 8.0507 8.0507 9.4487 9.4487 10.7569 10.7569 12.1362 12.1362 13.1104 13.1104 13.2373 13.2373 k = 0.4697-0.6162 0.6452 ( 3934 PWs) bands (ev): -45.9719 -45.9719 -22.6940 -22.6940 -22.0533 -22.0533 -22.0278 -22.0278 3.6165 3.6165 5.9735 5.9735 6.0092 6.0092 6.4546 6.4546 8.0230 8.0230 9.4709 9.4709 10.7595 10.7595 12.1045 12.1045 13.1069 13.1069 13.2388 13.2388 k = 0.4773-0.6262 0.6556 ( 3942 PWs) bands (ev): -45.9718 -45.9718 -22.6942 -22.6942 -22.0536 -22.0536 -22.0279 -22.0279 3.6876 3.6876 5.9066 5.9066 6.0004 6.0004 6.4513 6.4513 8.0016 8.0016 9.4889 9.4889 10.7615 10.7615 12.0791 12.0791 13.1041 13.1041 13.2398 13.2398 k = 0.4848-0.6361 0.6661 ( 3938 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0539 -22.0539 -22.0280 -22.0280 3.7415 3.7415 5.8555 5.8555 5.9941 5.9941 6.4488 6.4488 7.9864 7.9864 9.5020 9.5020 10.7629 10.7629 12.0605 12.0605 13.1022 13.1022 13.2406 13.2406 k = 0.4924-0.6460 0.6765 ( 3934 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0540 -22.0540 -22.0280 -22.0280 3.7754 3.7754 5.8232 5.8232 5.9903 5.9903 6.4474 6.4474 7.9774 7.9774 9.5101 9.5101 10.7638 10.7638 12.0492 12.0492 13.1010 13.1010 13.2410 13.2410 k = 0.5000-0.6560 0.6869 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7869 3.7869 5.8122 5.8122 5.9890 5.9890 6.4469 6.4469 7.9744 7.9744 9.5128 9.5128 10.7641 10.7641 12.0454 12.0454 13.1006 13.1006 13.2411 13.2411 k = 0.5000-0.6560 0.6869 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7869 3.7869 5.8122 5.8122 5.9890 5.9890 6.4469 6.4469 7.9744 7.9744 9.5128 9.5128 10.7641 10.7641 12.0454 12.0454 13.1006 13.1006 13.2411 13.2411 k = 0.5000-0.6446 0.6977 ( 3938 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0540 -22.0540 -22.0281 -22.0281 3.7880 3.7880 5.8133 5.8133 5.9304 5.9304 6.5075 6.5075 7.9726 7.9726 9.5137 9.5137 10.7621 10.7621 12.0389 12.0389 13.1093 13.1093 13.2409 13.2409 k = 0.5000-0.6333 0.7086 ( 3938 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0539 -22.0539 -22.0280 -22.0280 3.7911 3.7911 5.8026 5.8026 5.8167 5.8167 6.6412 6.6412 7.9671 7.9671 9.5165 9.5165 10.7564 10.7564 12.0200 12.0200 13.1347 13.1347 13.2402 13.2402 k = 0.5000-0.6219 0.7194 ( 3938 PWs) bands (ev): -45.9718 -45.9718 -22.6943 -22.6943 -22.0538 -22.0538 -22.0279 -22.0279 3.7963 3.7963 5.6524 5.6524 5.8223 5.8223 6.8013 6.8013 7.9580 7.9580 9.5212 9.5212 10.7471 10.7471 11.9903 11.9903 13.1749 13.1749 13.2392 13.2392 k = 0.5000-0.6106 0.7302 ( 3938 PWs) bands (ev): -45.9719 -45.9719 -22.6941 -22.6941 -22.0535 -22.0535 -22.0278 -22.0278 3.8035 3.8035 5.4951 5.4951 5.8301 5.8301 6.9725 6.9725 7.9452 7.9452 9.5278 9.5278 10.7347 10.7347 11.9520 11.9520 13.2234 13.2234 13.2421 13.2421 k = 0.5000-0.5992 0.7411 ( 3938 PWs) bands (ev): -45.9720 -45.9720 -22.6939 -22.6939 -22.0532 -22.0532 -22.0277 -22.0277 3.8128 3.8128 5.3357 5.3357 5.8401 5.8401 7.1497 7.1497 7.9286 7.9286 9.5362 9.5362 10.7199 10.7199 11.9074 11.9074 13.2311 13.2311 13.2957 13.2957 k = 0.5000-0.5879 0.7519 ( 3932 PWs) bands (ev): -45.9721 -45.9721 -22.6936 -22.6936 -22.0528 -22.0528 -22.0275 -22.0275 3.8241 3.8241 5.1762 5.1762 5.8524 5.8524 7.3310 7.3310 7.9081 7.9081 9.5464 9.5464 10.7034 10.7034 11.8582 11.8582 13.2274 13.2274 13.3684 13.3684 k = 0.5000-0.5765 0.7628 ( 3932 PWs) bands (ev): -45.9722 -45.9722 -22.6933 -22.6933 -22.0524 -22.0524 -22.0273 -22.0273 3.8373 3.8373 5.0175 5.0175 5.8669 5.8669 7.5153 7.5153 7.8838 7.8838 9.5585 9.5585 10.6858 10.6858 11.8060 11.8060 13.2220 13.2220 13.4368 13.4368 k = 0.5000-0.5652 0.7736 ( 3928 PWs) bands (ev): -45.9723 -45.9723 -22.6929 -22.6929 -22.0519 -22.0519 -22.0270 -22.0270 3.8524 3.8524 4.8601 4.8601 5.8836 5.8836 7.7020 7.7020 7.8555 7.8555 9.5725 9.5725 10.6680 10.6680 11.7522 11.7522 13.2151 13.2151 13.3916 13.3916 k = 0.5000-0.5538 0.7844 ( 3928 PWs) bands (ev): -45.9725 -45.9725 -22.6925 -22.6925 -22.0513 -22.0513 -22.0268 -22.0268 3.8693 3.8693 4.7044 4.7044 5.9025 5.9025 7.8226 7.8226 7.8916 7.8916 9.5882 9.5882 10.6509 10.6509 11.6975 11.6975 13.2065 13.2065 13.3414 13.3414 k = 0.5000-0.5424 0.7953 ( 3930 PWs) bands (ev): -45.9726 -45.9726 -22.6921 -22.6921 -22.0507 -22.0507 -22.0264 -22.0264 3.8879 3.8879 4.5504 4.5504 5.9237 5.9237 7.7866 7.7866 8.0823 8.0823 9.6058 9.6058 10.6351 10.6351 11.6427 11.6427 13.1963 13.1963 13.2894 13.2894 k = 0.5000-0.5311 0.8061 ( 3930 PWs) bands (ev): -45.9728 -45.9728 -22.6916 -22.6916 -22.0501 -22.0501 -22.0261 -22.0261 3.9082 3.9082 4.3984 4.3984 5.9470 5.9470 7.7464 7.7464 8.2750 8.2750 9.6252 9.6252 10.6213 10.6213 11.5883 11.5883 13.1842 13.1842 13.2365 13.2365 k = 0.5000-0.5197 0.8170 ( 3930 PWs) bands (ev): -45.9730 -45.9730 -22.6910 -22.6910 -22.0493 -22.0493 -22.0256 -22.0256 3.9301 3.9301 4.2484 4.2484 5.9726 5.9726 7.7025 7.7025 8.4693 8.4693 9.6463 9.6463 10.6102 10.6102 11.5349 11.5349 13.1690 13.1690 13.1843 13.1843 k = 0.5000-0.5084 0.8278 ( 3936 PWs) bands (ev): -45.9732 -45.9732 -22.6904 -22.6904 -22.0486 -22.0486 -22.0251 -22.0251 3.9533 3.9533 4.1005 4.1005 6.0004 6.0004 7.6549 7.6549 8.6650 8.6650 9.6692 9.6692 10.6022 10.6022 11.4827 11.4827 13.1273 13.1273 13.1566 13.1566 k = 0.5000-0.4970 0.8387 ( 3940 PWs) bands (ev): -45.9734 -45.9734 -22.6898 -22.6898 -22.0478 -22.0478 -22.0246 -22.0246 3.9546 3.9546 3.9778 3.9778 6.0303 6.0303 7.6041 7.6041 8.8619 8.8619 9.6939 9.6939 10.5978 10.5978 11.4322 11.4322 13.0738 13.0738 13.1389 13.1389 k = 0.5000-0.4970 0.8387 ( 3940 PWs) bands (ev): -45.9734 -45.9734 -22.6898 -22.6898 -22.0478 -22.0478 -22.0246 -22.0246 3.9546 3.9546 3.9778 3.9778 6.0303 6.0303 7.6041 7.6041 8.8619 8.8619 9.6939 9.6939 10.5978 10.5978 11.4322 11.4322 13.0738 13.0738 13.1389 13.1389 k = 0.4944-0.4818 0.8387 ( 3942 PWs) bands (ev): -45.9736 -45.9736 -22.6893 -22.6893 -22.0473 -22.0473 -22.0242 -22.0242 3.8540 3.8540 3.9901 3.9901 6.0569 6.0569 7.5695 7.5695 9.0007 9.0007 9.7107 9.7107 10.5965 10.5965 11.4005 11.4005 13.0320 13.0320 13.1301 13.1301 k = 0.4889-0.4665 0.8387 ( 3944 PWs) bands (ev): -45.9738 -45.9738 -22.6888 -22.6888 -22.0467 -22.0467 -22.0236 -22.0236 3.7558 3.7558 3.9921 3.9921 6.0919 6.0919 7.5400 7.5400 9.1385 9.1385 9.7257 9.7257 10.5961 10.5961 11.3759 11.3759 12.9864 12.9864 13.1253 13.1253 k = 0.4833-0.4512 0.8387 ( 3938 PWs) bands (ev): -45.9740 -45.9740 -22.6882 -22.6882 -22.0462 -22.0462 -22.0229 -22.0229 3.6599 3.6599 3.9846 3.9846 6.1331 6.1331 7.5172 7.5172 9.2734 9.2734 9.7402 9.7402 10.5967 10.5967 11.3589 11.3589 12.9398 12.9398 13.1218 13.1218 k = 0.4778-0.4360 0.8387 ( 3933 PWs) bands (ev): -45.9742 -45.9742 -22.6876 -22.6876 -22.0458 -22.0458 -22.0220 -22.0220 3.5664 3.5664 3.9689 3.9689 6.1777 6.1777 7.5028 7.5028 9.4009 9.4009 9.7579 9.7579 10.5980 10.5980 11.3500 11.3500 12.8935 12.8935 13.1189 13.1189 k = 0.4722-0.4207 0.8387 ( 3931 PWs) bands (ev): -45.9745 -45.9745 -22.6870 -22.6870 -22.0454 -22.0454 -22.0210 -22.0210 3.4754 3.4754 3.9460 3.9460 6.2226 6.2226 7.4988 7.4988 9.5107 9.5107 9.7889 9.7889 10.6000 10.6000 11.3499 11.3499 12.8480 12.8480 13.1160 13.1160 k = 0.4667-0.4054 0.8387 ( 3927 PWs) bands (ev): -45.9747 -45.9747 -22.6864 -22.6864 -22.0451 -22.0451 -22.0197 -22.0197 3.3868 3.3868 3.9172 3.9172 6.2643 6.2643 7.5074 7.5074 9.5840 9.5840 9.8512 9.8512 10.6025 10.6025 11.3589 11.3589 12.8040 12.8040 13.1132 13.1132 k = 0.4611-0.3901 0.8387 ( 3929 PWs) bands (ev): -45.9750 -45.9750 -22.6857 -22.6857 -22.0449 -22.0449 -22.0184 -22.0184 3.3007 3.3007 3.8836 3.8836 6.2999 6.2999 7.5307 7.5307 9.6149 9.6149 9.9505 9.9505 10.6055 10.6055 11.3776 11.3776 12.7617 12.7617 13.1102 13.1102 k = 0.4556-0.3749 0.8387 ( 3929 PWs) bands (ev): -45.9752 -45.9752 -22.6850 -22.6850 -22.0448 -22.0448 -22.0168 -22.0168 3.2171 3.2171 3.8463 3.8463 6.3269 6.3269 7.5700 7.5700 9.6195 9.6195 10.0701 10.0701 10.6087 10.6087 11.4062 11.4062 12.7217 12.7217 13.1069 13.1069 k = 0.4500-0.3596 0.8387 ( 3923 PWs) bands (ev): -45.9755 -45.9755 -22.6842 -22.6842 -22.0447 -22.0447 -22.0151 -22.0151 3.1360 3.1360 3.8062 3.8062 6.3439 6.3439 7.6259 7.6259 9.6107 9.6107 10.1967 10.1967 10.6120 10.6120 11.4452 11.4452 12.6844 12.6844 13.1034 13.1034 k = 0.4445-0.3443 0.8387 ( 3925 PWs) bands (ev): -45.9758 -45.9758 -22.6835 -22.6835 -22.0448 -22.0448 -22.0133 -22.0133 3.0574 3.0574 3.7639 3.7639 6.3508 6.3508 7.6978 7.6978 9.5942 9.5942 10.3239 10.3239 10.6153 10.6153 11.4950 11.4950 12.6502 12.6502 13.0995 13.0995 k = 0.4389-0.3291 0.8387 ( 3919 PWs) bands (ev): -45.9761 -45.9761 -22.6828 -22.6828 -22.0449 -22.0449 -22.0113 -22.0113 2.9813 2.9813 3.7203 3.7203 6.3482 6.3482 7.7843 7.7843 9.5727 9.5727 10.4485 10.4485 10.6184 10.6184 11.5560 11.5560 12.6195 12.6195 13.0952 13.0952 k = 0.4334-0.3138 0.8387 ( 3927 PWs) bands (ev): -45.9764 -45.9764 -22.6820 -22.6820 -22.0451 -22.0451 -22.0092 -22.0092 2.9078 2.9078 3.6757 3.6757 6.3375 6.3375 7.8833 7.8833 9.5475 9.5475 10.5683 10.5683 10.6215 10.6215 11.6287 11.6287 12.5928 12.5928 13.0905 13.0905 k = 0.4278-0.2985 0.8387 ( 3931 PWs) bands (ev): -45.9767 -45.9767 -22.6813 -22.6813 -22.0453 -22.0453 -22.0070 -22.0070 2.8369 2.8369 3.6308 3.6308 6.3201 6.3201 7.9929 7.9929 9.5198 9.5198 10.6223 10.6223 10.6843 10.6843 11.7131 11.7131 12.5705 12.5705 13.0854 13.0854 k = 0.4223-0.2833 0.8387 ( 3920 PWs) bands (ev): -45.9770 -45.9770 -22.6806 -22.6806 -22.0456 -22.0456 -22.0048 -22.0048 2.7686 2.7686 3.5858 3.5858 6.2976 6.2976 8.1110 8.1110 9.4901 9.4901 10.6242 10.6242 10.7919 10.7919 11.8091 11.8091 12.5530 12.5530 13.0799 13.0799 k = 0.4167-0.2680 0.8387 ( 3922 PWs) bands (ev): -45.9773 -45.9773 -22.6798 -22.6798 -22.0459 -22.0459 -22.0024 -22.0024 2.7028 2.7028 3.5412 3.5412 6.2713 6.2713 8.2358 8.2358 9.4590 9.4590 10.6253 10.6253 10.8931 10.8931 11.9161 11.9161 12.5405 12.5405 13.0740 13.0740 k = 0.4112-0.2527 0.8387 ( 3923 PWs) bands (ev): -45.9776 -45.9776 -22.6791 -22.6791 -22.0462 -22.0462 -22.0001 -22.0001 2.6397 2.6397 3.4971 3.4971 6.2422 6.2422 8.3657 8.3657 9.4271 9.4271 10.6257 10.6257 10.9877 10.9877 12.0332 12.0332 12.5334 12.5334 13.0677 13.0677 k = 0.4056-0.2374 0.8387 ( 3923 PWs) bands (ev): -45.9780 -45.9780 -22.6784 -22.6784 -22.0466 -22.0466 -21.9977 -21.9977 2.5791 2.5791 3.4540 3.4540 6.2112 6.2112 8.4992 8.4992 9.3947 9.3947 10.6255 10.6255 11.0762 11.0762 12.1591 12.1591 12.5319 12.5319 13.0610 13.0610 k = 0.4001-0.2222 0.8387 ( 3923 PWs) bands (ev): -45.9783 -45.9783 -22.6777 -22.6777 -22.0470 -22.0470 -21.9952 -21.9952 2.5212 2.5212 3.4118 3.4118 6.1791 6.1791 8.6351 8.6351 9.3621 9.3621 10.6249 10.6249 11.1595 11.1595 12.2922 12.2922 12.5364 12.5364 13.0542 13.0542 k = 0.3945-0.2069 0.8387 ( 3925 PWs) bands (ev): -45.9786 -45.9786 -22.6770 -22.6770 -22.0474 -22.0474 -21.9928 -21.9928 2.4658 2.4658 3.3709 3.3709 6.1463 6.1463 8.7720 8.7720 9.3297 9.3297 10.6241 10.6241 11.2382 11.2382 12.4310 12.4310 12.5469 12.5469 13.0473 13.0473 k = 0.3890-0.1916 0.8387 ( 3928 PWs) bands (ev): -45.9789 -45.9789 -22.6764 -22.6764 -22.0478 -22.0478 -21.9904 -21.9904 2.4132 2.4132 3.3313 3.3313 6.1134 6.1134 8.9088 8.9088 9.2977 9.2977 10.6235 10.6235 11.3132 11.3132 12.5603 12.5603 12.5771 12.5771 13.0406 13.0406 k = 0.3834-0.1764 0.8387 ( 3928 PWs) bands (ev): -45.9792 -45.9792 -22.6757 -22.6757 -22.0482 -22.0482 -21.9880 -21.9880 2.3631 2.3631 3.2933 3.2933 6.0808 6.0808 9.0442 9.0442 9.2662 9.2662 10.6235 10.6235 11.3849 11.3849 12.5849 12.5849 12.7207 12.7207 13.0345 13.0345 k = 0.3779-0.1611 0.8387 ( 3926 PWs) bands (ev): -45.9794 -45.9794 -22.6751 -22.6751 -22.0486 -22.0486 -21.9857 -21.9857 2.3157 2.3157 3.2568 3.2568 6.0487 6.0487 9.1767 9.1767 9.2358 9.2358 10.6247 10.6247 11.4538 11.4538 12.6128 12.6128 12.8678 12.8678 13.0298 13.0298 k = 0.3723-0.1458 0.8387 ( 3928 PWs) bands (ev): -45.9797 -45.9797 -22.6746 -22.6746 -22.0491 -22.0491 -21.9834 -21.9834 2.2710 2.2710 3.2221 3.2221 6.0174 6.0174 9.2054 9.2054 9.3060 9.3060 10.6278 10.6278 11.5202 11.5202 12.6453 12.6453 13.0110 13.0110 13.0313 13.0313 k = 0.3668-0.1306 0.8387 ( 3921 PWs) bands (ev): -45.9800 -45.9800 -22.6740 -22.6740 -22.0495 -22.0495 -21.9812 -21.9812 2.2289 2.2289 3.1891 3.1891 5.9871 5.9871 9.1768 9.1768 9.4289 9.4289 10.6336 10.6336 11.5842 11.5842 12.6812 12.6812 13.0270 13.0270 13.1627 13.1627 k = 0.3612-0.1153 0.8387 ( 3917 PWs) bands (ev): -45.9802 -45.9802 -22.6735 -22.6735 -22.0499 -22.0499 -21.9790 -21.9790 2.1894 2.1894 3.1581 3.1581 5.9581 5.9581 9.1493 9.1493 9.5446 9.5446 10.6433 10.6433 11.6459 11.6459 12.7179 12.7179 13.0349 13.0349 13.3063 13.3063 k = 0.3556-0.1000 0.8387 ( 3915 PWs) bands (ev): -45.9805 -45.9805 -22.6730 -22.6730 -22.0502 -22.0502 -21.9769 -21.9769 2.1527 2.1527 3.1289 3.1289 5.9304 5.9304 9.1230 9.1230 9.6512 9.6512 10.6579 10.6579 11.7053 11.7053 12.7516 12.7516 13.0532 13.0532 13.4460 13.4460 k = 0.3501-0.0847 0.8387 ( 3917 PWs) bands (ev): -45.9807 -45.9807 -22.6726 -22.6726 -22.0506 -22.0506 -21.9750 -21.9750 2.1186 2.1186 3.1017 3.1017 5.9042 5.9042 9.0980 9.0980 9.7470 9.7470 10.6786 10.6786 11.7622 11.7622 12.7781 12.7781 13.0866 13.0866 13.5802 13.5802 k = 0.3445-0.0695 0.8387 ( 3915 PWs) bands (ev): -45.9809 -45.9809 -22.6721 -22.6721 -22.0510 -22.0510 -21.9731 -21.9731 2.0872 2.0872 3.0766 3.0766 5.8796 5.8796 9.0745 9.0745 9.8304 9.8304 10.7060 10.7060 11.8163 11.8163 12.7949 12.7949 13.1378 13.1378 13.7070 13.7070 k = 0.3390-0.0542 0.8387 ( 3915 PWs) bands (ev): -45.9811 -45.9811 -22.6718 -22.6718 -22.0513 -22.0513 -21.9714 -21.9714 2.0585 2.0585 3.0536 3.0536 5.8568 5.8568 9.0524 9.0524 9.9007 9.9007 10.7406 10.7406 11.8674 11.8674 12.8025 12.8025 13.2063 13.2063 13.8246 13.8246 k = 0.3334-0.0389 0.8387 ( 3921 PWs) bands (ev): -45.9813 -45.9813 -22.6714 -22.6714 -22.0516 -22.0516 -21.9698 -21.9698 2.0324 2.0324 3.0326 3.0326 5.8358 5.8358 9.0319 9.0319 9.9578 9.9578 10.7816 10.7816 11.9151 11.9151 12.8034 12.8034 13.2897 13.2897 13.9308 13.9308 k = 0.3279-0.0237 0.8387 ( 3919 PWs) bands (ev): -45.9815 -45.9815 -22.6711 -22.6711 -22.0519 -22.0519 -21.9683 -21.9683 2.0091 2.0091 3.0139 3.0139 5.8166 5.8166 9.0130 9.0130 10.0028 10.0028 10.8276 10.8276 11.9590 11.9590 12.8002 12.8002 13.3853 13.3853 14.0236 14.0236 k = 0.3223-0.0084 0.8387 ( 3919 PWs) bands (ev): -45.9816 -45.9816 -22.6708 -22.6708 -22.0521 -22.0521 -21.9670 -21.9670 1.9884 1.9884 2.9973 2.9973 5.7994 5.7994 8.9956 8.9956 10.0373 10.0373 10.8763 10.8763 11.9984 11.9984 12.7947 12.7947 13.4909 13.4909 14.1009 14.1009 k = 0.3168 0.0069 0.8387 ( 3918 PWs) bands (ev): -45.9817 -45.9817 -22.6706 -22.6706 -22.0524 -22.0524 -21.9659 -21.9659 1.9704 1.9704 2.9829 2.9829 5.7842 5.7842 8.9799 8.9799 10.0633 10.0633 10.9256 10.9256 12.0330 12.0330 12.7883 12.7883 13.6045 13.6045 14.1613 14.1613 k = 0.3112 0.0221 0.8387 ( 3916 PWs) bands (ev): -45.9818 -45.9818 -22.6704 -22.6704 -22.0526 -22.0526 -21.9649 -21.9649 1.9551 1.9551 2.9708 2.9708 5.7710 5.7710 8.9659 8.9659 10.0828 10.0828 10.9730 10.9730 12.0621 12.0621 12.7818 12.7818 13.7242 13.7242 14.2041 14.2041 k = 0.3057 0.0374 0.8387 ( 3918 PWs) bands (ev): -45.9819 -45.9819 -22.6703 -22.6703 -22.0528 -22.0528 -21.9640 -21.9640 1.9425 1.9425 2.9609 2.9609 5.7599 5.7599 8.9535 8.9535 10.0975 10.0975 11.0167 11.0167 12.0850 12.0850 12.7761 12.7761 13.8480 13.8480 14.2296 14.2296 k = 0.3001 0.0527 0.8387 ( 3924 PWs) bands (ev): -45.9820 -45.9820 -22.6701 -22.6701 -22.0529 -22.0529 -21.9634 -21.9634 1.9326 1.9326 2.9533 2.9533 5.7509 5.7509 8.9428 8.9428 10.1087 10.1087 11.0552 11.0552 12.1012 12.1012 12.7718 12.7718 13.9734 13.9734 14.2390 14.2390 k = 0.2946 0.0680 0.8387 ( 3924 PWs) bands (ev): -45.9820 -45.9820 -22.6700 -22.6700 -22.0531 -22.0531 -21.9629 -21.9629 1.9254 1.9254 2.9479 2.9479 5.7441 5.7441 8.9338 8.9338 10.1176 10.1176 11.0874 11.0874 12.1099 12.1099 12.7692 12.7692 14.0971 14.0971 14.2341 14.2341 k = 0.2890 0.0832 0.8387 ( 3930 PWs) bands (ev): -45.9821 -45.9821 -22.6700 -22.6700 -22.0532 -22.0532 -21.9626 -21.9626 1.9210 1.9210 2.9449 2.9449 5.7394 5.7394 8.9265 8.9265 10.1249 10.1249 11.1124 11.1124 12.1105 12.1105 12.7688 12.7688 14.2141 14.2141 14.2176 14.2176 k = 0.2835 0.0985 0.8387 ( 3928 PWs) bands (ev): -45.9821 -45.9821 -22.6700 -22.6700 -22.0532 -22.0532 -21.9624 -21.9624 1.9192 1.9192 2.9442 2.9442 5.7369 5.7369 8.9209 8.9209 10.1313 10.1313 11.1298 11.1298 12.1024 12.1024 12.7709 12.7709 14.1882 14.1882 14.3209 14.3209 k = 0.2779 0.1138 0.8387 ( 3931 PWs) bands (ev): -45.9821 -45.9821 -22.6700 -22.6700 -22.0532 -22.0532 -21.9625 -21.9625 1.9201 1.9201 2.9457 2.9457 5.7365 5.7365 8.9170 8.9170 10.1371 10.1371 11.1393 11.1393 12.0851 12.0851 12.7755 12.7755 14.1500 14.1500 14.3934 14.3934 k = 0.2724 0.1290 0.8387 ( 3934 PWs) bands (ev): -45.9820 -45.9820 -22.6701 -22.6701 -22.0533 -22.0533 -21.9627 -21.9627 1.9237 1.9237 2.9496 2.9496 5.7383 5.7383 8.9148 8.9148 10.1428 10.1428 11.1408 11.1408 12.0582 12.0582 12.7826 12.7826 14.1029 14.1029 14.4071 14.4071 k = 0.2668 0.1443 0.8387 ( 3930 PWs) bands (ev): -45.9820 -45.9820 -22.6702 -22.6702 -22.0532 -22.0532 -21.9631 -21.9631 1.9300 1.9300 2.9558 2.9558 5.7422 5.7422 8.9142 8.9142 10.1485 10.1485 11.1343 11.1343 12.0213 12.0213 12.7924 12.7924 14.0475 14.0475 14.4066 14.4066 k = 0.2613 0.1596 0.8387 ( 3926 PWs) bands (ev): -45.9819 -45.9819 -22.6704 -22.6704 -22.0532 -22.0532 -21.9636 -21.9636 1.9390 1.9390 2.9644 2.9644 5.7483 5.7483 8.9152 8.9152 10.1543 10.1543 11.1201 11.1201 11.9743 11.9743 12.8044 12.8044 13.9848 13.9848 14.4028 14.4028 k = 0.2557 0.1748 0.8387 ( 3930 PWs) bands (ev): -45.9818 -45.9818 -22.6706 -22.6706 -22.0531 -22.0531 -21.9644 -21.9644 1.9507 1.9507 2.9752 2.9752 5.7565 5.7565 8.9179 8.9179 10.1604 10.1604 11.0984 11.0984 11.9171 11.9171 12.8185 12.8185 13.9154 13.9154 14.3933 14.3933 k = 0.2502 0.1901 0.8387 ( 3926 PWs) bands (ev): -45.9817 -45.9817 -22.6708 -22.6708 -22.0530 -22.0530 -21.9653 -21.9653 1.9651 1.9651 2.9883 2.9883 5.7668 5.7668 8.9221 8.9221 10.1666 10.1666 11.0695 11.0695 11.8497 11.8497 12.8345 12.8345 13.8404 13.8404 14.3711 14.3711 k = 0.2446 0.2054 0.8387 ( 3926 PWs) bands (ev): -45.9816 -45.9816 -22.6711 -22.6711 -22.0528 -22.0528 -21.9664 -21.9664 1.9823 1.9823 3.0038 3.0038 5.7791 5.7791 8.9278 8.9278 10.1730 10.1730 11.0338 11.0338 11.7724 11.7724 12.8519 12.8519 13.7610 13.7610 14.3270 14.3270 k = 0.2391 0.2207 0.8387 ( 3930 PWs) bands (ev): -45.9814 -45.9814 -22.6714 -22.6714 -22.0527 -22.0527 -21.9676 -21.9676 2.0021 2.0021 3.0215 3.0215 5.7934 5.7934 8.9350 8.9350 10.1795 10.1795 10.9918 10.9918 11.6854 11.6854 12.8704 12.8704 13.6786 13.6786 14.2586 14.2586 k = 0.2335 0.2359 0.8387 ( 3936 PWs) bands (ev): -45.9812 -45.9812 -22.6717 -22.6717 -22.0525 -22.0525 -21.9690 -21.9690 2.0246 2.0246 3.0415 3.0415 5.8097 5.8097 8.9436 8.9436 10.1857 10.1857 10.9438 10.9438 11.5891 11.5891 12.8897 12.8897 13.5943 13.5943 14.1718 14.1718 k = 0.2280 0.2512 0.8387 ( 3932 PWs) bands (ev): -45.9810 -45.9810 -22.6721 -22.6721 -22.0523 -22.0523 -21.9705 -21.9705 2.0498 2.0498 3.0638 3.0638 5.8279 5.8279 8.9536 8.9536 10.1915 10.1915 10.8903 10.8903 11.4841 11.4841 12.9094 12.9094 13.5094 13.5094 14.0740 14.0740 k = 0.2224 0.2665 0.8387 ( 3926 PWs) bands (ev): -45.9808 -45.9808 -22.6725 -22.6725 -22.0520 -22.0520 -21.9722 -21.9722 2.0777 2.0777 3.0883 3.0883 5.8479 5.8479 8.9649 8.9649 10.1964 10.1964 10.8318 10.8318 11.3711 11.3711 12.9293 12.9293 13.4248 13.4248 13.9707 13.9707 k = 0.2168 0.2817 0.8387 ( 3936 PWs) bands (ev): -45.9806 -45.9806 -22.6729 -22.6729 -22.0518 -22.0518 -21.9740 -21.9740 2.1082 2.1082 3.1151 3.1151 5.8697 5.8697 8.9773 8.9773 10.1998 10.1998 10.7690 10.7690 11.2506 11.2506 12.9491 12.9491 13.3415 13.3415 13.8659 13.8659 k = 0.2113 0.2970 0.8387 ( 3934 PWs) bands (ev): -45.9804 -45.9804 -22.6734 -22.6734 -22.0515 -22.0515 -21.9759 -21.9759 2.1415 2.1415 3.1441 3.1441 5.8931 5.8931 8.9907 8.9907 10.2007 10.2007 10.7030 10.7030 11.1234 11.1234 12.9685 12.9685 13.2601 13.2601 13.7624 13.7624 k = 0.2057 0.3123 0.8387 ( 3928 PWs) bands (ev): -45.9801 -45.9801 -22.6739 -22.6739 -22.0512 -22.0512 -21.9779 -21.9779 2.1774 2.1774 3.1752 3.1752 5.9182 5.9182 9.0051 9.0051 10.1977 10.1977 10.6353 10.6353 10.9903 10.9903 12.9873 12.9873 13.1811 13.1811 13.6624 13.6624 k = 0.2002 0.3276 0.8387 ( 3926 PWs) bands (ev): -45.9799 -45.9799 -22.6745 -22.6745 -22.0509 -22.0509 -21.9800 -21.9800 2.2160 2.2160 3.2085 3.2085 5.9448 5.9448 9.0202 9.0202 10.1883 10.1883 10.5684 10.5684 10.8522 10.8522 13.0051 13.0051 13.1049 13.1049 13.5674 13.5674 k = 0.1946 0.3428 0.8387 ( 3924 PWs) bands (ev): -45.9796 -45.9796 -22.6751 -22.6751 -22.0506 -22.0506 -21.9822 -21.9822 2.2573 2.2573 3.2440 3.2440 5.9727 5.9727 9.0358 9.0358 10.1686 10.1686 10.5062 10.5062 10.7099 10.7099 13.0212 13.0212 13.0323 13.0323 13.4790 13.4790 k = 0.1891 0.3581 0.8387 ( 3919 PWs) bands (ev): -45.9793 -45.9793 -22.6757 -22.6757 -22.0503 -22.0503 -21.9845 -21.9845 2.3013 2.3013 3.2815 3.2815 6.0019 6.0019 9.0517 9.0517 10.1338 10.1338 10.4537 10.4537 10.5644 10.5644 12.9617 12.9617 13.0368 13.0368 13.3984 13.3984 k = 0.1835 0.3734 0.8387 ( 3913 PWs) bands (ev): -45.9790 -45.9790 -22.6763 -22.6763 -22.0500 -22.0500 -21.9868 -21.9868 2.3479 2.3479 3.3211 3.3211 6.0323 6.0323 9.0673 9.0673 10.0804 10.0804 10.4133 10.4133 10.4178 10.4178 12.8952 12.8952 13.0492 13.0492 13.3268 13.3268 k = 0.1780 0.3886 0.8387 ( 3908 PWs) bands (ev): -45.9787 -45.9787 -22.6770 -22.6770 -22.0496 -22.0496 -21.9892 -21.9892 2.3971 2.3971 3.3627 3.3627 6.0636 6.0636 9.0821 9.0821 10.0092 10.0092 10.2673 10.2673 10.3883 10.3883 12.8321 12.8321 13.0575 13.0575 13.2663 13.2663 k = 0.1724 0.4039 0.8387 ( 3908 PWs) bands (ev): -45.9784 -45.9784 -22.6777 -22.6777 -22.0493 -22.0493 -21.9916 -21.9916 2.4490 2.4490 3.4062 3.4062 6.0957 6.0957 9.0950 9.0950 9.9241 9.9241 10.1185 10.1185 10.3711 10.3711 12.7726 12.7726 13.0588 13.0588 13.2200 13.2200 k = 0.1669 0.4192 0.8387 ( 3904 PWs) bands (ev): -45.9781 -45.9781 -22.6784 -22.6784 -22.0490 -22.0490 -21.9940 -21.9940 2.5036 2.5036 3.4517 3.4517 6.1285 6.1285 9.1046 9.1046 9.8295 9.8295 9.9719 9.9719 10.3590 10.3590 12.7167 12.7167 13.0496 13.0496 13.1915 13.1915 k = 0.1613 0.4344 0.8387 ( 3906 PWs) bands (ev): -45.9777 -45.9777 -22.6791 -22.6791 -22.0487 -22.0487 -21.9965 -21.9965 2.5608 2.5608 3.4990 3.4990 6.1616 6.1616 9.1080 9.1080 9.7284 9.7284 9.8307 9.8307 10.3496 10.3496 12.6645 12.6645 13.0302 13.0302 13.1804 13.1804 k = 0.1558 0.4497 0.8387 ( 3907 PWs) bands (ev): -45.9774 -45.9774 -22.6799 -22.6799 -22.0484 -22.0484 -21.9989 -21.9989 2.6206 2.6206 3.5480 3.5480 6.1950 6.1950 9.0999 9.0999 9.6229 9.6229 9.7003 9.7003 10.3410 10.3410 12.6160 12.6160 13.0068 13.0068 13.1804 13.1804 k = 0.1502 0.4650 0.8387 ( 3903 PWs) bands (ev): -45.9771 -45.9771 -22.6807 -22.6807 -22.0481 -22.0481 -22.0013 -22.0013 2.6830 2.6830 3.5987 3.5987 6.2282 6.2282 9.0718 9.0718 9.5147 9.5147 9.5897 9.5897 10.3325 10.3325 12.5713 12.5713 12.9848 12.9848 13.1859 13.1859 k = 0.1447 0.4803 0.8387 ( 3905 PWs) bands (ev): -45.9767 -45.9767 -22.6814 -22.6814 -22.0479 -22.0479 -22.0037 -22.0037 2.7481 2.7481 3.6510 3.6510 6.2611 6.2611 9.0131 9.0131 9.4051 9.4051 9.5093 9.5093 10.3234 10.3234 12.5304 12.5304 12.9668 12.9668 13.1939 13.1939 k = 0.1391 0.4955 0.8387 ( 3901 PWs) bands (ev): -45.9764 -45.9764 -22.6822 -22.6822 -22.0477 -22.0477 -22.0060 -22.0060 2.8157 2.8157 3.7048 3.7048 6.2933 6.2933 8.9200 8.9200 9.2951 9.2951 9.4632 9.4632 10.3135 10.3135 12.4936 12.4936 12.9537 12.9537 13.2031 13.2031 k = 0.1336 0.5108 0.8387 ( 3907 PWs) bands (ev): -45.9761 -45.9761 -22.6830 -22.6830 -22.0475 -22.0475 -22.0083 -22.0083 2.8859 2.8859 3.7600 3.7600 6.3244 6.3244 8.8002 8.8002 9.1856 9.1856 9.4439 9.4439 10.3025 10.3025 12.4608 12.4608 12.9457 12.9457 13.2129 13.2129 k = 0.1280 0.5261 0.8387 ( 3908 PWs) bands (ev): -45.9758 -45.9758 -22.6838 -22.6838 -22.0474 -22.0474 -22.0105 -22.0105 2.9587 2.9587 3.8164 3.8164 6.3540 6.3540 8.6644 8.6644 9.0774 9.0774 9.4408 9.4408 10.2905 10.2905 12.4321 12.4321 12.9424 12.9424 13.2233 13.2233 k = 0.1225 0.5413 0.8387 ( 3899 PWs) bands (ev): -45.9754 -45.9754 -22.6846 -22.6846 -22.0473 -22.0473 -22.0126 -22.0126 3.0340 3.0340 3.8739 3.8739 6.3816 6.3816 8.5198 8.5198 8.9715 8.9715 9.4467 9.4467 10.2775 10.2775 12.4076 12.4076 12.9433 12.9433 13.2342 13.2342 k = 0.1169 0.5566 0.8387 ( 3903 PWs) bands (ev): -45.9751 -45.9751 -22.6854 -22.6854 -22.0473 -22.0473 -22.0146 -22.0146 3.1119 3.1119 3.9323 3.9323 6.4068 6.4068 8.3707 8.3707 8.8688 8.8688 9.4574 9.4574 10.2636 10.2636 12.3874 12.3874 12.9478 12.9478 13.2457 13.2457 k = 0.1114 0.5719 0.8387 ( 3906 PWs) bands (ev): -45.9748 -45.9748 -22.6862 -22.6862 -22.0473 -22.0473 -22.0164 -22.0164 3.1922 3.1922 3.9914 3.9914 6.4290 6.4290 8.2192 8.2192 8.7703 8.7703 9.4707 9.4707 10.2489 10.2489 12.3716 12.3716 12.9550 12.9550 13.2581 13.2581 k = 0.1058 0.5871 0.8387 ( 3906 PWs) bands (ev): -45.9745 -45.9745 -22.6869 -22.6869 -22.0474 -22.0474 -22.0181 -22.0181 3.2751 3.2751 4.0509 4.0509 6.4476 6.4476 8.0669 8.0669 8.6769 8.6769 9.4851 9.4851 10.2336 10.2336 12.3604 12.3604 12.9643 12.9643 13.2716 13.2716 k = 0.1003 0.6024 0.8387 ( 3902 PWs) bands (ev): -45.9742 -45.9742 -22.6877 -22.6877 -22.0476 -22.0476 -22.0197 -22.0197 3.3605 3.3605 4.1106 4.1106 6.4621 6.4621 7.9145 7.9145 8.5895 8.5895 9.4997 9.4997 10.2177 10.2177 12.3537 12.3537 12.9747 12.9747 13.2864 13.2864 k = 0.0947 0.6177 0.8387 ( 3904 PWs) bands (ev): -45.9740 -45.9740 -22.6884 -22.6884 -22.0479 -22.0479 -22.0211 -22.0211 3.4482 3.4482 4.1701 4.1701 6.4718 6.4718 7.7626 7.7626 8.5091 8.5091 9.5141 9.5141 10.2016 10.2016 12.3516 12.3516 12.9856 12.9856 13.3030 13.3030 k = 0.0892 0.6330 0.8387 ( 3902 PWs) bands (ev): -45.9737 -45.9737 -22.6891 -22.6891 -22.0483 -22.0483 -22.0224 -22.0224 3.5384 3.5384 4.2291 4.2291 6.4764 6.4764 7.6116 7.6116 8.4365 8.4365 9.5277 9.5277 10.1853 10.1853 12.3541 12.3541 12.9963 12.9963 13.3213 13.3213 k = 0.0836 0.6482 0.8387 ( 3902 PWs) bands (ev): -45.9735 -45.9735 -22.6898 -22.6898 -22.0487 -22.0487 -22.0235 -22.0235 3.6309 3.6309 4.2871 4.2871 6.4755 6.4755 7.4619 7.4619 8.3726 8.3726 9.5404 9.5404 10.1690 10.1690 12.3614 12.3614 13.0061 13.0061 13.3416 13.3416 k = 0.0780 0.6635 0.8387 ( 3908 PWs) bands (ev): -45.9732 -45.9732 -22.6905 -22.6905 -22.0492 -22.0492 -22.0244 -22.0244 3.7258 3.7258 4.3435 4.3435 6.4691 6.4691 7.3136 7.3136 8.3178 8.3178 9.5518 9.5518 10.1529 10.1529 12.3733 12.3733 13.0147 13.0147 13.3637 13.3637 k = 0.0725 0.6788 0.8387 ( 3906 PWs) bands (ev): -45.9730 -45.9730 -22.6911 -22.6911 -22.0497 -22.0497 -22.0252 -22.0252 3.8229 3.8229 4.3977 4.3977 6.4575 6.4575 7.1671 7.1671 8.2725 8.2725 9.5617 9.5617 10.1371 10.1371 12.3899 12.3899 13.0219 13.0219 13.3873 13.3873 k = 0.0669 0.6940 0.8387 ( 3906 PWs) bands (ev): -45.9728 -45.9728 -22.6916 -22.6916 -22.0503 -22.0503 -22.0259 -22.0259 3.9221 3.9221 4.4491 4.4491 6.4411 6.4411 7.0225 7.0225 8.2367 8.2367 9.5701 9.5701 10.1219 10.1219 12.4111 12.4111 13.0277 13.0277 13.4122 13.4122 k = 0.0614 0.7093 0.8387 ( 3906 PWs) bands (ev): -45.9726 -45.9726 -22.6922 -22.6922 -22.0509 -22.0509 -22.0264 -22.0264 4.0234 4.0234 4.4967 4.4967 6.4210 6.4210 6.8801 6.8801 8.2102 8.2102 9.5768 9.5768 10.1073 10.1073 12.4369 12.4369 13.0323 13.0323 13.4378 13.4378 k = 0.0558 0.7246 0.8387 ( 3906 PWs) bands (ev): -45.9724 -45.9724 -22.6926 -22.6926 -22.0514 -22.0514 -22.0269 -22.0269 4.1266 4.1266 4.5395 4.5395 6.3985 6.3985 6.7400 6.7400 8.1925 8.1925 9.5818 9.5818 10.0935 10.0935 12.4671 12.4671 13.0356 13.0356 13.4637 13.4637 k = 0.0503 0.7398 0.8387 ( 3914 PWs) bands (ev): -45.9723 -45.9723 -22.6931 -22.6931 -22.0520 -22.0520 -22.0272 -22.0272 4.2315 4.2315 4.5766 4.5766 6.3752 6.3752 6.6025 6.6025 8.1831 8.1831 9.5850 9.5850 10.0806 10.0806 12.5017 12.5017 13.0381 13.0381 13.4892 13.4892 k = 0.0447 0.7551 0.8387 ( 3918 PWs) bands (ev): -45.9722 -45.9722 -22.6934 -22.6934 -22.0525 -22.0525 -22.0275 -22.0275 4.3378 4.3378 4.6067 4.6067 6.3529 6.3529 6.4680 6.4680 8.1810 8.1810 9.5863 9.5863 10.0688 10.0688 12.5403 12.5403 13.0399 13.0399 13.5050 13.5050 k = 0.0392 0.7704 0.8387 ( 3924 PWs) bands (ev): -45.9720 -45.9720 -22.6938 -22.6938 -22.0529 -22.0529 -22.0277 -22.0277 4.4452 4.4452 4.6288 4.6288 6.3330 6.3330 6.3371 6.3371 8.1856 8.1856 9.5859 9.5859 10.0581 10.0581 12.5829 12.5829 13.0412 13.0412 13.4392 13.4392 k = 0.0336 0.7857 0.8387 ( 3924 PWs) bands (ev): -45.9720 -45.9720 -22.6940 -22.6940 -22.0533 -22.0533 -22.0279 -22.0279 4.5530 4.5530 4.6419 4.6419 6.2098 6.2098 6.3180 6.3180 8.1959 8.1959 9.5837 9.5837 10.0486 10.0486 12.6292 12.6292 13.0424 13.0424 13.3727 13.3727 k = 0.0281 0.8009 0.8387 ( 3928 PWs) bands (ev): -45.9719 -45.9719 -22.6942 -22.6942 -22.0536 -22.0536 -22.0280 -22.0280 4.6452 4.6452 4.6602 4.6602 6.0879 6.0879 6.3084 6.3084 8.2114 8.2114 9.5797 9.5797 10.0405 10.0405 12.6789 12.6789 13.0436 13.0436 13.3086 13.3086 k = 0.0281 0.8009 0.8387 ( 3928 PWs) bands (ev): -45.9719 -45.9719 -22.6942 -22.6942 -22.0536 -22.0536 -22.0280 -22.0280 4.6452 4.6452 4.6602 4.6602 6.0879 6.0879 6.3084 6.3084 8.2114 8.2114 9.5797 9.5797 10.0405 10.0405 12.6789 12.6789 13.0436 13.0436 13.3086 13.3086 k = 0.0211 0.8101 0.8290 ( 3928 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0539 -22.0539 -22.0281 -22.0281 4.6431 4.6431 4.7913 4.7913 5.9429 5.9429 6.3013 6.3013 8.2313 8.2313 9.5743 9.5743 10.0322 10.0322 12.7437 12.7437 13.0448 13.0448 13.2313 13.2313 k = 0.0140 0.8193 0.8194 ( 3928 PWs) bands (ev): -45.9718 -45.9718 -22.6946 -22.6946 -22.0541 -22.0541 -22.0282 -22.0282 4.6416 4.6416 4.9101 4.9101 5.8142 5.8142 6.2963 6.2963 8.2458 8.2458 9.5704 9.5704 10.0263 10.0263 12.8070 12.8070 13.0455 13.0455 13.1591 13.1591 k = 0.0070 0.8286 0.8097 ( 3928 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6407 4.6407 5.0014 5.0014 5.7170 5.7170 6.2933 6.2933 8.2546 8.2546 9.5681 9.5681 10.0227 10.0227 12.8626 12.8626 13.0452 13.0452 13.0988 13.0988 k = 0.0000 0.8378 0.8001 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6404 4.6404 5.0379 5.0379 5.6785 5.6785 6.2923 6.2923 8.2576 8.2576 9.5673 9.5673 10.0215 10.0215 12.8892 12.8892 13.0439 13.0439 13.0719 13.0719 k = 0.0000 0.8378 0.8001 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6404 4.6404 5.0379 5.0379 5.6785 5.6785 6.2923 6.2923 8.2576 8.2576 9.5673 9.5673 10.0215 10.0215 12.8892 12.8892 13.0439 13.0439 13.0719 13.0719 k = 0.0000 0.8260 0.7888 ( 3926 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6287 4.6287 5.0389 5.0389 5.6798 5.6798 6.2986 6.2986 8.2656 8.2656 9.5644 9.5644 10.0214 10.0214 12.8929 12.8929 13.0446 13.0446 13.0723 13.0723 k = 0.0000 0.8142 0.7775 ( 3930 PWs) bands (ev): -45.9718 -45.9718 -22.6946 -22.6946 -22.0541 -22.0541 -22.0282 -22.0282 4.5942 4.5942 5.0416 5.0416 5.6838 5.6838 6.3171 6.3171 8.2898 8.2898 9.5558 9.5558 10.0213 10.0213 12.9038 12.9038 13.0468 13.0468 13.0736 13.0736 k = 0.0000 0.8024 0.7663 ( 3922 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0540 -22.0540 -22.0281 -22.0281 4.5390 4.5390 5.0462 5.0462 5.6905 5.6905 6.3460 6.3460 8.3296 8.3296 9.5416 9.5416 10.0211 10.0211 12.9217 12.9217 13.0504 13.0504 13.0757 13.0757 k = 0.0000 0.7906 0.7550 ( 3922 PWs) bands (ev): -45.9719 -45.9719 -22.6943 -22.6943 -22.0537 -22.0537 -22.0279 -22.0279 4.4661 4.4661 5.0525 5.0525 5.6999 5.6999 6.3828 6.3828 8.3845 8.3845 9.5220 9.5220 10.0208 10.0208 12.9463 12.9463 13.0555 13.0555 13.0787 13.0787 k = 0.0000 0.7788 0.7437 ( 3922 PWs) bands (ev): -45.9720 -45.9720 -22.6940 -22.6940 -22.0534 -22.0534 -22.0278 -22.0278 4.3783 4.3783 5.0607 5.0607 5.7119 5.7119 6.4252 6.4252 8.4537 8.4537 9.4976 9.4976 10.0205 10.0205 12.9770 12.9770 13.0621 13.0621 13.0827 13.0827 k = 0.0000 0.7670 0.7325 ( 3918 PWs) bands (ev): -45.9721 -45.9721 -22.6937 -22.6937 -22.0530 -22.0530 -22.0276 -22.0276 4.2786 4.2786 5.0707 5.0707 5.7266 5.7266 6.4712 6.4712 8.5361 8.5361 9.4685 9.4685 10.0201 10.0201 13.0130 13.0130 13.0702 13.0702 13.0878 13.0878 k = 0.0000 0.7552 0.7212 ( 3914 PWs) bands (ev): -45.9722 -45.9722 -22.6934 -22.6934 -22.0525 -22.0525 -22.0273 -22.0273 4.1695 4.1695 5.0824 5.0824 5.7440 5.7440 6.5193 6.5193 8.6305 8.6305 9.4355 9.4355 10.0196 10.0196 13.0530 13.0530 13.0803 13.0803 13.0944 13.0944 k = 0.0000 0.7434 0.7099 ( 3918 PWs) bands (ev): -45.9723 -45.9723 -22.6930 -22.6930 -22.0519 -22.0519 -22.0270 -22.0270 4.0531 4.0531 5.0959 5.0959 5.7641 5.7641 6.5684 6.5684 8.7355 8.7355 9.3988 9.3988 10.0191 10.0191 13.0837 13.0837 13.1003 13.1003 13.1071 13.1071 k = 0.0000 0.7316 0.6987 ( 3918 PWs) bands (ev): -45.9725 -45.9725 -22.6925 -22.6925 -22.0514 -22.0514 -22.0267 -22.0267 3.9310 3.9310 5.1111 5.1111 5.7868 5.7868 6.6179 6.6179 8.8496 8.8496 9.3590 9.3590 10.0186 10.0186 13.0952 13.0952 13.1138 13.1138 13.1516 13.1516 k = 0.0000 0.7198 0.6874 ( 3920 PWs) bands (ev): -45.9727 -45.9727 -22.6920 -22.6920 -22.0507 -22.0507 -22.0263 -22.0263 3.8047 3.8047 5.1281 5.1281 5.8122 5.8122 6.6674 6.6674 8.9714 8.9714 9.3167 9.3167 10.0182 10.0182 13.1044 13.1044 13.1287 13.1287 13.2024 13.2024 k = 0.0000 0.7080 0.6761 ( 3908 PWs) bands (ev): -45.9729 -45.9729 -22.6915 -22.6915 -22.0500 -22.0500 -22.0259 -22.0259 3.6752 3.6752 5.1466 5.1466 5.8403 5.8403 6.7168 6.7168 9.0992 9.0992 9.2723 9.2723 10.0177 10.0177 13.1134 13.1134 13.1465 13.1465 13.2554 13.2554 k = 0.0000 0.6962 0.6649 ( 3910 PWs) bands (ev): -45.9731 -45.9731 -22.6909 -22.6909 -22.0492 -22.0492 -22.0254 -22.0254 3.5434 3.5434 5.1668 5.1668 5.8710 5.8710 6.7661 6.7661 9.2227 9.2227 9.2350 9.2350 10.0173 10.0173 13.1225 13.1225 13.1674 13.1674 13.3092 13.3092 k = 0.0000 0.6844 0.6536 ( 3908 PWs) bands (ev): -45.9733 -45.9733 -22.6902 -22.6902 -22.0484 -22.0484 -22.0248 -22.0248 3.4100 3.4100 5.1886 5.1886 5.9043 5.9043 6.8152 6.8152 9.1785 9.1785 9.3673 9.3673 10.0170 10.0170 13.1321 13.1321 13.1913 13.1913 13.3630 13.3630 k = 0.0000 0.6726 0.6423 ( 3908 PWs) bands (ev): -45.9736 -45.9736 -22.6895 -22.6895 -22.0476 -22.0476 -22.0242 -22.0242 3.2757 3.2757 5.2119 5.2119 5.9404 5.9404 6.8644 6.8644 9.1304 9.1304 9.5040 9.5040 10.0168 10.0168 13.1423 13.1423 13.2188 13.2188 13.4158 13.4158 k = 0.0000 0.6608 0.6310 ( 3912 PWs) bands (ev): -45.9738 -45.9738 -22.6888 -22.6888 -22.0467 -22.0467 -22.0235 -22.0235 3.1410 3.1410 5.2367 5.2367 5.9790 5.9790 6.9135 6.9135 9.0819 9.0819 9.6406 9.6406 10.0168 10.0168 13.1529 13.1529 13.2502 13.2502 13.4669 13.4669 k = 0.0000 0.6490 0.6198 ( 3916 PWs) bands (ev): -45.9741 -45.9741 -22.6880 -22.6880 -22.0458 -22.0458 -22.0227 -22.0227 3.0062 3.0062 5.2629 5.2629 6.0203 6.0203 6.9627 6.9627 9.0333 9.0333 9.7752 9.7752 10.0169 10.0169 13.1642 13.1642 13.2861 13.2861 13.5153 13.5153 k = 0.0000 0.6372 0.6085 ( 3912 PWs) bands (ev): -45.9744 -45.9744 -22.6872 -22.6872 -22.0449 -22.0449 -22.0219 -22.0219 2.8717 2.8717 5.2905 5.2905 6.0642 6.0642 7.0119 7.0119 8.9849 8.9849 9.9062 9.9062 10.0173 10.0173 13.1759 13.1759 13.3270 13.3270 13.5604 13.5604 k = 0.0000 0.6254 0.5972 ( 3916 PWs) bands (ev): -45.9747 -45.9747 -22.6863 -22.6863 -22.0440 -22.0440 -22.0209 -22.0209 2.7378 2.7378 5.3194 5.3194 6.1107 6.1107 7.0611 7.0611 8.9371 8.9371 10.0156 10.0156 10.0342 10.0342 13.1882 13.1882 13.3737 13.3737 13.6013 13.6013 k = 0.0000 0.6136 0.5860 ( 3906 PWs) bands (ev): -45.9750 -45.9750 -22.6854 -22.6854 -22.0431 -22.0431 -22.0199 -22.0199 2.6047 2.6047 5.3494 5.3494 6.1598 6.1598 7.1100 7.1100 8.8902 8.8902 10.0180 10.0180 10.1515 10.1515 13.2011 13.2011 13.4265 13.4265 13.6376 13.6376 k = 0.0000 0.6018 0.5747 ( 3906 PWs) bands (ev): -45.9754 -45.9754 -22.6845 -22.6845 -22.0422 -22.0422 -22.0188 -22.0188 2.4727 2.4727 5.3806 5.3806 6.2115 6.2115 7.1587 7.1587 8.8445 8.8445 10.0190 10.0190 10.2618 10.2618 13.2144 13.2144 13.4850 13.4850 13.6687 13.6687 k = 0.0000 0.5900 0.5634 ( 3910 PWs) bands (ev): -45.9757 -45.9757 -22.6835 -22.6835 -22.0413 -22.0413 -22.0176 -22.0176 2.3419 2.3419 5.4129 5.4129 6.2659 6.2659 7.2069 7.2069 8.8001 8.8001 10.0203 10.0203 10.3621 10.3621 13.2282 13.2282 13.5450 13.5450 13.6936 13.6936 k = 0.0000 0.5782 0.5522 ( 3914 PWs) bands (ev): -45.9761 -45.9761 -22.6825 -22.6825 -22.0404 -22.0404 -22.0163 -22.0163 2.2124 2.2124 5.4460 5.4460 6.3228 6.3228 7.2544 7.2544 8.7573 8.7573 10.0219 10.0219 10.4514 10.4514 13.2424 13.2424 13.5839 13.5839 13.7065 13.7065 k = 0.0000 0.5664 0.5409 ( 3916 PWs) bands (ev): -45.9764 -45.9764 -22.6814 -22.6814 -22.0395 -22.0395 -22.0149 -22.0149 2.0846 2.0846 5.4800 5.4800 6.3822 6.3822 7.3008 7.3008 8.7164 8.7164 10.0238 10.0238 10.5290 10.5290 13.2571 13.2571 13.5699 13.5699 13.7234 13.7234 k = 0.0000 0.5546 0.5296 ( 3914 PWs) bands (ev): -45.9768 -45.9768 -22.6803 -22.6803 -22.0387 -22.0387 -22.0134 -22.0134 1.9583 1.9583 5.5147 5.5147 6.4442 6.4442 7.3458 7.3458 8.6776 8.6776 10.0260 10.0260 10.5946 10.5946 13.2721 13.2721 13.5364 13.5364 13.7334 13.7334 k = 0.0000 0.5428 0.5184 ( 3914 PWs) bands (ev): -45.9772 -45.9772 -22.6792 -22.6792 -22.0378 -22.0378 -22.0118 -22.0118 1.8338 1.8338 5.5499 5.5499 6.5088 6.5088 7.3890 7.3890 8.6411 8.6411 10.0286 10.0286 10.6488 10.6488 13.2875 13.2875 13.5044 13.5044 13.7365 13.7365 k = 0.0000 0.5310 0.5071 ( 3914 PWs) bands (ev): -45.9776 -45.9776 -22.6781 -22.6781 -22.0370 -22.0370 -22.0102 -22.0102 1.7112 1.7112 5.5856 5.5856 6.5758 6.5758 7.4301 7.4301 8.6070 8.6070 10.0316 10.0316 10.6923 10.6923 13.3032 13.3032 13.4777 13.4777 13.7338 13.7338 k = 0.0000 0.5192 0.4958 ( 3918 PWs) bands (ev): -45.9780 -45.9780 -22.6770 -22.6770 -22.0362 -22.0362 -22.0084 -22.0084 1.5906 1.5906 5.6215 5.6215 6.6454 6.6454 7.4686 7.4686 8.5757 8.5757 10.0350 10.0350 10.7267 10.7267 13.3191 13.3191 13.4569 13.4569 13.7259 13.7259 k = 0.0000 0.5074 0.4846 ( 3918 PWs) bands (ev): -45.9784 -45.9784 -22.6758 -22.6758 -22.0354 -22.0354 -22.0066 -22.0066 1.4719 1.4719 5.6576 5.6576 6.7175 6.7175 7.5039 7.5039 8.5472 8.5472 10.0389 10.0389 10.7537 10.7537 13.3353 13.3353 13.4416 13.4416 13.7134 13.7134 k = 0.0000 0.4956 0.4733 ( 3914 PWs) bands (ev): -45.9789 -45.9789 -22.6746 -22.6746 -22.0346 -22.0346 -22.0047 -22.0047 1.3553 1.3553 5.6936 5.6936 6.7920 6.7920 7.5357 7.5357 8.5218 8.5218 10.0431 10.0431 10.7752 10.7752 13.3515 13.3515 13.4312 13.4312 13.6967 13.6967 k = 0.0000 0.4838 0.4620 ( 3914 PWs) bands (ev): -45.9793 -45.9793 -22.6734 -22.6734 -22.0339 -22.0339 -22.0027 -22.0027 1.2409 1.2409 5.7294 5.7294 6.8690 6.8690 7.5634 7.5634 8.4996 8.4996 10.0478 10.0478 10.7932 10.7932 13.3677 13.3677 13.4253 13.4253 13.6763 13.6763 k = 0.0000 0.4720 0.4507 ( 3918 PWs) bands (ev): -45.9797 -45.9797 -22.6722 -22.6722 -22.0331 -22.0331 -22.0007 -22.0007 1.1287 1.1287 5.7648 5.7648 6.9483 6.9483 7.5866 7.5866 8.4809 8.4809 10.0530 10.0530 10.8097 10.8097 13.3834 13.3834 13.4234 13.4234 13.6528 13.6528 k = 0.0000 0.4602 0.4395 ( 3918 PWs) bands (ev): -45.9802 -45.9802 -22.6710 -22.6710 -22.0324 -22.0324 -21.9986 -21.9986 1.0188 1.0188 5.7997 5.7997 7.0301 7.0301 7.6050 7.6050 8.4658 8.4658 10.0586 10.0586 10.8263 10.8263 13.3977 13.3977 13.4259 13.4259 13.6265 13.6265 k = 0.0000 0.4484 0.4282 ( 3918 PWs) bands (ev): -45.9806 -45.9806 -22.6697 -22.6697 -22.0317 -22.0317 -21.9964 -21.9964 0.9112 0.9112 5.8338 5.8338 7.1142 7.1142 7.6181 7.6181 8.4544 8.4544 10.0647 10.0647 10.8446 10.8446 13.4088 13.4088 13.4339 13.4339 13.5981 13.5981 k = 0.0000 0.4366 0.4169 ( 3920 PWs) bands (ev): -45.9811 -45.9811 -22.6685 -22.6685 -22.0310 -22.0310 -21.9942 -21.9942 0.8060 0.8060 5.8670 5.8670 7.2007 7.2007 7.6258 7.6258 8.4470 8.4470 10.0712 10.0712 10.8660 10.8660 13.4167 13.4167 13.4470 13.4470 13.5680 13.5680 k = 0.0000 0.4248 0.4057 ( 3914 PWs) bands (ev): -45.9815 -45.9815 -22.6672 -22.6672 -22.0303 -22.0303 -21.9920 -21.9920 0.7031 0.7031 5.8991 5.8991 7.2894 7.2894 7.6279 7.6279 8.4436 8.4436 10.0782 10.0782 10.8915 10.8915 13.4232 13.4232 13.4626 13.4626 13.5369 13.5369 k = 0.0000 0.4130 0.3944 ( 3910 PWs) bands (ev): -45.9819 -45.9819 -22.6660 -22.6660 -22.0296 -22.0296 -21.9898 -21.9898 0.6027 0.6027 5.9299 5.9299 7.3803 7.3803 7.6245 7.6245 8.4443 8.4443 10.0856 10.0856 10.9219 10.9219 13.4292 13.4292 13.4789 13.4789 13.5059 13.5059 k = 0.0000 0.4012 0.3831 ( 3918 PWs) bands (ev): -45.9824 -45.9824 -22.6647 -22.6647 -22.0289 -22.0289 -21.9875 -21.9875 0.5048 0.5048 5.9593 5.9593 7.4734 7.4734 7.6156 7.6156 8.4493 8.4493 10.0935 10.0935 10.9576 10.9576 13.4333 13.4333 13.4741 13.4741 13.4983 13.4983 k = 0.0000 0.3894 0.3719 ( 3922 PWs) bands (ev): -45.9828 -45.9828 -22.6635 -22.6635 -22.0282 -22.0282 -21.9852 -21.9852 0.4094 0.4094 5.9872 5.9872 7.5681 7.5681 7.6020 7.6020 8.4586 8.4586 10.1017 10.1017 10.9990 10.9990 13.4246 13.4246 13.4576 13.4576 13.5153 13.5153 k = 0.0000 0.3776 0.3606 ( 3920 PWs) bands (ev): -45.9833 -45.9833 -22.6623 -22.6623 -22.0276 -22.0276 -21.9829 -21.9829 0.3166 0.3166 6.0134 6.0134 7.5815 7.5815 7.6668 7.6668 8.4722 8.4722 10.1104 10.1104 11.0462 11.0462 13.3974 13.3974 13.4596 13.4596 13.5331 13.5331 k = 0.0000 0.3658 0.3493 ( 3920 PWs) bands (ev): -45.9837 -45.9837 -22.6610 -22.6610 -22.0269 -22.0269 -21.9806 -21.9806 0.2263 0.2263 6.0379 6.0379 7.5579 7.5579 7.7661 7.7661 8.4901 8.4901 10.1195 10.1195 11.0991 11.0991 13.3661 13.3661 13.4661 13.4661 13.5511 13.5511 k = 0.0000 0.3540 0.3381 ( 3924 PWs) bands (ev): -45.9842 -45.9842 -22.6598 -22.6598 -22.0262 -22.0262 -21.9783 -21.9783 0.1386 0.1386 6.0605 6.0605 7.5299 7.5299 7.8674 7.8674 8.5122 8.5122 10.1289 10.1289 11.1573 11.1573 13.3346 13.3346 13.4735 13.4735 13.5692 13.5692 k = 0.0000 0.3422 0.3268 ( 3920 PWs) bands (ev): -45.9846 -45.9846 -22.6586 -22.6586 -22.0256 -22.0256 -21.9760 -21.9760 0.0536 0.0536 6.0814 6.0814 7.4983 7.4983 7.9707 7.9707 8.5385 8.5385 10.1387 10.1387 11.2205 11.2205 13.3039 13.3039 13.4811 13.4811 13.5874 13.5874 k = 0.0000 0.3304 0.3155 ( 3908 PWs) bands (ev): -45.9850 -45.9850 -22.6574 -22.6574 -22.0249 -22.0249 -21.9737 -21.9737 -0.0288 -0.0288 6.1004 6.1004 7.4635 7.4635 8.0759 8.0759 8.5689 8.5689 10.1488 10.1488 11.2883 11.2883 13.2744 13.2744 13.4887 13.4887 13.6056 13.6056 k = 0.0000 0.3186 0.3043 ( 3916 PWs) bands (ev): -45.9855 -45.9855 -22.6563 -22.6563 -22.0243 -22.0243 -21.9715 -21.9715 -0.1084 -0.1084 6.1176 6.1176 7.4260 7.4260 8.1827 8.1827 8.6031 8.6031 10.1591 10.1591 11.3601 11.3601 13.2463 13.2463 13.4961 13.4961 13.6240 13.6240 k = 0.0000 0.3068 0.2930 ( 3922 PWs) bands (ev): -45.9859 -45.9859 -22.6551 -22.6551 -22.0236 -22.0236 -21.9692 -21.9692 -0.1854 -0.1854 6.1330 6.1330 7.3864 7.3864 8.2912 8.2912 8.6409 8.6409 10.1697 10.1697 11.4353 11.4353 13.2201 13.2201 13.5033 13.5033 13.6425 13.6425 k = 0.0000 0.2950 0.2817 ( 3930 PWs) bands (ev): -45.9863 -45.9863 -22.6540 -22.6540 -22.0230 -22.0230 -21.9670 -21.9670 -0.2597 -0.2597 6.1467 6.1467 7.3452 7.3452 8.4011 8.4011 8.6822 8.6822 10.1805 10.1805 11.5132 11.5132 13.1960 13.1960 13.5102 13.5102 13.6610 13.6610 k = 0.0000 0.2832 0.2704 ( 3934 PWs) bands (ev): -45.9867 -45.9867 -22.6529 -22.6529 -22.0224 -22.0224 -21.9649 -21.9649 -0.3312 -0.3312 6.1588 6.1588 7.3027 7.3027 8.5123 8.5123 8.7267 8.7267 10.1915 10.1915 11.5933 11.5933 13.1742 13.1742 13.5169 13.5169 13.6798 13.6798 k = 0.0000 0.2714 0.2592 ( 3934 PWs) bands (ev): -45.9871 -45.9871 -22.6518 -22.6518 -22.0218 -22.0218 -21.9627 -21.9627 -0.3999 -0.3999 6.1693 6.1693 7.2595 7.2595 8.6247 8.6247 8.7740 8.7740 10.2026 10.2026 11.6748 11.6748 13.1551 13.1551 13.5233 13.5233 13.6987 13.6987 k = 0.0000 0.2596 0.2479 ( 3930 PWs) bands (ev): -45.9875 -45.9875 -22.6508 -22.6508 -22.0212 -22.0212 -21.9607 -21.9607 -0.4659 -0.4659 6.1785 6.1785 7.2159 7.2159 8.7378 8.7378 8.8240 8.8240 10.2138 10.2138 11.7570 11.7570 13.1388 13.1388 13.5294 13.5294 13.7178 13.7178 k = 0.0000 0.2478 0.2366 ( 3926 PWs) bands (ev): -45.9878 -45.9878 -22.6498 -22.6498 -22.0206 -22.0206 -21.9586 -21.9586 -0.5290 -0.5290 6.1863 6.1863 7.1723 7.1723 8.8501 8.8501 8.8778 8.8778 10.2249 10.2249 11.8392 11.8392 13.1257 13.1257 13.5353 13.5353 13.7372 13.7372 k = 0.0000 0.2360 0.2254 ( 3930 PWs) bands (ev): -45.9882 -45.9882 -22.6488 -22.6488 -22.0200 -22.0200 -21.9567 -21.9567 -0.5893 -0.5893 6.1930 6.1930 7.1290 7.1290 8.9265 8.9265 8.9698 8.9698 10.2361 10.2361 11.9208 11.9208 13.1161 13.1161 13.5410 13.5410 13.7571 13.7571 k = 0.0000 0.2242 0.2141 ( 3924 PWs) bands (ev): -45.9885 -45.9885 -22.6478 -22.6478 -22.0195 -22.0195 -21.9548 -21.9548 -0.6468 -0.6468 6.1986 6.1986 7.0864 7.0864 8.9823 8.9823 9.0841 9.0841 10.2472 10.2472 12.0010 12.0010 13.1100 13.1100 13.5466 13.5466 13.7774 13.7774 k = 0.0000 0.2124 0.2028 ( 3916 PWs) bands (ev): -45.9889 -45.9889 -22.6469 -22.6469 -22.0189 -22.0189 -21.9529 -21.9529 -0.7014 -0.7014 6.2032 6.2032 7.0446 7.0446 9.0382 9.0382 9.1993 9.1993 10.2582 10.2582 12.0791 12.0791 13.1080 13.1080 13.5520 13.5520 13.7983 13.7983 k = 0.0000 0.2006 0.1916 ( 3912 PWs) bands (ev): -45.9892 -45.9892 -22.6461 -22.6461 -22.0184 -22.0184 -21.9511 -21.9511 -0.7532 -0.7532 6.2070 6.2070 7.0040 7.0040 9.0943 9.0943 9.3143 9.3143 10.2690 10.2690 12.1547 12.1547 13.1101 13.1101 13.5573 13.5573 13.8199 13.8199 k = 0.0000 0.1888 0.1803 ( 3910 PWs) bands (ev): -45.9895 -45.9895 -22.6453 -22.6453 -22.0179 -22.0179 -21.9494 -21.9494 -0.8020 -0.8020 6.2100 6.2100 6.9647 6.9647 9.1504 9.1504 9.4287 9.4287 10.2795 10.2795 12.2270 12.2270 13.1168 13.1168 13.5626 13.5626 13.8424 13.8424 k = 0.0000 0.1770 0.1690 ( 3910 PWs) bands (ev): -45.9898 -45.9898 -22.6445 -22.6445 -22.0174 -22.0174 -21.9478 -21.9478 -0.8480 -0.8480 6.2124 6.2124 6.9271 6.9271 9.2061 9.2061 9.5421 9.5421 10.2898 10.2898 12.2956 12.2956 13.1282 13.1282 13.5678 13.5678 13.8661 13.8661 k = 0.0000 0.1652 0.1578 ( 3916 PWs) bands (ev): -45.9900 -45.9900 -22.6437 -22.6437 -22.0170 -22.0170 -21.9463 -21.9463 -0.8911 -0.8911 6.2143 6.2143 6.8911 6.8911 9.2607 9.2607 9.6540 9.6540 10.2997 10.2997 12.3600 12.3600 13.1445 13.1445 13.5730 13.5730 13.8910 13.8910 k = 0.0000 0.1534 0.1465 ( 3916 PWs) bands (ev): -45.9903 -45.9903 -22.6430 -22.6430 -22.0165 -22.0165 -21.9449 -21.9449 -0.9312 -0.9312 6.2157 6.2157 6.8570 6.8570 9.3140 9.3140 9.7638 9.7638 10.3092 10.3092 12.4199 12.4199 13.1661 13.1661 13.5782 13.5782 13.9176 13.9176 k = 0.0000 0.1416 0.1352 ( 3912 PWs) bands (ev): -45.9905 -45.9905 -22.6424 -22.6424 -22.0161 -22.0161 -21.9435 -21.9435 -0.9684 -0.9684 6.2167 6.2167 6.8250 6.8250 9.3655 9.3655 9.8708 9.8708 10.3183 10.3183 12.4750 12.4750 13.1932 13.1932 13.5833 13.5833 13.9460 13.9460 k = 0.0000 0.1298 0.1240 ( 3912 PWs) bands (ev): -45.9908 -45.9908 -22.6418 -22.6418 -22.0158 -22.0158 -21.9423 -21.9423 -1.0027 -1.0027 6.2174 6.2174 6.7951 6.7951 9.4146 9.4146 9.9745 9.9745 10.3269 10.3269 12.5252 12.5252 13.2259 13.2259 13.5883 13.5883 13.9767 13.9767 k = 0.0000 0.1180 0.1127 ( 3912 PWs) bands (ev): -45.9910 -45.9910 -22.6412 -22.6412 -22.0154 -22.0154 -21.9411 -21.9411 -1.0340 -1.0340 6.2178 6.2178 6.7675 6.7675 9.4611 9.4611 10.0740 10.0740 10.3349 10.3349 12.5704 12.5704 13.2643 13.2643 13.5932 13.5933 14.0101 14.0101 k = 0.0000 0.1062 0.1014 ( 3914 PWs) bands (ev): -45.9912 -45.9912 -22.6407 -22.6407 -22.0151 -22.0151 -21.9400 -21.9400 -1.0624 -1.0624 6.2181 6.2181 6.7423 6.7423 9.5044 9.5044 10.1684 10.1684 10.3424 10.3424 12.6106 12.6106 13.3086 13.3086 13.5980 13.5980 14.0465 14.0465 k = 0.0000 0.0944 0.0901 ( 3910 PWs) bands (ev): -45.9913 -45.9913 -22.6403 -22.6403 -22.0148 -22.0148 -21.9391 -21.9391 -1.0878 -1.0878 6.2182 6.2182 6.7195 6.7195 9.5442 9.5442 10.2567 10.2567 10.3492 10.3492 12.6460 12.6460 13.3585 13.3585 13.6025 13.6025 14.0865 14.0865 k = 0.0000 0.0826 0.0789 ( 3910 PWs) bands (ev): -45.9915 -45.9915 -22.6399 -22.6399 -22.0146 -22.0146 -21.9382 -21.9382 -1.1102 -1.1102 6.2182 6.2182 6.6992 6.6992 9.5802 9.5802 10.3374 10.3374 10.3561 10.3561 12.6765 12.6765 13.4141 13.4141 13.6067 13.6067 14.1304 14.1304 k = 0.0000 0.0708 0.0676 ( 3909 PWs) bands (ev): -45.9916 -45.9916 -22.6395 -22.6395 -22.0143 -22.0143 -21.9375 -21.9375 -1.1297 -1.1297 6.2181 6.2181 6.6815 6.6815 9.6120 9.6120 10.3600 10.3600 10.4124 10.4124 12.7025 12.7025 13.4747 13.4747 13.6107 13.6107 14.1787 14.1787 k = 0.0000 0.0590 0.0563 ( 3909 PWs) bands (ev): -45.9917 -45.9917 -22.6392 -22.6392 -22.0141 -22.0141 -21.9369 -21.9369 -1.1461 -1.1461 6.2180 6.2180 6.6665 6.6665 9.6394 9.6394 10.3648 10.3648 10.4767 10.4767 12.7240 12.7240 13.5394 13.5394 13.6145 13.6145 14.2315 14.2315 k = 0.0000 0.0472 0.0451 ( 3913 PWs) bands (ev): -45.9918 -45.9918 -22.6390 -22.6390 -22.0140 -22.0140 -21.9364 -21.9364 -1.1596 -1.1596 6.2179 6.2179 6.6541 6.6541 9.6621 9.6621 10.3686 10.3686 10.5311 10.5311 12.7414 12.7414 13.6028 13.6028 13.6220 13.6220 14.2888 14.2888 k = 0.0000 0.0354 0.0338 ( 3903 PWs) bands (ev): -45.9919 -45.9919 -22.6388 -22.6388 -22.0139 -22.0139 -21.9359 -21.9359 -1.1701 -1.1701 6.2177 6.2177 6.6444 6.6444 9.6800 9.6800 10.3716 10.3716 10.5745 10.5745 12.7547 12.7547 13.6171 13.6171 13.6783 13.6783 14.3493 14.3493 k = 0.0000 0.0236 0.0225 ( 3907 PWs) bands (ev): -45.9919 -45.9919 -22.6387 -22.6387 -22.0138 -22.0138 -21.9357 -21.9357 -1.1776 -1.1776 6.2176 6.2176 6.6375 6.6375 9.6928 9.6928 10.3738 10.3738 10.6062 10.6062 12.7641 12.7641 13.6194 13.6194 13.7409 13.7409 14.4067 14.4067 k = 0.0000 0.0118 0.0113 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9355 -21.9355 -1.1821 -1.1821 6.2176 6.2176 6.6333 6.6333 9.7006 9.7006 10.3751 10.3751 10.6255 10.6255 12.7696 12.7696 13.6206 13.6206 13.7890 13.7890 14.3726 14.3726 k = 0.0000 0.0000 0.0000 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1836 -1.1836 6.2176 6.2176 6.6319 6.6319 9.7032 9.7032 10.3755 10.3755 10.6320 10.6320 12.7715 12.7715 13.6210 13.6210 13.8078 13.8078 14.3480 14.3480 k = 0.0000 0.0000 0.0000 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1836 -1.1836 6.2176 6.2176 6.6319 6.6319 9.7032 9.7032 10.3755 10.3755 10.6320 10.6320 12.7715 12.7715 13.6210 13.6210 13.8078 13.8078 14.3480 14.3480 k = 0.0143 0.0052-0.0054 ( 3903 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1824 -1.1824 6.1645 6.1645 6.6862 6.6862 9.7043 9.7043 10.3748 10.3748 10.6329 10.6329 12.7715 12.7715 13.5804 13.5804 13.8497 13.8497 14.3344 14.3344 k = 0.0286 0.0104-0.0109 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1790 -1.1790 6.0486 6.0486 6.8058 6.8058 9.7077 9.7077 10.3729 10.3729 10.6359 10.6359 12.7716 12.7716 13.5021 13.5021 13.9319 13.9319 14.2954 14.2954 k = 0.0429 0.0156-0.0163 ( 3905 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1734 -1.1734 5.9120 5.9120 6.9485 6.9485 9.7134 9.7134 10.3696 10.3696 10.6408 10.6408 12.7717 12.7717 13.4162 13.4162 14.0243 14.0243 14.2357 14.2357 k = 0.0571 0.0208-0.0218 ( 3907 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0138 -22.0138 -21.9354 -21.9354 -1.1655 -1.1655 5.7688 5.7688 7.1002 7.1002 9.7212 9.7212 10.3650 10.3650 10.6477 10.6477 12.7718 12.7718 13.3295 13.3295 14.1198 14.1198 14.1608 14.1608 k = 0.0714 0.0260-0.0272 ( 3909 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0138 -22.0138 -21.9354 -21.9354 -1.1554 -1.1554 5.6234 5.6234 7.2564 7.2564 9.7314 9.7314 10.3592 10.3592 10.6566 10.6566 12.7719 12.7719 13.2443 13.2443 14.0747 14.0747 14.2168 14.2168 k = 0.0857 0.0312-0.0326 ( 3909 PWs) bands (ev): -45.9920 -45.9920 -22.6387 -22.6387 -22.0139 -22.0139 -21.9354 -21.9354 -1.1431 -1.1431 5.4779 5.4779 7.4150 7.4150 9.7437 9.7437 10.3523 10.3523 10.6674 10.6674 12.7718 12.7718 13.1614 13.1614 13.9814 13.9814 14.2147 14.2147 k = 0.1000 0.0364-0.0381 ( 3909 PWs) bands (ev): -45.9920 -45.9920 -22.6387 -22.6387 -22.0139 -22.0139 -21.9355 -21.9355 -1.1287 -1.1287 5.3332 5.3332 7.5749 7.5749 9.7583 9.7583 10.3443 10.3443 10.6802 10.6802 12.7715 12.7715 13.0819 13.0819 13.8832 13.8832 14.1372 14.1372 k = 0.1143 0.0416-0.0435 ( 3913 PWs) bands (ev): -45.9920 -45.9920 -22.6388 -22.6388 -22.0140 -22.0140 -21.9355 -21.9355 -1.1121 -1.1121 5.1898 5.1898 7.7355 7.7355 9.7751 9.7751 10.3354 10.3354 10.6949 10.6949 12.7704 12.7704 13.0063 13.0063 13.7817 13.7817 14.0559 14.0559 k = 0.1286 0.0467-0.0489 ( 3917 PWs) bands (ev): -45.9920 -45.9920 -22.6388 -22.6388 -22.0141 -22.0141 -21.9355 -21.9355 -1.0936 -1.0936 5.0481 5.0481 7.8962 7.8962 9.7941 9.7941 10.3255 10.3255 10.7116 10.7116 12.7678 12.7678 12.9362 12.9362 13.6782 13.6782 13.9720 13.9720 k = 0.1429 0.0519-0.0544 ( 3921 PWs) bands (ev): -45.9920 -45.9920 -22.6389 -22.6389 -22.0141 -22.0141 -21.9355 -21.9355 -1.0731 -1.0731 4.9084 4.9084 8.0567 8.0567 9.8153 9.8153 10.3149 10.3149 10.7302 10.7302 12.7611 12.7611 12.8744 12.8744 13.5735 13.5735 13.8864 13.8864 k = 0.1571 0.0571-0.0598 ( 3929 PWs) bands (ev): -45.9920 -45.9920 -22.6389 -22.6389 -22.0142 -22.0142 -21.9355 -21.9355 -1.0507 -1.0507 4.7709 4.7709 8.2163 8.2163 9.8387 9.8387 10.3035 10.3035 10.7507 10.7507 12.7429 12.7429 12.8289 12.8289 13.4683 13.4683 13.7996 13.7996 k = 0.1714 0.0623-0.0653 ( 3925 PWs) bands (ev): -45.9919 -45.9919 -22.6390 -22.6390 -22.0143 -22.0143 -21.9355 -21.9355 -1.0264 -1.0264 4.6359 4.6359 8.3747 8.3747 9.8642 9.8642 10.2917 10.2917 10.7731 10.7731 12.7060 12.7060 12.8070 12.8070 13.3629 13.3629 13.7121 13.7121 k = 0.1857 0.0675-0.0707 ( 3925 PWs) bands (ev): -45.9919 -45.9919 -22.6390 -22.6390 -22.0144 -22.0144 -21.9355 -21.9355 -1.0005 -1.0005 4.5035 4.5035 8.5313 8.5313 9.8918 9.8918 10.2793 10.2793 10.7974 10.7974 12.6604 12.6604 12.7993 12.7993 13.2578 13.2578 13.6244 13.6244 k = 0.2000 0.0727-0.0761 ( 3925 PWs) bands (ev): -45.9919 -45.9919 -22.6391 -22.6391 -22.0145 -22.0145 -21.9355 -21.9355 -0.9731 -0.9731 4.3739 4.3739 8.6856 8.6856 9.9215 9.9215 10.2666 10.2666 10.8236 10.8236 12.6158 12.6158 12.7967 12.7967 13.1533 13.1533 13.5366 13.5366 k = 0.2143 0.0779-0.0816 ( 3918 PWs) bands (ev): -45.9919 -45.9919 -22.6392 -22.6392 -22.0146 -22.0146 -21.9355 -21.9355 -0.9441 -0.9441 4.2473 4.2473 8.8369 8.8369 9.9532 9.9532 10.2537 10.2537 10.8516 10.8516 12.5758 12.5758 12.7959 12.7959 13.0495 13.0495 13.4491 13.4491 k = 0.2286 0.0831-0.0870 ( 3914 PWs) bands (ev): -45.9919 -45.9919 -22.6392 -22.6392 -22.0147 -22.0147 -21.9355 -21.9355 -0.9139 -0.9139 4.1239 4.1239 8.9845 8.9845 9.9869 9.9869 10.2407 10.2407 10.8814 10.8814 12.5422 12.5422 12.7960 12.7960 12.9468 12.9468 13.3621 13.3621 k = 0.2429 0.0883-0.0925 ( 3914 PWs) bands (ev): -45.9919 -45.9919 -22.6393 -22.6393 -22.0148 -22.0148 -21.9356 -21.9356 -0.8825 -0.8825 4.0039 4.0039 9.1278 9.1278 10.0226 10.0226 10.2277 10.2277 10.9131 10.9131 12.5158 12.5158 12.7959 12.7959 12.8458 12.8458 13.2756 13.2756 k = 0.2571 0.0935-0.0979 ( 3914 PWs) bands (ev): -45.9919 -45.9919 -22.6394 -22.6394 -22.0149 -22.0149 -21.9356 -21.9356 -0.8501 -0.8501 3.8875 3.8875 9.2657 9.2657 10.0602 10.0602 10.2147 10.2147 10.9464 10.9464 12.4976 12.4976 12.7435 12.7435 12.7987 12.7987 13.1900 13.1900 k = 0.2714 0.0987-0.1033 ( 3914 PWs) bands (ev): -45.9919 -45.9919 -22.6394 -22.6394 -22.0150 -22.0150 -21.9356 -21.9356 -0.8170 -0.8170 3.7750 3.7750 9.3976 9.3976 10.0996 10.0996 10.2020 10.2020 10.9815 10.9815 12.4884 12.4884 12.6451 12.6451 12.7992 12.7992 13.1052 13.1052 k = 0.2857 0.1039-0.1088 ( 3910 PWs) bands (ev): -45.9919 -45.9919 -22.6395 -22.6395 -22.0151 -22.0151 -21.9356 -21.9356 -0.7833 -0.7833 3.6667 3.6667 9.5223 9.5223 10.1407 10.1407 10.1897 10.1897 11.0183 11.0183 12.4889 12.4889 12.5479 12.5479 12.8001 12.8001 13.0216 13.0216 k = 0.3000 0.1091-0.1142 ( 3914 PWs) bands (ev): -45.9919 -45.9919 -22.6396 -22.6396 -22.0152 -22.0152 -21.9356 -21.9356 -0.7494 -0.7494 3.5628 3.5628 9.6391 9.6391 10.1758 10.1758 10.1854 10.1854 11.0567 11.0567 12.4524 12.4524 12.4999 12.4999 12.8011 12.8011 12.9392 12.9392 k = 0.3143 0.1143-0.1197 ( 3918 PWs) bands (ev): -45.9919 -45.9919 -22.6396 -22.6396 -22.0153 -22.0153 -21.9356 -21.9356 -0.7154 -0.7154 3.4636 3.4636 9.7471 9.7471 10.1655 10.1655 10.2284 10.2284 11.0966 11.0966 12.3588 12.3588 12.5216 12.5216 12.8016 12.8016 12.8586 12.8586 k = 0.3286 0.1195-0.1251 ( 3912 PWs) bands (ev): -45.9919 -45.9919 -22.6397 -22.6397 -22.0154 -22.0154 -21.9356 -21.9356 -0.6817 -0.6817 3.3694 3.3694 9.8457 9.8457 10.1546 10.1546 10.2741 10.2741 11.1380 11.1380 12.2673 12.2673 12.5545 12.5545 12.7752 12.7752 12.8064 12.8064 k = 0.3429 0.1247-0.1305 ( 3904 PWs) bands (ev): -45.9919 -45.9919 -22.6398 -22.6398 -22.0155 -22.0155 -21.9356 -21.9356 -0.6486 -0.6486 3.2805 3.2805 9.9343 9.9343 10.1441 10.1441 10.3210 10.3210 11.1808 11.1808 12.1781 12.1781 12.5985 12.5985 12.6987 12.6987 12.8059 12.8059 k = 0.3571 0.1299-0.1360 ( 3896 PWs) bands (ev): -45.9919 -45.9919 -22.6398 -22.6398 -22.0156 -22.0156 -21.9356 -21.9356 -0.6165 -0.6165 3.1975 3.1975 10.0127 10.0127 10.1344 10.1344 10.3689 10.3689 11.2247 11.2247 12.0916 12.0916 12.6222 12.6222 12.6534 12.6534 12.8068 12.8068 k = 0.3714 0.1350-0.1414 ( 3902 PWs) bands (ev): -45.9919 -45.9919 -22.6399 -22.6399 -22.0157 -22.0157 -21.9356 -21.9356 -0.5857 -0.5857 3.1206 3.1206 10.0809 10.0809 10.1254 10.1254 10.4174 10.4174 11.2697 11.2697 12.0080 12.0080 12.5479 12.5479 12.7177 12.7177 12.8078 12.8078 k = 0.3857 0.1402-0.1468 ( 3896 PWs) bands (ev): -45.9919 -45.9919 -22.6399 -22.6399 -22.0158 -22.0158 -21.9356 -21.9356 -0.5567 -0.5567 3.0502 3.0502 10.1172 10.1172 10.1393 10.1393 10.4662 10.4662 11.3154 11.3154 11.9279 11.9279 12.4758 12.4758 12.7901 12.7901 12.8095 12.8095 k = 0.4000 0.1454-0.1523 ( 3894 PWs) bands (ev): -45.9919 -45.9919 -22.6400 -22.6400 -22.0158 -22.0158 -21.9357 -21.9357 -0.5297 -0.5297 2.9867 2.9867 10.1098 10.1098 10.1884 10.1884 10.5146 10.5146 11.3615 11.3615 11.8517 11.8517 12.4063 12.4063 12.8092 12.8092 12.8709 12.8709 k = 0.4143 0.1506-0.1577 ( 3898 PWs) bands (ev): -45.9919 -45.9919 -22.6400 -22.6400 -22.0159 -22.0159 -21.9357 -21.9357 -0.5053 -0.5053 2.9307 2.9307 10.1034 10.1034 10.2289 10.2289 10.5619 10.5619 11.4074 11.4074 11.7804 11.7804 12.3401 12.3401 12.8101 12.8101 12.9546 12.9546 k = 0.4286 0.1558-0.1632 ( 3894 PWs) bands (ev): -45.9919 -45.9919 -22.6400 -22.6400 -22.0159 -22.0159 -21.9357 -21.9357 -0.4839 -0.4839 2.8824 2.8824 10.0978 10.0978 10.2615 10.2615 10.6070 10.6070 11.4524 11.4524 11.7149 11.7149 12.2779 12.2779 12.8108 12.8108 13.0393 13.0393 k = 0.4429 0.1610-0.1686 ( 3888 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4657 -0.4657 2.8423 2.8423 10.0932 10.0932 10.2870 10.2870 10.6485 10.6485 11.4951 11.4951 11.6567 11.6567 12.2211 12.2211 12.8114 12.8114 13.1211 13.1211 k = 0.4571 0.1662-0.1740 ( 3890 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4512 -0.4512 2.8107 2.8107 10.0897 10.0897 10.3060 10.3060 10.6846 10.6846 11.5338 11.5338 11.6076 11.6076 12.1714 12.1714 12.8119 12.8119 13.1948 13.1948 k = 0.4714 0.1714-0.1795 ( 3898 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4406 -0.4406 2.7880 2.7880 10.0871 10.0871 10.3192 10.3192 10.7130 10.7130 11.5653 11.5653 11.5702 11.5702 12.1317 12.1317 12.8122 12.8122 13.2547 13.2547 k = 0.4857 0.1766-0.1849 ( 3898 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4341 -0.4341 2.7742 2.7742 10.0855 10.0855 10.3269 10.3269 10.7313 10.7313 11.5459 11.5459 11.5872 11.5872 12.1054 12.1054 12.8124 12.8124 13.2942 13.2942 k = 0.5000 0.1818-0.1904 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4320 -0.4320 2.7696 2.7696 10.0850 10.0850 10.3294 10.3294 10.7377 10.7377 11.5377 11.5377 11.5949 11.5949 12.0962 12.0962 12.8125 12.8125 13.3081 13.3081 k = 0.5000 0.1818-0.1904 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4320 -0.4320 2.7696 2.7696 10.0850 10.0850 10.3294 10.3294 10.7377 10.7377 11.5377 11.5377 11.5949 11.5949 12.0962 12.0962 12.8125 12.8125 13.3081 13.3081 k = 0.5075 0.1720-0.1801 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0161 -22.0161 -21.9357 -21.9357 -0.4307 -0.4307 2.7710 2.7710 10.0759 10.0759 10.3249 10.3249 10.7443 10.7443 11.5363 11.5363 11.5913 11.5913 12.0925 12.0925 12.8141 12.8141 13.3136 13.3136 k = 0.5150 0.1621-0.1698 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6402 -22.6402 -22.0161 -22.0161 -21.9359 -21.9359 -0.4267 -0.4267 2.7752 2.7752 10.0496 10.0496 10.3113 10.3113 10.7632 10.7632 11.5322 11.5322 11.5810 11.5810 12.0815 12.0815 12.8188 12.8188 13.3298 13.3298 k = 0.5225 0.1523-0.1595 ( 3896 PWs) bands (ev): -45.9918 -45.9918 -22.6404 -22.6404 -22.0162 -22.0162 -21.9363 -21.9363 -0.4202 -0.4202 2.7822 2.7822 10.0088 10.0088 10.2884 10.2884 10.7917 10.7917 11.5252 11.5252 11.5652 11.5652 12.0640 12.0640 12.8256 12.8256 13.3563 13.3563 k = 0.5300 0.1425-0.1492 ( 3894 PWs) bands (ev): -45.9917 -45.9917 -22.6405 -22.6405 -22.0163 -22.0163 -21.9367 -21.9367 -0.4110 -0.4110 2.7919 2.7919 9.9564 9.9564 10.2564 10.2564 10.8270 10.8270 11.5155 11.5155 11.5457 11.5457 12.0406 12.0406 12.8332 12.8332 13.3920 13.3920 k = 0.5375 0.1327-0.1389 ( 3900 PWs) bands (ev): -45.9916 -45.9916 -22.6408 -22.6408 -22.0164 -22.0164 -21.9373 -21.9373 -0.3993 -0.3993 2.8045 2.8045 9.8953 9.8953 10.2153 10.2153 10.8666 10.8666 11.5029 11.5029 11.5243 11.5243 12.0125 12.0125 12.8403 12.8403 13.4359 13.4359 k = 0.5449 0.1228-0.1286 ( 3902 PWs) bands (ev): -45.9915 -45.9915 -22.6411 -22.6411 -22.0166 -22.0166 -21.9380 -21.9380 -0.3849 -0.3849 2.8198 2.8198 9.8274 9.8274 10.1651 10.1651 10.9087 10.9087 11.4874 11.4874 11.5030 11.5030 11.9807 11.9807 12.8456 12.8456 13.4869 13.4869 k = 0.5524 0.1130-0.1183 ( 3902 PWs) bands (ev): -45.9914 -45.9914 -22.6415 -22.6415 -22.0168 -22.0168 -21.9388 -21.9388 -0.3679 -0.3679 2.8378 2.8378 9.7542 9.7542 10.1063 10.1063 10.9520 10.9520 11.4693 11.4693 11.4830 11.4830 11.9460 11.9460 12.8482 12.8482 13.5441 13.5441 k = 0.5599 0.1032-0.1080 ( 3906 PWs) bands (ev): -45.9912 -45.9912 -22.6419 -22.6419 -22.0170 -22.0170 -21.9398 -21.9398 -0.3483 -0.3483 2.8585 2.8585 9.6770 9.6770 10.0394 10.0394 10.9958 10.9958 11.4492 11.4492 11.4647 11.4647 11.9093 11.9093 12.8475 12.8475 13.6064 13.6064 k = 0.5674 0.0933-0.0977 ( 3902 PWs) bands (ev): -45.9910 -45.9910 -22.6423 -22.6423 -22.0173 -22.0173 -21.9408 -21.9408 -0.3260 -0.3260 2.8819 2.8819 9.5965 9.5965 9.9652 9.9652 11.0395 11.0395 11.4272 11.4272 11.4488 11.4488 11.8713 11.8713 12.8431 12.8431 13.6730 13.6730 k = 0.5749 0.0835-0.0875 ( 3896 PWs) bands (ev): -45.9908 -45.9908 -22.6428 -22.6428 -22.0175 -22.0175 -21.9420 -21.9420 -0.3012 -0.3012 2.9079 2.9079 9.5134 9.5134 9.8844 9.8844 11.0828 11.0828 11.4030 11.4030 11.4359 11.4359 11.8326 11.8326 12.8350 12.8350 13.7432 13.7432 k = 0.5824 0.0737-0.0772 ( 3888 PWs) bands (ev): -45.9906 -45.9906 -22.6434 -22.6434 -22.0178 -22.0178 -21.9433 -21.9433 -0.2737 -0.2737 2.9365 2.9365 9.4283 9.4283 9.7981 9.7981 11.1256 11.1256 11.3765 11.3765 11.4264 11.4264 11.7937 11.7937 12.8231 12.8231 13.8162 13.8162 k = 0.5899 0.0639-0.0669 ( 3884 PWs) bands (ev): -45.9903 -45.9903 -22.6440 -22.6440 -22.0182 -22.0182 -21.9447 -21.9447 -0.2436 -0.2436 2.9676 2.9676 9.3416 9.3416 9.7072 9.7072 11.1678 11.1678 11.3477 11.3477 11.4201 11.4201 11.7549 11.7549 12.8077 12.8077 13.8913 13.8913 k = 0.5974 0.0540-0.0566 ( 3902 PWs) bands (ev): -45.9901 -45.9901 -22.6447 -22.6447 -22.0185 -22.0185 -21.9462 -21.9462 -0.2109 -0.2109 3.0013 3.0013 9.2537 9.2537 9.6126 9.6126 11.2093 11.2093 11.3169 11.3169 11.4165 11.4165 11.7167 11.7167 12.7890 12.7890 13.9680 13.9680 k = 0.6049 0.0442-0.0463 ( 3898 PWs) bands (ev): -45.9898 -45.9898 -22.6454 -22.6454 -22.0189 -22.0189 -21.9478 -21.9478 -0.1756 -0.1756 3.0373 3.0373 9.1649 9.1649 9.5150 9.5150 11.2498 11.2498 11.2845 11.2845 11.4154 11.4154 11.6792 11.6792 12.7673 12.7673 14.0453 14.0453 k = 0.6124 0.0344-0.0360 ( 3902 PWs) bands (ev): -45.9895 -45.9895 -22.6461 -22.6461 -22.0193 -22.0193 -21.9495 -21.9495 -0.1377 -0.1377 3.0758 3.0758 9.0754 9.0754 9.4154 9.4154 11.2484 11.2484 11.2917 11.2917 11.4162 11.4162 11.6427 11.6427 12.7431 12.7431 14.1225 14.1225 k = 0.6199 0.0246-0.0257 ( 3902 PWs) bands (ev): -45.9892 -45.9892 -22.6469 -22.6469 -22.0197 -22.0197 -21.9513 -21.9513 -0.0972 -0.0972 3.1165 3.1165 8.9856 8.9856 9.3144 9.3144 11.2125 11.2125 11.3312 11.3312 11.4186 11.4186 11.6074 11.6074 12.7168 12.7168 14.1983 14.1983 k = 0.6273 0.0147-0.0154 ( 3906 PWs) bands (ev): -45.9888 -45.9888 -22.6478 -22.6478 -22.0201 -22.0201 -21.9532 -21.9532 -0.0540 -0.0540 3.1595 3.1595 8.8957 8.8957 9.2125 9.2125 11.1746 11.1746 11.3701 11.3701 11.4224 11.4224 11.5734 11.5734 12.6889 12.6889 14.2712 14.2712 k = 0.6348 0.0049-0.0051 ( 3906 PWs) bands (ev): -45.9885 -45.9885 -22.6487 -22.6487 -22.0206 -22.0206 -21.9551 -21.9551 -0.0083 -0.0083 3.2046 3.2046 8.8058 8.8058 9.1105 9.1105 11.1353 11.1353 11.4057 11.4057 11.4297 11.4297 11.5410 11.5410 12.6598 12.6598 14.3390 14.3390 k = 0.6423-0.0049 0.0052 ( 3906 PWs) bands (ev): -45.9881 -45.9881 -22.6496 -22.6496 -22.0210 -22.0210 -21.9572 -21.9572 0.0401 0.0401 3.2517 3.2517 8.7162 8.7162 9.0086 9.0086 11.0946 11.0946 11.4222 11.4222 11.4551 11.4551 11.5108 11.5108 12.6301 12.6301 14.3982 14.3982 k = 0.6498-0.0148 0.0155 ( 3898 PWs) bands (ev): -45.9877 -45.9877 -22.6506 -22.6506 -22.0215 -22.0215 -21.9593 -21.9593 0.0910 0.0910 3.3008 3.3008 8.6270 8.6270 8.9075 8.9075 11.0528 11.0528 11.4254 11.4254 11.4781 11.4781 11.4971 11.4971 12.6005 12.6005 14.4435 14.4435 k = 0.6573-0.0246 0.0257 ( 3898 PWs) bands (ev): -45.9873 -45.9873 -22.6516 -22.6516 -22.0220 -22.0220 -21.9615 -21.9615 0.1446 0.1446 3.3517 3.3517 8.5384 8.5384 8.8075 8.8075 11.0100 11.0100 11.4226 11.4226 11.4571 11.4571 11.5337 11.5337 12.5715 12.5715 14.4667 14.4667 k = 0.6648-0.0344 0.0360 ( 3894 PWs) bands (ev): -45.9869 -45.9869 -22.6526 -22.6526 -22.0225 -22.0225 -21.9637 -21.9637 0.2008 0.2008 3.4043 3.4043 8.4505 8.4505 8.7089 8.7089 10.9662 10.9662 11.4092 11.4092 11.4434 11.4434 11.5732 11.5732 12.5439 12.5439 14.4564 14.4564 k = 0.6723-0.0442 0.0463 ( 3890 PWs) bands (ev): -45.9865 -45.9865 -22.6537 -22.6537 -22.0230 -22.0230 -21.9660 -21.9660 0.2596 0.2596 3.4584 3.4584 8.3635 8.3635 8.6121 8.6121 10.9216 10.9216 11.3878 11.3878 11.4363 11.4363 11.6134 11.6134 12.5183 12.5183 14.4022 14.4022 k = 0.6798-0.0541 0.0566 ( 3890 PWs) bands (ev): -45.9861 -45.9861 -22.6548 -22.6548 -22.0235 -22.0235 -21.9683 -21.9683 0.3210 0.3210 3.5140 3.5140 8.2775 8.2775 8.5174 8.5174 10.8764 10.8764 11.3645 11.3645 11.4290 11.4290 11.6540 11.6540 12.4954 12.4954 14.3015 14.3015 k = 0.6873-0.0639 0.0669 ( 3898 PWs) bands (ev): -45.9857 -45.9857 -22.6559 -22.6559 -22.0241 -22.0241 -21.9707 -21.9707 0.3850 0.3850 3.5708 3.5708 8.1925 8.1925 8.4251 8.4251 10.8306 10.8306 11.3414 11.3414 11.4189 11.4189 11.6952 11.6952 12.4759 12.4759 14.1621 14.1621 k = 0.6948-0.0737 0.0772 ( 3902 PWs) bands (ev): -45.9852 -45.9852 -22.6571 -22.6571 -22.0246 -22.0246 -21.9732 -21.9732 0.4516 0.4516 3.6287 3.6287 8.1087 8.1087 8.3355 8.3355 10.7844 10.7844 11.3187 11.3187 11.4051 11.4051 11.7368 11.7368 12.4603 12.4603 13.9960 13.9960 k = 0.7023-0.0835 0.0875 ( 3898 PWs) bands (ev): -45.9848 -45.9848 -22.6583 -22.6583 -22.0252 -22.0252 -21.9756 -21.9756 0.5208 0.5208 3.6875 3.6875 8.0262 8.0262 8.2488 8.2488 10.7380 10.7380 11.2963 11.2963 11.3871 11.3871 11.7791 11.7791 12.4490 12.4490 13.8133 13.8133 k = 0.7097-0.0934 0.0978 ( 3898 PWs) bands (ev): -45.9843 -45.9843 -22.6595 -22.6595 -22.0257 -22.0257 -21.9781 -21.9781 0.5926 0.5926 3.7470 3.7470 7.9451 7.9451 8.1654 8.1654 10.6913 10.6913 11.2739 11.2739 11.3646 11.3646 11.8220 11.8220 12.4424 12.4424 13.6211 13.6211 k = 0.7172-0.1032 0.1081 ( 3902 PWs) bands (ev): -45.9839 -45.9839 -22.6607 -22.6607 -22.0263 -22.0263 -21.9806 -21.9806 0.6670 0.6670 3.8068 3.8068 7.8654 7.8654 8.0855 8.0855 10.6446 10.6446 11.2509 11.2509 11.3376 11.3376 11.8657 11.8657 12.4404 12.4404 13.4240 13.4240 k = 0.7247-0.1130 0.1184 ( 3906 PWs) bands (ev): -45.9834 -45.9834 -22.6620 -22.6620 -22.0269 -22.0269 -21.9831 -21.9831 0.7440 0.7440 3.8669 3.8669 7.7872 7.7872 8.0094 8.0094 10.5980 10.5980 11.2265 11.2265 11.3064 11.3064 11.9100 11.9100 12.4429 12.4429 13.2256 13.2256 k = 0.7322-0.1229 0.1286 ( 3910 PWs) bands (ev): -45.9829 -45.9829 -22.6632 -22.6632 -22.0275 -22.0275 -21.9856 -21.9856 0.8236 0.8236 3.9269 3.9269 7.7106 7.7106 7.9374 7.9374 10.5514 10.5514 11.1996 11.1996 11.2711 11.2711 11.9551 11.9551 12.4498 12.4498 13.0288 13.0288 k = 0.7397-0.1327 0.1389 ( 3898 PWs) bands (ev): -45.9824 -45.9824 -22.6645 -22.6645 -22.0281 -22.0281 -21.9881 -21.9881 0.9057 0.9057 3.9866 3.9866 7.6356 7.6356 7.8697 7.8697 10.5052 10.5052 11.1686 11.1686 11.2322 11.2322 12.0010 12.0010 12.4606 12.4606 12.8362 12.8362 k = 0.7472-0.1425 0.1492 ( 3902 PWs) bands (ev): -45.9820 -45.9820 -22.6658 -22.6658 -22.0287 -22.0287 -21.9905 -21.9905 0.9905 0.9905 4.0456 4.0456 7.5624 7.5624 7.8066 7.8066 10.4592 10.4592 11.1316 11.1316 11.1900 11.1900 12.0477 12.0477 12.4749 12.4749 12.6509 12.6509 k = 0.7547-0.1523 0.1595 ( 3902 PWs) bands (ev): -45.9815 -45.9815 -22.6671 -22.6671 -22.0293 -22.0293 -21.9930 -21.9930 1.0778 1.0778 4.1036 4.1036 7.4908 7.4908 7.7486 7.7486 10.4138 10.4138 11.0856 11.0856 11.1449 11.1449 12.0952 12.0952 12.4764 12.4764 12.4925 12.4925 k = 0.7622-0.1622 0.1698 ( 3908 PWs) bands (ev): -45.9810 -45.9810 -22.6684 -22.6684 -22.0299 -22.0299 -21.9954 -21.9954 1.1677 1.1677 4.1602 4.1602 7.4211 7.4211 7.6957 7.6957 10.3688 10.3688 11.0270 11.0270 11.0973 11.0973 12.1435 12.1435 12.3172 12.3172 12.5125 12.5125 k = 0.7697-0.1720 0.1801 ( 3908 PWs) bands (ev): -45.9805 -45.9805 -22.6697 -22.6697 -22.0306 -22.0306 -21.9978 -21.9978 1.2602 1.2602 4.2152 4.2152 7.3532 7.3532 7.6485 7.6485 10.3245 10.3245 10.9515 10.9515 11.0479 11.0479 12.1764 12.1764 12.1937 12.1937 12.5348 12.5348 k = 0.7772-0.1818 0.1904 ( 3912 PWs) bands (ev): -45.9801 -45.9801 -22.6710 -22.6710 -22.0312 -22.0312 -22.0001 -22.0001 1.3553 1.3553 4.2681 4.2681 7.2871 7.2871 7.6070 7.6070 10.2808 10.2808 10.8552 10.8552 10.9976 10.9976 12.0606 12.0606 12.2430 12.2430 12.5589 12.5589 k = 0.7847-0.1917 0.2007 ( 3908 PWs) bands (ev): -45.9796 -45.9796 -22.6723 -22.6723 -22.0319 -22.0319 -22.0024 -22.0024 1.4529 1.4529 4.3186 4.3186 7.2230 7.2230 7.5717 7.5717 10.2380 10.2380 10.7367 10.7367 10.9466 10.9466 11.9692 11.9692 12.2938 12.2938 12.5845 12.5845 k = 0.7921-0.2015 0.2110 ( 3900 PWs) bands (ev): -45.9792 -45.9792 -22.6735 -22.6735 -22.0326 -22.0326 -22.0046 -22.0046 1.5530 1.5530 4.3664 4.3664 7.1608 7.1608 7.5427 7.5427 10.1960 10.1960 10.5971 10.5971 10.8953 10.8953 11.9018 11.9018 12.3456 12.3456 12.6112 12.6112 k = 0.7996-0.2113 0.2213 ( 3910 PWs) bands (ev): -45.9787 -45.9787 -22.6748 -22.6748 -22.0333 -22.0333 -22.0067 -22.0067 1.6557 1.6557 4.4112 4.4112 7.1006 7.1006 7.5203 7.5203 10.1549 10.1549 10.4397 10.4397 10.8440 10.8440 11.8556 11.8556 12.3981 12.3981 12.6386 12.6386 k = 0.8071-0.2211 0.2315 ( 3922 PWs) bands (ev): -45.9782 -45.9782 -22.6760 -22.6760 -22.0341 -22.0341 -22.0088 -22.0088 1.7610 1.7610 4.4526 4.4526 7.0424 7.0424 7.5045 7.5045 10.1148 10.1148 10.2683 10.2683 10.7929 10.7929 11.8268 11.8268 12.4514 12.4514 12.6666 12.6666 k = 0.8146-0.2310 0.2418 ( 3914 PWs) bands (ev): -45.9778 -45.9778 -22.6773 -22.6773 -22.0349 -22.0349 -22.0107 -22.0107 1.8688 1.8688 4.4904 4.4904 6.9862 6.9862 7.4957 7.4957 10.0757 10.0757 10.0869 10.0869 10.7422 10.7422 11.8118 11.8118 12.5055 12.5055 12.6948 12.6948 k = 0.8221-0.2408 0.2521 ( 3910 PWs) bands (ev): -45.9774 -45.9774 -22.6785 -22.6785 -22.0358 -22.0358 -22.0126 -22.0126 1.9791 1.9791 4.5245 4.5245 6.9321 6.9321 7.4936 7.4936 9.8981 9.8981 10.0379 10.0379 10.6922 10.6922 11.8077 11.8077 12.5603 12.5603 12.7229 12.7229 k = 0.8296-0.2506 0.2624 ( 3914 PWs) bands (ev): -45.9770 -45.9770 -22.6797 -22.6797 -22.0366 -22.0366 -22.0143 -22.0143 2.0919 2.0919 4.5548 4.5548 6.8801 6.8801 7.4983 7.4983 9.7045 9.7045 10.0011 10.0011 10.6430 10.6430 11.8124 11.8124 12.6157 12.6157 12.7508 12.7508 k = 0.8371-0.2604 0.2727 ( 3908 PWs) bands (ev): -45.9765 -45.9765 -22.6808 -22.6808 -22.0376 -22.0376 -22.0159 -22.0159 2.2073 2.2073 4.5812 4.5812 6.8302 6.8302 7.5096 7.5096 9.5077 9.5077 9.9656 9.9656 10.5950 10.5950 11.8242 11.8242 12.6717 12.6717 12.7783 12.7783 k = 0.8446-0.2703 0.2830 ( 3904 PWs) bands (ev): -45.9761 -45.9761 -22.6820 -22.6820 -22.0385 -22.0385 -22.0174 -22.0174 2.3251 2.3251 4.6037 4.6037 6.7824 6.7824 7.5272 7.5272 9.3089 9.3089 9.9313 9.9313 10.5481 10.5481 11.8420 11.8420 12.7281 12.7281 12.8051 12.8051 k = 0.8521-0.2801 0.2933 ( 3904 PWs) bands (ev): -45.9758 -45.9758 -22.6831 -22.6831 -22.0396 -22.0396 -22.0187 -22.0187 2.4454 2.4454 4.6225 4.6225 6.7367 6.7367 7.5507 7.5507 9.1091 9.1091 9.8984 9.8984 10.5026 10.5026 11.8650 11.8650 12.7848 12.7848 12.8313 12.8313 k = 0.8596-0.2899 0.3036 ( 3904 PWs) bands (ev): -45.9754 -45.9754 -22.6841 -22.6841 -22.0406 -22.0406 -22.0199 -22.0199 2.5681 2.5681 4.6378 4.6378 6.6933 6.6933 7.5799 7.5799 8.9089 8.9089 9.8668 9.8668 10.4586 10.4586 11.8926 11.8926 12.8409 12.8409 12.8574 12.8574 k = 0.8670-0.2998 0.3139 ( 3908 PWs) bands (ev): -45.9750 -45.9750 -22.6851 -22.6851 -22.0417 -22.0417 -22.0211 -22.0211 2.6933 2.6933 4.6498 4.6498 6.6520 6.6520 7.6139 7.6139 8.7088 8.7088 9.8366 9.8366 10.4162 10.4162 11.9242 11.9242 12.8781 12.8781 12.9014 12.9014 k = 0.8745-0.3096 0.3242 ( 3916 PWs) bands (ev): -45.9747 -45.9747 -22.6861 -22.6861 -22.0428 -22.0428 -22.0221 -22.0221 2.8210 2.8210 4.6587 4.6587 6.6128 6.6128 7.6524 7.6524 8.5093 8.5093 9.8079 9.8079 10.3756 10.3756 11.9596 11.9596 12.9012 12.9012 12.9582 12.9582 k = 0.8820-0.3194 0.3345 ( 3914 PWs) bands (ev): -45.9744 -45.9744 -22.6871 -22.6871 -22.0439 -22.0439 -22.0229 -22.0229 2.9510 2.9510 4.6650 4.6650 6.5759 6.5759 7.6946 7.6946 8.3107 8.3107 9.7807 9.7807 10.3368 10.3368 11.9984 11.9984 12.9223 12.9223 13.0154 13.0154 k = 0.8895-0.3292 0.3447 ( 3916 PWs) bands (ev): -45.9740 -45.9740 -22.6880 -22.6880 -22.0449 -22.0449 -22.0237 -22.0237 3.0833 3.0833 4.6689 4.6689 6.5412 6.5412 7.7398 7.7398 8.1132 8.1132 9.7550 9.7550 10.2999 10.2999 12.0405 12.0405 12.9418 12.9418 13.0723 13.0723 k = 0.8970-0.3391 0.3550 ( 3904 PWs) bands (ev): -45.9738 -45.9738 -22.6888 -22.6888 -22.0460 -22.0460 -22.0244 -22.0244 3.2180 3.2180 4.6709 4.6709 6.5088 6.5088 7.7870 7.7870 7.9173 7.9173 9.7308 9.7308 10.2650 10.2650 12.0857 12.0857 12.9595 12.9595 13.1288 13.1288 k = 0.9045-0.3489 0.3653 ( 3896 PWs) bands (ev): -45.9735 -45.9735 -22.6896 -22.6896 -22.0470 -22.0470 -22.0251 -22.0251 3.3549 3.3549 4.6711 4.6711 6.4785 6.4785 7.7222 7.7222 7.8365 7.8365 9.7083 9.7083 10.2322 10.2322 12.1338 12.1338 12.9755 12.9755 13.1844 13.1844 k = 0.9120-0.3587 0.3756 ( 3900 PWs) bands (ev): -45.9732 -45.9732 -22.6903 -22.6903 -22.0480 -22.0480 -22.0256 -22.0256 3.4940 3.4940 4.6700 4.6700 6.4505 6.4505 7.5297 7.5297 7.8859 7.8859 9.6873 9.6873 10.2015 10.2015 12.1847 12.1847 12.9897 12.9897 13.2389 13.2389 k = 0.9195-0.3685 0.3859 ( 3892 PWs) bands (ev): -45.9730 -45.9730 -22.6910 -22.6910 -22.0490 -22.0490 -22.0261 -22.0261 3.6353 3.6353 4.6679 4.6679 6.4248 6.4248 7.3390 7.3390 7.9353 7.9353 9.6679 9.6679 10.1730 10.1730 12.2383 12.2383 13.0020 13.0020 13.2919 13.2919 k = 0.9270-0.3784 0.3962 ( 3898 PWs) bands (ev): -45.9728 -45.9728 -22.6917 -22.6917 -22.0499 -22.0499 -22.0265 -22.0265 3.7785 3.7785 4.6650 4.6650 6.4013 6.4013 7.1505 7.1505 7.9837 7.9837 9.6502 9.6502 10.1468 10.1468 12.2945 12.2945 13.0126 13.0126 13.3430 13.3430 k = 0.9345-0.3882 0.4065 ( 3906 PWs) bands (ev): -45.9726 -45.9726 -22.6922 -22.6922 -22.0507 -22.0507 -22.0269 -22.0269 3.9235 3.9235 4.6617 4.6617 6.3801 6.3801 6.9644 6.9644 8.0305 8.0305 9.6342 9.6342 10.1229 10.1229 12.3532 12.3532 13.0214 13.0214 13.3917 13.3917 k = 0.9420-0.3980 0.4168 ( 3904 PWs) bands (ev): -45.9724 -45.9724 -22.6928 -22.6928 -22.0514 -22.0514 -22.0272 -22.0272 4.0702 4.0702 4.6581 4.6581 6.3612 6.3612 6.7810 6.7810 8.0746 8.0746 9.6199 9.6199 10.1015 10.1015 12.4143 12.4143 13.0285 13.0285 13.4375 13.4375 k = 0.9494-0.4079 0.4271 ( 3912 PWs) bands (ev): -45.9722 -45.9722 -22.6932 -22.6932 -22.0521 -22.0521 -22.0274 -22.0274 4.2180 4.2180 4.6545 4.6545 6.3446 6.3446 6.6008 6.6008 8.1155 8.1155 9.6072 9.6072 10.0824 10.0824 12.4776 12.4776 13.0341 13.0341 13.4797 13.4797 k = 0.9569-0.4177 0.4374 ( 3916 PWs) bands (ev): -45.9721 -45.9721 -22.6936 -22.6936 -22.0527 -22.0527 -22.0277 -22.0277 4.3664 4.3664 4.6510 4.6510 6.3302 6.3302 6.4244 6.4244 8.1524 8.1524 9.5963 9.5963 10.0659 10.0659 12.5430 12.5430 13.0384 13.0384 13.4827 13.4827 k = 0.9644-0.4275 0.4476 ( 3924 PWs) bands (ev): -45.9720 -45.9720 -22.6940 -22.6940 -22.0532 -22.0532 -22.0279 -22.0279 4.5145 4.5145 4.6479 4.6479 6.2527 6.2527 6.3182 6.3182 8.1845 8.1845 9.5871 9.5871 10.0519 10.0519 12.6103 12.6103 13.0415 13.0415 13.3947 13.3947 k = 0.9719-0.4373 0.4579 ( 3928 PWs) bands (ev): -45.9719 -45.9719 -22.6942 -22.6942 -22.0536 -22.0536 -22.0280 -22.0280 4.6452 4.6452 4.6602 4.6602 6.0879 6.0879 6.3084 6.3084 8.2114 8.2114 9.5797 9.5797 10.0405 10.0405 12.6789 12.6789 13.0436 13.0436 13.3086 13.3086 k = 0.9719-0.4373 0.4579 ( 3928 PWs) bands (ev): -45.9719 -45.9719 -22.6942 -22.6942 -22.0536 -22.0536 -22.0280 -22.0280 4.6452 4.6452 4.6602 4.6602 6.0879 6.0879 6.3084 6.3084 8.2114 8.2114 9.5797 9.5797 10.0405 10.0405 12.6789 12.6789 13.0436 13.0436 13.3086 13.3086 k = 0.9628-0.4465 0.4676 ( 3924 PWs) bands (ev): -45.9718 -45.9718 -22.6943 -22.6943 -22.0538 -22.0538 -22.0281 -22.0281 4.6304 4.6304 4.7404 4.7404 6.0139 6.0139 6.3041 6.3041 8.2246 8.2246 9.5783 9.5783 10.0350 10.0350 12.6829 12.6829 13.0502 13.0502 13.2934 13.2934 k = 0.9536-0.4558 0.4772 ( 3920 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0539 -22.0539 -22.0281 -22.0281 4.6140 4.6140 4.8203 4.8203 5.9430 5.9430 6.2991 6.2991 8.2415 8.2415 9.5803 9.5803 10.0281 10.0281 12.6325 12.6325 13.0651 13.0651 13.3279 13.3280 k = 0.9445-0.4650 0.4869 ( 3920 PWs) bands (ev): -45.9718 -45.9718 -22.6945 -22.6945 -22.0540 -22.0540 -22.0281 -22.0281 4.5974 4.5974 4.8971 4.8971 5.8765 5.8765 6.2936 6.2936 8.2619 8.2619 9.5857 9.5857 10.0199 10.0199 12.5455 12.5455 13.0820 13.0820 13.4007 13.4007 k = 0.9353-0.4742 0.4965 ( 3922 PWs) bands (ev): -45.9718 -45.9718 -22.6946 -22.6946 -22.0541 -22.0541 -22.0282 -22.0282 4.5801 4.5801 4.9699 4.9699 5.8161 5.8161 6.2874 6.2874 8.2857 8.2857 9.5945 9.5945 10.0105 10.0105 12.4395 12.4395 13.1003 13.1003 13.4946 13.4946 k = 0.9261-0.4834 0.5062 ( 3916 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.5614 4.5614 5.0371 5.0371 5.7641 5.7641 6.2808 6.2808 8.3125 8.3125 9.6065 9.6065 10.0000 10.0000 12.3243 12.3243 13.1214 13.1214 13.5969 13.5970 k = 0.9170-0.4926 0.5158 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0542 -22.0542 -22.0282 -22.0282 4.5406 4.5406 5.0967 5.0967 5.7235 5.7235 6.2736 6.2736 8.3419 8.3419 9.6219 9.6219 9.9886 9.9886 12.2050 12.2050 13.1459 13.1459 13.6253 13.6253 k = 0.9078-0.5018 0.5254 ( 3910 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.5166 4.5166 5.1459 5.1459 5.6979 5.6979 6.2661 6.2661 8.3737 8.3737 9.6404 9.6404 9.9763 9.9763 12.0848 12.0848 13.1741 13.1741 13.6282 13.6282 k = 0.8987-0.5110 0.5351 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4886 4.4886 5.1823 5.1823 5.6909 5.6909 6.2581 6.2581 8.4073 8.4073 9.6620 9.6620 9.9630 9.9630 11.9659 11.9659 13.2058 13.2058 13.6292 13.6292 k = 0.8987-0.5110 0.5351 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4886 4.4886 5.1823 5.1823 5.6909 5.6909 6.2581 6.2581 8.4073 8.4073 9.6620 9.6620 9.9630 9.9630 11.9659 11.9659 13.2058 13.2058 13.6292 13.6292 k = 0.8858-0.5106 0.5449 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4564 4.4564 5.2111 5.2111 5.6944 5.6944 6.2520 6.2520 8.4446 8.4446 9.6860 9.6860 9.9483 9.9483 11.8486 11.8486 13.2413 13.2413 13.6299 13.6299 k = 0.8730-0.5101 0.5547 ( 3911 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.4221 4.4221 5.2360 5.2360 5.6987 5.6987 6.2511 6.2511 8.4862 8.4862 9.7108 9.7108 9.9326 9.9326 11.7369 11.7369 13.2795 13.2795 13.6320 13.6320 k = 0.8601-0.5097 0.5645 ( 3910 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.3865 4.3865 5.2549 5.2549 5.7038 5.7038 6.2569 6.2569 8.5310 8.5310 9.7356 9.7356 9.9158 9.9158 11.6320 11.6320 13.3191 13.3191 13.6366 13.6366 k = 0.8472-0.5092 0.5743 ( 3908 PWs) bands (ev): -45.9718 -45.9718 -22.6946 -22.6946 -22.0541 -22.0541 -22.0282 -22.0282 4.3504 4.3504 5.2664 5.2664 5.7097 5.7097 6.2711 6.2711 8.5778 8.5778 9.7599 9.7599 9.8983 9.8983 11.5352 11.5352 13.3583 13.3583 13.6456 13.6456 k = 0.8344-0.5088 0.5840 ( 3911 PWs) bands (ev): -45.9718 -45.9718 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 4.3143 4.3143 5.2694 5.2694 5.7163 5.7163 6.2944 6.2944 8.6254 8.6254 9.7827 9.7827 9.8803 9.8803 11.4481 11.4481 13.3941 13.3941 13.6615 13.6615 k = 0.8215-0.5083 0.5938 ( 3907 PWs) bands (ev): -45.9718 -45.9718 -22.6945 -22.6945 -22.0540 -22.0540 -22.0281 -22.0281 4.2787 4.2787 5.2636 5.2636 5.7237 5.7237 6.3272 6.3272 8.6724 8.6724 9.8030 9.8030 9.8620 9.8620 11.3724 11.3724 13.4233 13.4233 13.6875 13.6875 k = 0.8087-0.5079 0.6036 ( 3907 PWs) bands (ev): -45.9718 -45.9718 -22.6944 -22.6944 -22.0539 -22.0539 -22.0280 -22.0280 4.2438 4.2438 5.2493 5.2493 5.7317 5.7317 6.3693 6.3693 8.7173 8.7173 9.8199 9.8199 9.8439 9.8439 11.3099 11.3099 13.4437 13.4437 13.7255 13.7255 k = 0.7958-0.5074 0.6134 ( 3905 PWs) bands (ev): -45.9718 -45.9718 -22.6943 -22.6943 -22.0538 -22.0538 -22.0280 -22.0280 4.2100 4.2100 5.2274 5.2274 5.7403 5.7403 6.4199 6.4199 8.7586 8.7586 9.8230 9.8230 9.8360 9.8360 11.2620 11.2620 13.4551 13.4551 13.7756 13.7756 k = 0.7829-0.5070 0.6232 ( 3905 PWs) bands (ev): -45.9719 -45.9719 -22.6942 -22.6942 -22.0536 -22.0536 -22.0279 -22.0279 4.1775 4.1775 5.1987 5.1987 5.7495 5.7495 6.4781 6.4781 8.7945 8.7945 9.8057 9.8057 9.8452 9.8452 11.2298 11.2298 13.4592 13.4592 13.8360 13.8360 k = 0.7701-0.5065 0.6330 ( 3901 PWs) bands (ev): -45.9719 -45.9719 -22.6941 -22.6941 -22.0535 -22.0535 -22.0278 -22.0278 4.1464 4.1464 5.1644 5.1644 5.7593 5.7593 6.5429 6.5429 8.8230 8.8230 9.7880 9.7880 9.8530 9.8530 11.2137 11.2137 13.4580 13.4580 13.9044 13.9044 k = 0.7572-0.5061 0.6428 ( 3897 PWs) bands (ev): -45.9719 -45.9719 -22.6940 -22.6940 -22.0533 -22.0533 -22.0278 -22.0278 4.1170 4.1170 5.1254 5.1254 5.7697 5.7697 6.6132 6.6132 8.8424 8.8424 9.7706 9.7706 9.8602 9.8602 11.2131 11.2131 13.4529 13.4529 13.9792 13.9792 k = 0.7444-0.5056 0.6526 ( 3905 PWs) bands (ev): -45.9720 -45.9720 -22.6939 -22.6939 -22.0532 -22.0532 -22.0277 -22.0277 4.0892 4.0892 5.0826 5.0826 5.7805 5.7805 6.6881 6.6881 8.8510 8.8510 9.7540 9.7540 9.8692 9.8692 11.2267 11.2267 13.4450 13.4450 14.0229 14.0229 k = 0.7315-0.5052 0.6624 ( 3913 PWs) bands (ev): -45.9720 -45.9720 -22.6937 -22.6937 -22.0530 -22.0530 -22.0276 -22.0276 4.0634 4.0634 5.0366 5.0366 5.7917 5.7917 6.7667 6.7667 8.8480 8.8480 9.7382 9.7382 9.8821 9.8821 11.2525 11.2525 13.4348 13.4348 13.9284 13.9284 k = 0.7186-0.5047 0.6722 ( 3915 PWs) bands (ev): -45.9721 -45.9721 -22.6936 -22.6936 -22.0528 -22.0528 -22.0275 -22.0275 4.0394 4.0394 4.9881 4.9881 5.8033 5.8033 6.8483 6.8483 8.8330 8.8330 9.7233 9.7233 9.9009 9.9009 11.2881 11.2881 13.4229 13.4229 13.8361 13.8361 k = 0.7058-0.5043 0.6820 ( 3919 PWs) bands (ev): -45.9721 -45.9721 -22.6934 -22.6934 -22.0526 -22.0526 -22.0274 -22.0274 4.0175 4.0175 4.9375 4.9375 5.8153 5.8153 6.9322 6.9322 8.8071 8.8071 9.7096 9.7096 9.9264 9.9264 11.3310 11.3310 13.4094 13.4094 13.7474 13.7474 k = 0.6929-0.5038 0.6918 ( 3915 PWs) bands (ev): -45.9722 -45.9722 -22.6933 -22.6933 -22.0524 -22.0524 -22.0273 -22.0273 3.9977 3.9977 4.8852 4.8852 5.8277 5.8277 7.0176 7.0176 8.7720 8.7720 9.6970 9.6970 9.9587 9.9587 11.3785 11.3785 13.3945 13.3945 13.6631 13.6631 k = 0.6800-0.5033 0.7016 ( 3915 PWs) bands (ev): -45.9723 -45.9723 -22.6931 -22.6931 -22.0521 -22.0521 -22.0272 -22.0272 3.9800 3.9800 4.8313 4.8313 5.8402 5.8402 7.1037 7.1037 8.7298 8.7298 9.6858 9.6858 9.9971 9.9971 11.4279 11.4279 13.3784 13.3784 13.5840 13.5840 k = 0.6672-0.5029 0.7113 ( 3919 PWs) bands (ev): -45.9723 -45.9723 -22.6929 -22.6929 -22.0519 -22.0519 -22.0270 -22.0270 3.9645 3.9645 4.7760 4.7760 5.8531 5.8531 7.1898 7.1898 8.6833 8.6833 9.6760 9.6760 10.0408 10.0408 11.4767 11.4767 13.3612 13.3612 13.5112 13.5112 k = 0.6543-0.5024 0.7211 ( 3917 PWs) bands (ev): -45.9724 -45.9724 -22.6927 -22.6927 -22.0516 -22.0516 -22.0269 -22.0269 3.9512 3.9512 4.7196 4.7196 5.8661 5.8661 7.2747 7.2747 8.6350 8.6350 9.6677 9.6677 10.0886 10.0886 11.5222 11.5222 13.3429 13.3429 13.4455 13.4455 k = 0.6415-0.5020 0.7309 ( 3915 PWs) bands (ev): -45.9725 -45.9725 -22.6925 -22.6925 -22.0514 -22.0514 -22.0268 -22.0268 3.9403 3.9403 4.6620 4.6620 5.8793 5.8793 7.3572 7.3572 8.5878 8.5878 9.6609 9.6609 10.1395 10.1395 11.5619 11.5619 13.3234 13.3234 13.3877 13.3877 k = 0.6286-0.5015 0.7407 ( 3914 PWs) bands (ev): -45.9725 -45.9725 -22.6923 -22.6923 -22.0511 -22.0511 -22.0266 -22.0266 3.9316 3.9316 4.6034 4.6034 5.8927 5.8927 7.4354 7.4354 8.5447 8.5447 9.6557 9.6557 10.1925 10.1925 11.5936 11.5936 13.3026 13.3026 13.3388 13.3388 k = 0.6157-0.5011 0.7505 ( 3916 PWs) bands (ev): -45.9726 -45.9726 -22.6921 -22.6921 -22.0508 -22.0508 -22.0265 -22.0265 3.9253 3.9253 4.5437 4.5437 5.9062 5.9062 7.5070 7.5070 8.5091 8.5091 9.6521 9.6521 10.2468 10.2468 11.6154 11.6154 13.2797 13.2797 13.2997 13.2997 k = 0.6029-0.5006 0.7603 ( 3914 PWs) bands (ev): -45.9727 -45.9727 -22.6919 -22.6919 -22.0505 -22.0505 -22.0263 -22.0263 3.9213 3.9213 4.4830 4.4830 5.9198 5.9198 7.5691 7.5691 8.4846 8.4846 9.6502 9.6502 10.3014 10.3014 11.6260 11.6260 13.2546 13.2546 13.2702 13.2702 k = 0.5900-0.5002 0.7701 ( 3914 PWs) bands (ev): -45.9728 -45.9728 -22.6917 -22.6917 -22.0502 -22.0502 -22.0261 -22.0261 3.9198 3.9198 4.4211 4.4211 5.9334 5.9334 7.6186 7.6186 8.4752 8.4752 9.6500 9.6500 10.3553 10.3553 11.6250 11.6250 13.2307 13.2307 13.2460 13.2460 k = 0.5772-0.4997 0.7799 ( 3918 PWs) bands (ev): -45.9729 -45.9729 -22.6914 -22.6914 -22.0499 -22.0499 -22.0259 -22.0259 3.9206 3.9206 4.3582 4.3582 5.9471 5.9471 7.6527 7.6527 8.4839 8.4839 9.6514 9.6514 10.4076 10.4076 11.6128 11.6128 13.2099 13.2099 13.2236 13.2236 k = 0.5643-0.4993 0.7897 ( 3924 PWs) bands (ev): -45.9729 -45.9729 -22.6912 -22.6912 -22.0495 -22.0495 -22.0257 -22.0257 3.9238 3.9238 4.2941 4.2941 5.9609 5.9609 7.6706 7.6706 8.5120 8.5120 9.6546 9.6546 10.4569 10.4569 11.5908 11.5908 13.1902 13.1902 13.2033 13.2033 k = 0.5514-0.4988 0.7995 ( 3928 PWs) bands (ev): -45.9730 -45.9730 -22.6909 -22.6909 -22.0492 -22.0492 -22.0255 -22.0255 3.9295 3.9295 4.2289 4.2289 5.9747 5.9747 7.6736 7.6736 8.5584 8.5584 9.6593 9.6593 10.5020 10.5020 11.5613 11.5613 13.1690 13.1690 13.1865 13.1865 k = 0.5386-0.4984 0.8093 ( 3934 PWs) bands (ev): -45.9731 -45.9731 -22.6907 -22.6907 -22.0489 -22.0489 -22.0253 -22.0253 3.9375 3.9375 4.1626 4.1626 5.9885 5.9885 7.6651 7.6651 8.6200 8.6200 9.6657 9.6657 10.5410 10.5410 11.5272 11.5272 13.1460 13.1460 13.1723 13.1723 k = 0.5257-0.4979 0.8191 ( 3936 PWs) bands (ev): -45.9732 -45.9732 -22.6904 -22.6904 -22.0485 -22.0485 -22.0251 -22.0251 3.9479 3.9479 4.0950 4.0950 6.0024 6.0024 7.6486 7.6486 8.6933 8.6933 9.6736 9.6736 10.5716 10.5716 11.4918 11.4918 13.1222 13.1222 13.1596 13.1596 k = 0.5129-0.4975 0.8289 ( 3940 PWs) bands (ev): -45.9733 -45.9733 -22.6901 -22.6901 -22.0482 -22.0482 -22.0249 -22.0249 3.9606 3.9606 4.0265 4.0265 6.0163 6.0163 7.6274 7.6274 8.7748 8.7748 9.6831 9.6831 10.5914 10.5914 11.4588 11.4588 13.0981 13.0981 13.1483 13.1483 k = 0.5000-0.4970 0.8387 ( 3940 PWs) bands (ev): -45.9734 -45.9734 -22.6898 -22.6898 -22.0478 -22.0478 -22.0246 -22.0246 3.9546 3.9546 3.9778 3.9778 6.0303 6.0303 7.6041 7.6041 8.8619 8.8619 9.6939 9.6939 10.5978 10.5978 11.4322 11.4322 13.0738 13.0738 13.1389 13.1389 k = 0.5000 0.8606 0.4579 ( 3940 PWs) bands (ev): -45.9734 -45.9734 -22.6898 -22.6898 -22.0478 -22.0478 -22.0246 -22.0246 3.9546 3.9546 3.9778 3.9778 6.0303 6.0303 7.6041 7.6041 8.8619 8.8619 9.6939 9.6939 10.5978 10.5978 11.4322 11.4322 13.0738 13.0738 13.1389 13.1389 k = 0.5000 0.8489 0.4468 ( 3944 PWs) bands (ev): -45.9737 -45.9737 -22.6891 -22.6891 -22.0470 -22.0470 -22.0240 -22.0240 3.8066 3.8066 4.0042 4.0042 6.0635 6.0635 7.5487 7.5487 9.0660 9.0660 9.7211 9.7211 10.5972 10.5972 11.3820 11.3820 13.0186 13.0186 13.1192 13.1192 k = 0.5000 0.8372 0.4356 ( 3940 PWs) bands (ev): -45.9740 -45.9740 -22.6884 -22.6884 -22.0461 -22.0461 -22.0233 -22.0233 3.6610 3.6610 4.0316 4.0316 6.0990 6.0990 7.4905 7.4905 9.2710 9.2710 9.7502 9.7502 10.6010 10.6010 11.3343 11.3343 12.9639 12.9639 13.0977 13.0977 k = 0.5000 0.8255 0.4244 ( 3936 PWs) bands (ev): -45.9742 -45.9742 -22.6876 -22.6876 -22.0452 -22.0452 -22.0225 -22.0225 3.5177 3.5177 4.0597 4.0597 6.1368 6.1368 7.4303 7.4303 9.4763 9.4763 9.7810 9.7810 10.6093 10.6093 11.2894 11.2894 12.9098 12.9098 13.0746 13.0746 k = 0.5000 0.8138 0.4132 ( 3928 PWs) bands (ev): -45.9745 -45.9745 -22.6868 -22.6868 -22.0444 -22.0444 -22.0217 -22.0217 3.3767 3.3767 4.0882 4.0882 6.1769 6.1769 7.3684 7.3684 9.6814 9.6814 9.8136 9.8136 10.6221 10.6221 11.2479 11.2479 12.8566 12.8566 13.0497 13.0497 k = 0.5000 0.8021 0.4021 ( 3920 PWs) bands (ev): -45.9748 -45.9748 -22.6859 -22.6859 -22.0435 -22.0435 -22.0208 -22.0208 3.2383 3.2383 4.1169 4.1169 6.2192 6.2192 7.3057 7.3057 9.8478 9.8478 9.8856 9.8856 10.6393 10.6393 11.2106 11.2106 12.8043 12.8043 13.0232 13.0232 k = 0.5000 0.7904 0.3909 ( 3916 PWs) bands (ev): -45.9752 -45.9752 -22.6850 -22.6850 -22.0426 -22.0426 -22.0197 -22.0197 3.1022 3.1022 4.1453 4.1453 6.2639 6.2639 7.2428 7.2428 9.8838 9.8838 10.0869 10.0869 10.6609 10.6609 11.1793 11.1793 12.7531 12.7531 12.9952 12.9952 k = 0.5000 0.7787 0.3797 ( 3924 PWs) bands (ev): -45.9755 -45.9755 -22.6841 -22.6841 -22.0417 -22.0417 -22.0186 -22.0186 2.9686 2.9686 4.1731 4.1731 6.3108 6.3108 7.1805 7.1805 9.9214 9.9214 10.2825 10.2825 10.6868 10.6868 11.1568 11.1568 12.7031 12.7031 12.9657 12.9657 k = 0.5000 0.7670 0.3685 ( 3920 PWs) bands (ev): -45.9758 -45.9758 -22.6832 -22.6832 -22.0409 -22.0409 -22.0174 -22.0174 2.8375 2.8375 4.1999 4.1999 6.3599 6.3599 7.1195 7.1195 9.9606 9.9606 10.4657 10.4657 10.7168 10.7168 11.1498 11.1498 12.6543 12.6543 12.9349 12.9349 k = 0.5000 0.7553 0.3573 ( 3912 PWs) bands (ev): -45.9762 -45.9762 -22.6822 -22.6822 -22.0400 -22.0400 -22.0161 -22.0161 2.7089 2.7089 4.2251 4.2251 6.4113 6.4113 7.0609 7.0609 10.0014 10.0014 10.6224 10.6224 10.7508 10.7508 11.1719 11.1719 12.6067 12.6067 12.9028 12.9028 k = 0.5000 0.7436 0.3462 ( 3916 PWs) bands (ev): -45.9766 -45.9766 -22.6811 -22.6811 -22.0392 -22.0392 -22.0147 -22.0147 2.5828 2.5828 4.2481 4.2481 6.4649 6.4649 7.0053 7.0053 10.0437 10.0437 10.7303 10.7303 10.7893 10.7893 11.2448 11.2448 12.5605 12.5605 12.8696 12.8696 k = 0.5000 0.7319 0.3350 ( 3912 PWs) bands (ev): -45.9770 -45.9770 -22.6801 -22.6801 -22.0384 -22.0384 -22.0132 -22.0132 2.4592 2.4592 4.2685 4.2685 6.5208 6.5208 6.9539 6.9539 10.0875 10.0875 10.7822 10.7822 10.8310 10.8310 11.3766 11.3766 12.5156 12.5156 12.8354 12.8354 k = 0.5000 0.7202 0.3238 ( 3912 PWs) bands (ev): -45.9774 -45.9774 -22.6790 -22.6790 -22.0376 -22.0376 -22.0116 -22.0116 2.3381 2.3381 4.2856 4.2856 6.5787 6.5787 6.9073 6.9073 10.1326 10.1326 10.7985 10.7985 10.8738 10.8738 11.5485 11.5485 12.4721 12.4721 12.8002 12.8002 k = 0.5000 0.7085 0.3126 ( 3914 PWs) bands (ev): -45.9777 -45.9777 -22.6779 -22.6779 -22.0369 -22.0369 -22.0099 -22.0099 2.2195 2.2195 4.2987 4.2987 6.6389 6.6389 6.8667 6.8667 10.1791 10.1791 10.7969 10.7969 10.9194 10.9194 11.7406 11.7406 12.4300 12.4300 12.7643 12.7643 k = 0.5000 0.6968 0.3015 ( 3910 PWs) bands (ev): -45.9782 -45.9782 -22.6768 -22.6768 -22.0361 -22.0361 -22.0081 -22.0081 2.1035 2.1035 4.3074 4.3074 6.7011 6.7011 6.8328 6.8328 10.2270 10.2270 10.7875 10.7875 10.9678 10.9678 11.9426 11.9426 12.3893 12.3893 12.7278 12.7278 k = 0.5000 0.6851 0.2903 ( 3910 PWs) bands (ev): -45.9786 -45.9786 -22.6757 -22.6757 -22.0354 -22.0354 -22.0063 -22.0063 1.9900 1.9900 4.3109 4.3109 6.7654 6.7654 6.8064 6.8064 10.2760 10.2760 10.7750 10.7750 11.0183 11.0183 12.1496 12.1496 12.3500 12.3500 12.6909 12.6909 k = 0.5000 0.6734 0.2791 ( 3906 PWs) bands (ev): -45.9790 -45.9790 -22.6745 -22.6745 -22.0347 -22.0347 -22.0044 -22.0044 1.8791 1.8791 4.3090 4.3090 6.7879 6.7879 6.8322 6.8322 10.3262 10.3262 10.7619 10.7619 11.0706 11.0706 12.3121 12.3121 12.3592 12.3592 12.6537 12.6537 k = 0.5000 0.6617 0.2679 ( 3908 PWs) bands (ev): -45.9794 -45.9794 -22.6734 -22.6734 -22.0341 -22.0341 -22.0024 -22.0024 1.7707 1.7707 4.3013 4.3013 6.7784 6.7784 6.9006 6.9006 10.3776 10.3776 10.7492 10.7492 11.1242 11.1242 12.2757 12.2757 12.5694 12.5694 12.6169 12.6169 k = 0.5000 0.6500 0.2567 ( 3912 PWs) bands (ev): -45.9798 -45.9798 -22.6722 -22.6722 -22.0334 -22.0334 -22.0003 -22.0003 1.6649 1.6649 4.2875 4.2875 6.7779 6.7779 6.9712 6.9712 10.4299 10.4299 10.7376 10.7376 11.1787 11.1787 12.2407 12.2407 12.5792 12.5792 12.7810 12.7810 k = 0.5000 0.6382 0.2456 ( 3922 PWs) bands (ev): -45.9803 -45.9803 -22.6710 -22.6710 -22.0328 -22.0328 -21.9982 -21.9982 1.5616 1.5616 4.2677 4.2677 6.7867 6.7867 7.0437 7.0437 10.4832 10.4832 10.7275 10.7275 11.2337 11.2337 12.2070 12.2070 12.5426 12.5426 12.9914 12.9914 k = 0.5000 0.6265 0.2344 ( 3926 PWs) bands (ev): -45.9807 -45.9807 -22.6698 -22.6698 -22.0321 -22.0321 -21.9961 -21.9961 1.4610 1.4610 4.2420 4.2420 6.8047 6.8047 7.1182 7.1182 10.5373 10.5373 10.7193 10.7193 11.2885 11.2885 12.1747 12.1747 12.5068 12.5068 13.2007 13.2007 k = 0.5000 0.6148 0.2232 ( 3926 PWs) bands (ev): -45.9812 -45.9812 -22.6686 -22.6686 -22.0315 -22.0315 -21.9939 -21.9939 1.3629 1.3629 4.2108 4.2108 6.8318 6.8318 7.1947 7.1947 10.5921 10.5921 10.7130 10.7130 11.3427 11.3427 12.1438 12.1438 12.4721 12.4721 13.4083 13.4083 k = 0.5000 0.6031 0.2120 ( 3928 PWs) bands (ev): -45.9816 -45.9816 -22.6674 -22.6674 -22.0309 -22.0309 -21.9917 -21.9917 1.2674 1.2674 4.1744 4.1744 6.8676 6.8676 7.2730 7.2730 10.6474 10.6474 10.7090 10.7090 11.3955 11.3955 12.1142 12.1142 12.4391 12.4391 13.6133 13.6133 k = 0.5000 0.5914 0.2009 ( 3926 PWs) bands (ev): -45.9820 -45.9820 -22.6662 -22.6662 -22.0303 -22.0303 -21.9895 -21.9895 1.1745 1.1745 4.1333 4.1333 6.9118 6.9118 7.3531 7.3531 10.6989 10.6989 10.7115 10.7115 11.4461 11.4461 12.0859 12.0859 12.4084 12.4084 13.8150 13.8150 k = 0.5000 0.5797 0.1897 ( 3918 PWs) bands (ev): -45.9825 -45.9825 -22.6650 -22.6650 -22.0297 -22.0297 -21.9872 -21.9872 1.0841 1.0841 4.0883 4.0883 6.9639 6.9639 7.4350 7.4350 10.7055 10.7055 10.7617 10.7617 11.4937 11.4937 12.0589 12.0589 12.3807 12.3807 14.0122 14.0122 k = 0.5000 0.5680 0.1785 ( 3926 PWs) bands (ev): -45.9829 -45.9829 -22.6638 -22.6638 -22.0291 -22.0291 -21.9849 -21.9849 0.9964 0.9964 4.0397 4.0397 7.0233 7.0233 7.5186 7.5186 10.7080 10.7080 10.8184 10.8184 11.5370 11.5370 12.0331 12.0331 12.3569 12.3569 14.2035 14.2035 k = 0.5000 0.5563 0.1673 ( 3922 PWs) bands (ev): -45.9834 -45.9834 -22.6626 -22.6626 -22.0285 -22.0285 -21.9826 -21.9826 0.9113 0.9113 3.9883 3.9883 7.0895 7.0895 7.6038 7.6038 10.7125 10.7125 10.8756 10.8756 11.5750 11.5750 12.0085 12.0085 12.3379 12.3379 14.3866 14.3866 k = 0.5000 0.5446 0.1561 ( 3922 PWs) bands (ev): -45.9838 -45.9838 -22.6614 -22.6614 -22.0279 -22.0279 -21.9803 -21.9803 0.8287 0.8287 3.9346 3.9346 7.1620 7.1620 7.6907 7.6907 10.7192 10.7192 10.9331 10.9331 11.6064 11.6064 11.9851 11.9851 12.3248 12.3248 14.5585 14.5585 k = 0.5000 0.5329 0.1450 ( 3918 PWs) bands (ev): -45.9842 -45.9842 -22.6603 -22.6603 -22.0273 -22.0273 -21.9780 -21.9780 0.7488 0.7488 3.8792 3.8792 7.2403 7.2403 7.7790 7.7790 10.7280 10.7280 10.9906 10.9906 11.6300 11.6300 11.9628 11.9628 12.3187 12.3187 14.7144 14.7144 k = 0.5000 0.5212 0.1338 ( 3914 PWs) bands (ev): -45.9847 -45.9847 -22.6591 -22.6591 -22.0267 -22.0267 -21.9758 -21.9758 0.6715 0.6715 3.8225 3.8225 7.3240 7.3240 7.8688 7.8688 10.7391 10.7391 11.0481 11.0481 11.6451 11.6451 11.9416 11.9416 12.3199 12.3199 14.8480 14.8480 k = 0.5000 0.5095 0.1226 ( 3914 PWs) bands (ev): -45.9851 -45.9851 -22.6580 -22.6580 -22.0261 -22.0261 -21.9735 -21.9735 0.5968 0.5968 3.7650 3.7650 7.4125 7.4125 7.9599 7.9599 10.7524 10.7524 11.1053 11.1053 11.6515 11.6515 11.9214 11.9214 12.3287 12.3287 14.9509 14.9509 k = 0.5000 0.4978 0.1114 ( 3918 PWs) bands (ev): -45.9855 -45.9855 -22.6569 -22.6569 -22.0255 -22.0255 -21.9713 -21.9713 0.5246 0.5246 3.7071 3.7071 7.5056 7.5056 8.0522 8.0522 10.7678 10.7678 11.1622 11.1622 11.6496 11.6496 11.9022 11.9022 12.3443 12.3443 15.0155 15.0155 k = 0.5000 0.4861 0.1003 ( 3914 PWs) bands (ev): -45.9859 -45.9859 -22.6558 -22.6558 -22.0250 -22.0250 -21.9691 -21.9691 0.4552 0.4552 3.6493 3.6493 7.6027 7.6027 8.1457 8.1457 10.7854 10.7854 11.2186 11.2186 11.6404 11.6404 11.8840 11.8840 12.3656 12.3656 15.0388 15.0388 k = 0.5000 0.4744 0.0891 ( 3918 PWs) bands (ev): -45.9863 -45.9863 -22.6547 -22.6547 -22.0244 -22.0244 -21.9669 -21.9669 0.3883 0.3883 3.5917 3.5917 7.7035 7.7035 8.2401 8.2401 10.8051 10.8051 11.2744 11.2744 11.6252 11.6252 11.8666 11.8666 12.3913 12.3913 15.0246 15.0246 k = 0.5000 0.4627 0.0779 ( 3920 PWs) bands (ev): -45.9867 -45.9867 -22.6537 -22.6537 -22.0239 -22.0239 -21.9647 -21.9647 0.3240 0.3240 3.5348 3.5348 7.8078 7.8078 8.3354 8.3354 10.8268 10.8268 11.3295 11.3295 11.6051 11.6051 11.8500 11.8500 12.4200 12.4200 14.9814 14.9814 k = 0.5000 0.4510 0.0667 ( 3916 PWs) bands (ev): -45.9871 -45.9871 -22.6526 -22.6526 -22.0233 -22.0233 -21.9626 -21.9626 0.2623 0.2623 3.4789 3.4789 7.9152 7.9152 8.4315 8.4315 10.8506 10.8506 11.3836 11.3836 11.5814 11.5814 11.8342 11.8342 12.4505 12.4505 14.9178 14.9178 k = 0.5000 0.4393 0.0555 ( 3916 PWs) bands (ev): -45.9875 -45.9875 -22.6517 -22.6517 -22.0228 -22.0228 -21.9606 -21.9606 0.2033 0.2033 3.4240 3.4240 8.0254 8.0254 8.5281 8.5281 10.8763 10.8763 11.4365 11.4365 11.5549 11.5549 11.8191 11.8191 12.4817 12.4817 14.8407 14.8407 k = 0.5000 0.4276 0.0444 ( 3912 PWs) bands (ev): -45.9878 -45.9878 -22.6507 -22.6507 -22.0223 -22.0223 -21.9586 -21.9586 0.1469 0.1469 3.3705 3.3705 8.1380 8.1380 8.6250 8.6250 10.9039 10.9039 11.4873 11.4873 11.5274 11.5274 11.8047 11.8047 12.5130 12.5130 14.7549 14.7549 k = 0.5000 0.4159 0.0332 ( 3916 PWs) bands (ev): -45.9882 -45.9882 -22.6498 -22.6498 -22.0217 -22.0217 -21.9566 -21.9566 0.0931 0.0931 3.3185 3.3185 8.2530 8.2530 8.7221 8.7221 10.9332 10.9332 11.4935 11.4935 11.5415 11.5415 11.7908 11.7908 12.5437 12.5437 14.6638 14.6638 k = 0.5000 0.4042 0.0220 ( 3916 PWs) bands (ev): -45.9885 -45.9885 -22.6489 -22.6489 -22.0213 -22.0213 -21.9547 -21.9547 0.0419 0.0419 3.2683 3.2683 8.3698 8.3698 8.8191 8.8191 10.9643 10.9643 11.4630 11.4630 11.5897 11.5897 11.7774 11.7774 12.5733 12.5733 14.5696 14.5696 k = 0.5000 0.3925 0.0108 ( 3920 PWs) bands (ev): -45.9889 -45.9889 -22.6480 -22.6480 -22.0208 -22.0208 -21.9529 -21.9529 -0.0066 -0.0066 3.2199 3.2199 8.4883 8.4883 8.9158 8.9158 10.9969 10.9969 11.4308 11.4308 11.6371 11.6371 11.7646 11.7646 12.6015 12.6015 14.4739 14.4739 k = 0.5000 0.3808-0.0003 ( 3924 PWs) bands (ev): -45.9892 -45.9892 -22.6472 -22.6472 -22.0203 -22.0203 -21.9512 -21.9512 -0.0526 -0.0526 3.1735 3.1735 8.6082 8.6082 9.0119 9.0119 11.0310 11.0310 11.3977 11.3977 11.6827 11.6827 11.7522 11.7522 12.6281 12.6281 14.3778 14.3778 k = 0.5000 0.3691-0.0115 ( 3916 PWs) bands (ev): -45.9895 -45.9895 -22.6464 -22.6464 -22.0199 -22.0199 -21.9495 -21.9495 -0.0959 -0.0959 3.1292 3.1292 8.7291 8.7291 9.1071 9.1071 11.0663 11.0663 11.3641 11.3641 11.7246 11.7246 11.7422 11.7422 12.6529 12.6529 14.2821 14.2821 k = 0.5000 0.3574-0.0227 ( 3916 PWs) bands (ev): -45.9897 -45.9897 -22.6457 -22.6457 -22.0194 -22.0194 -21.9479 -21.9479 -0.1366 -0.1366 3.0872 3.0872 8.8508 8.8508 9.2010 9.2010 11.1027 11.1027 11.3299 11.3299 11.7263 11.7263 11.7705 11.7705 12.6759 12.6759 14.1877 14.1877 k = 0.5000 0.3456-0.0339 ( 3916 PWs) bands (ev): -45.9900 -45.9900 -22.6450 -22.6450 -22.0190 -22.0190 -21.9464 -21.9464 -0.1746 -0.1746 3.0474 3.0474 8.9728 8.9728 9.2932 9.2932 11.1398 11.1398 11.2953 11.2953 11.7149 11.7149 11.8100 11.8100 12.6969 12.6969 14.0951 14.0951 k = 0.5000 0.3339-0.0450 ( 3916 PWs) bands (ev): -45.9903 -45.9903 -22.6443 -22.6443 -22.0186 -22.0186 -21.9450 -21.9450 -0.2101 -0.2101 3.0101 3.0101 9.0948 9.0948 9.3834 9.3834 11.1768 11.1768 11.2608 11.2608 11.7034 11.7034 11.8476 11.8476 12.7159 12.7159 14.0048 14.0048 k = 0.5000 0.3222-0.0562 ( 3910 PWs) bands (ev): -45.9905 -45.9905 -22.6437 -22.6437 -22.0183 -22.0183 -21.9436 -21.9436 -0.2429 -0.2429 2.9752 2.9752 9.2163 9.2163 9.4709 9.4709 11.2054 11.2054 11.2343 11.2343 11.6919 11.6919 11.8831 11.8831 12.7330 12.7330 13.9174 13.9174 k = 0.5000 0.3105-0.0674 ( 3910 PWs) bands (ev): -45.9907 -45.9907 -22.6431 -22.6431 -22.0179 -22.0179 -21.9424 -21.9424 -0.2731 -0.2731 2.9430 2.9430 9.3370 9.3370 9.5554 9.5554 11.1815 11.1815 11.2593 11.2593 11.6805 11.6805 11.9161 11.9161 12.7481 12.7481 13.8334 13.8334 k = 0.5000 0.2988-0.0786 ( 3910 PWs) bands (ev): -45.9909 -45.9909 -22.6426 -22.6426 -22.0176 -22.0176 -21.9413 -21.9413 -0.3007 -0.3007 2.9133 2.9133 9.4563 9.4563 9.6361 9.6361 11.1442 11.1442 11.2963 11.2963 11.6692 11.6692 11.9465 11.9465 12.7614 12.7614 13.7532 13.7532 k = 0.5000 0.2871-0.0898 ( 3910 PWs) bands (ev): -45.9911 -45.9911 -22.6422 -22.6422 -22.0173 -22.0173 -21.9402 -21.9402 -0.3256 -0.3256 2.8863 2.8863 9.5737 9.5737 9.7126 9.7126 11.1045 11.1045 11.3334 11.3334 11.6581 11.6581 11.9744 11.9744 12.7728 12.7728 13.6775 13.6775 k = 0.5000 0.2754-0.1009 ( 3910 PWs) bands (ev): -45.9913 -45.9913 -22.6417 -22.6417 -22.0171 -22.0171 -21.9393 -21.9393 -0.3479 -0.3479 2.8620 2.8620 9.6884 9.6884 9.7840 9.7840 11.0629 11.0629 11.3695 11.3695 11.6473 11.6473 11.9996 11.9996 12.7825 12.7825 13.6069 13.6069 k = 0.5000 0.2637-0.1121 ( 3908 PWs) bands (ev): -45.9914 -45.9914 -22.6414 -22.6414 -22.0168 -22.0168 -21.9384 -21.9384 -0.3676 -0.3676 2.8405 2.8405 9.7996 9.7996 9.8498 9.8498 11.0193 11.0193 11.4039 11.4039 11.6369 11.6369 12.0219 12.0219 12.7906 12.7906 13.5420 13.5420 k = 0.5000 0.2520-0.1233 ( 3904 PWs) bands (ev): -45.9915 -45.9915 -22.6410 -22.6410 -22.0166 -22.0166 -21.9377 -21.9377 -0.3847 -0.3847 2.8218 2.8218 9.9039 9.9039 9.9118 9.9118 10.9737 10.9737 11.4359 11.4359 11.6272 11.6272 12.0415 12.0415 12.7971 12.7971 13.4835 13.4835 k = 0.5000 0.2403-0.1345 ( 3912 PWs) bands (ev): -45.9917 -45.9917 -22.6407 -22.6407 -22.0164 -22.0164 -21.9371 -21.9371 -0.3991 -0.3991 2.8059 2.8059 9.9601 9.9601 10.0092 10.0092 10.9262 10.9262 11.4647 11.4647 11.6183 11.6183 12.0581 12.0581 12.8023 12.8023 13.4322 13.4322 k = 0.5000 0.2286-0.1456 ( 3912 PWs) bands (ev): -45.9917 -45.9917 -22.6405 -22.6405 -22.0163 -22.0163 -21.9366 -21.9366 -0.4110 -0.4110 2.7928 2.7928 10.0039 10.0039 10.1038 10.1038 10.8775 10.8775 11.4897 11.4897 11.6104 11.6104 12.0717 12.0717 12.8062 12.8062 13.3888 13.3888 k = 0.5000 0.2169-0.1568 ( 3908 PWs) bands (ev): -45.9918 -45.9918 -22.6403 -22.6403 -22.0162 -22.0162 -21.9362 -21.9362 -0.4201 -0.4201 2.7827 2.7827 10.0389 10.0389 10.1890 10.1890 10.8292 10.8292 11.5101 11.5101 11.6039 11.6039 12.0824 12.0824 12.8091 12.8091 13.3541 13.3541 k = 0.5000 0.2052-0.1680 ( 3896 PWs) bands (ev): -45.9919 -45.9919 -22.6402 -22.6402 -22.0161 -22.0161 -21.9359 -21.9359 -0.4267 -0.4267 2.7754 2.7754 10.0643 10.0643 10.2605 10.2605 10.7847 10.7847 11.5252 11.5252 11.5990 11.5990 12.0901 12.0901 12.8110 12.8110 13.3287 13.3287 k = 0.5000 0.1935-0.1792 ( 3898 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0161 -22.0161 -21.9357 -21.9357 -0.4307 -0.4307 2.7710 2.7710 10.0798 10.0798 10.3107 10.3107 10.7509 10.7509 11.5346 11.5346 11.5959 11.5959 12.0947 12.0947 12.8121 12.8121 13.3132 13.3132 k = 0.5000 0.1818-0.1904 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6401 -22.6401 -22.0160 -22.0160 -21.9357 -21.9357 -0.4320 -0.4320 2.7696 2.7696 10.0850 10.0850 10.3294 10.3294 10.7377 10.7377 11.5377 11.5377 11.5949 11.5949 12.0962 12.0962 12.8125 12.8125 13.3081 13.3081 k = 0.0000 0.8378 0.8001 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6404 4.6404 5.0379 5.0379 5.6785 5.6785 6.2923 6.2923 8.2576 8.2576 9.5673 9.5673 10.0215 10.0215 12.8892 12.8892 13.0439 13.0439 13.0719 13.0719 k = 0.0127 0.8424 0.7953 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6372 4.6372 5.0409 5.0409 5.6787 5.6787 6.2917 6.2917 8.2601 8.2601 9.5688 9.5688 10.0205 10.0205 12.8184 12.8184 13.0704 13.0704 13.1176 13.1176 k = 0.0253 0.8470 0.7904 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6280 4.6280 5.0495 5.0495 5.6793 5.6793 6.2900 6.2900 8.2676 8.2676 9.5734 9.5734 10.0176 10.0176 12.7017 12.7017 13.0778 13.0778 13.2314 13.2314 k = 0.0380 0.8516 0.7856 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.6135 4.6135 5.0632 5.0632 5.6802 5.6802 6.2872 6.2872 8.2801 8.2801 9.5809 9.5809 10.0128 10.0128 12.5785 12.5785 13.0888 13.0888 13.3509 13.3509 k = 0.0507 0.8562 0.7808 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.5944 4.5944 5.0811 5.0811 5.6816 5.6816 6.2834 6.2834 8.2973 8.2973 9.5914 9.5914 10.0062 10.0062 12.4540 12.4540 13.1040 13.1040 13.4703 13.4703 k = 0.0633 0.8608 0.7760 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.5716 4.5716 5.1026 5.1026 5.6834 5.6834 6.2785 6.2785 8.3190 8.3190 9.6048 9.6048 9.9978 9.9978 12.3297 12.3297 13.1234 13.1234 13.5870 13.5870 k = 0.0760 0.8654 0.7711 ( 3910 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.5460 4.5460 5.1269 5.1269 5.6856 5.6856 6.2726 6.2726 8.3448 8.3448 9.6211 9.6211 9.9877 9.9877 12.2065 12.2065 13.1469 13.1469 13.6285 13.6285 k = 0.0887 0.8700 0.7663 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.5182 4.5182 5.1536 5.1536 5.6881 5.6881 6.2658 6.2658 8.3744 8.3744 9.6402 9.6402 9.9761 9.9761 12.0850 12.0850 13.1744 13.1744 13.6290 13.6290 k = 0.1013 0.8746 0.7615 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4886 4.4886 5.1823 5.1823 5.6909 5.6909 6.2581 6.2581 8.4073 8.4073 9.6620 9.6620 9.9630 9.9630 11.9659 11.9659 13.2058 13.2058 13.6292 13.6292 k = 0.8987-0.5110 0.5351 ( 3912 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4886 4.4886 5.1823 5.1823 5.6909 5.6909 6.2581 6.2581 8.4073 8.4073 9.6620 9.6620 9.9630 9.9630 11.9659 11.9659 13.2058 13.2058 13.6292 13.6292 k = 0.8844-0.5162 0.5405 ( 3916 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4538 4.4538 5.2167 5.2167 5.6945 5.6945 6.2486 6.2486 8.4474 8.4474 9.6896 9.6896 9.9467 9.9467 11.8354 11.8354 13.2456 13.2456 13.6294 13.6294 k = 0.8702-0.5214 0.5459 ( 3910 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.4179 4.4179 5.2532 5.2532 5.6985 5.6985 6.2381 6.2381 8.4900 8.4900 9.7203 9.7203 9.9289 9.9289 11.7096 11.7096 13.2901 13.2901 13.6295 13.6295 k = 0.8560-0.5265 0.5513 ( 3906 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0543 -22.0543 -22.0282 -22.0282 4.3811 4.3811 5.2916 5.2916 5.7029 5.7029 6.2268 6.2268 8.5340 8.5340 9.7541 9.7541 9.9098 9.9098 11.5895 11.5895 13.3390 13.3390 13.6296 13.6296 k = 0.8417-0.5317 0.5568 ( 3906 PWs) bands (ev): -45.9717 -45.9717 -22.6947 -22.6947 -22.0542 -22.0542 -22.0282 -22.0282 4.3439 4.3439 5.3318 5.3318 5.7076 5.7076 6.2148 6.2148 8.5781 8.5781 9.7906 9.7906 9.8896 9.8896 11.4763 11.4763 13.3920 13.3920 13.6298 13.6298 k = 0.8275-0.5369 0.5622 ( 3904 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.3066 4.3066 5.3739 5.3739 5.7126 5.7126 6.2023 6.2023 8.6209 8.6209 9.8296 9.8296 9.8687 9.8687 11.3713 11.3713 13.4491 13.4491 13.6300 13.6300 k = 0.8132-0.5421 0.5676 ( 3908 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.2694 4.2694 5.4177 5.4177 5.7179 5.7179 6.1893 6.1893 8.6606 8.6606 9.8462 9.8462 9.8720 9.8720 11.2761 11.2761 13.5098 13.5098 13.6303 13.6303 k = 0.7990-0.5473 0.5730 ( 3892 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.2325 4.2325 5.4633 5.4633 5.7234 5.7234 6.1760 6.1760 8.6956 8.6956 9.8243 9.8243 9.9155 9.9155 11.1923 11.1923 13.5737 13.5737 13.6311 13.6311 k = 0.7848-0.5524 0.5785 ( 3892 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.1961 4.1961 5.5106 5.5106 5.7291 5.7291 6.1625 6.1625 8.7239 8.7239 9.8018 9.8018 9.9613 9.9613 11.1216 11.1216 13.6257 13.6257 13.6472 13.6472 k = 0.7705-0.5576 0.5839 ( 3890 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.1605 4.1605 5.5596 5.5596 5.7349 5.7349 6.1490 6.1490 8.7437 8.7437 9.7792 9.7792 10.0089 10.0089 11.0659 11.0659 13.6291 13.6291 13.7149 13.7149 k = 0.7563-0.5628 0.5893 ( 3894 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.1258 4.1258 5.6103 5.6103 5.7408 5.7408 6.1354 6.1354 8.7532 8.7532 9.7566 9.7566 10.0581 10.0581 11.0265 11.0265 13.6296 13.6296 13.7886 13.7886 k = 0.7421-0.5680 0.5947 ( 3900 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0282 -22.0282 4.0922 4.0922 5.6625 5.6625 5.7468 5.7468 6.1220 6.1220 8.7513 8.7513 9.7342 9.7342 10.1085 10.1085 11.0046 11.0046 13.6299 13.6299 13.8652 13.8652 k = 0.7278-0.5731 0.6001 ( 3902 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0281 -22.0281 4.0598 4.0598 5.7162 5.7162 5.7528 5.7528 6.1088 6.1088 8.7374 8.7374 9.7123 9.7123 10.1599 10.1599 11.0007 11.0007 13.6300 13.6300 13.9442 13.9442 k = 0.7136-0.5783 0.6056 ( 3902 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0542 -22.0542 -22.0281 -22.0281 4.0287 4.0287 5.7587 5.7587 5.7712 5.7712 6.0959 6.0959 8.7116 8.7116 9.6909 9.6909 10.2120 10.2120 11.0145 11.0145 13.6302 13.6302 13.9804 13.9804 k = 0.6993-0.5835 0.6110 ( 3906 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0541 -22.0541 -22.0281 -22.0281 3.9992 3.9992 5.7645 5.7645 5.8273 5.8273 6.0835 6.0835 8.6746 8.6746 9.6702 9.6702 10.2644 10.2644 11.0450 11.0450 13.6302 13.6302 13.8857 13.8857 k = 0.6851-0.5887 0.6164 ( 3906 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0541 -22.0541 -22.0281 -22.0281 3.9712 3.9712 5.7702 5.7702 5.8844 5.8844 6.0716 6.0716 8.6279 8.6279 9.6503 9.6503 10.3169 10.3169 11.0908 11.0908 13.6302 13.6302 13.7935 13.7935 k = 0.6709-0.5938 0.6218 ( 3914 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0541 -22.0541 -22.0281 -22.0281 3.9450 3.9450 5.7757 5.7757 5.9422 5.9422 6.0602 6.0602 8.5733 8.5733 9.6314 9.6314 10.3689 10.3689 11.1499 11.1499 13.6297 13.6297 13.7052 13.7052 k = 0.6566-0.5990 0.6272 ( 3918 PWs) bands (ev): -45.9717 -45.9717 -22.6946 -22.6946 -22.0541 -22.0541 -22.0281 -22.0281 3.9205 3.9205 5.7810 5.7810 6.0003 6.0003 6.0495 6.0495 8.5125 8.5125 9.6136 9.6136 10.4201 10.4201 11.2205 11.2205 13.6148 13.6148 13.6353 13.6353 k = 0.6424-0.6042 0.6327 ( 3922 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8979 3.8979 5.7860 5.7860 6.0392 6.0392 6.0587 6.0587 8.4475 8.4475 9.5970 9.5970 10.4700 10.4700 11.3002 11.3002 13.5381 13.5381 13.6316 13.6316 k = 0.6281-0.6094 0.6381 ( 3926 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8772 3.8772 5.7907 5.7907 6.0302 6.0302 6.1159 6.1159 8.3803 8.3803 9.5816 9.5816 10.5180 10.5180 11.3872 11.3872 13.4628 13.4628 13.6313 13.6313 k = 0.6139-0.6146 0.6435 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8585 3.8585 5.7950 5.7950 6.0218 6.0218 6.1720 6.1720 8.3127 8.3127 9.5676 9.5676 10.5636 10.5636 11.4792 11.4792 13.3928 13.3928 13.6310 13.6310 k = 0.5997-0.6197 0.6489 ( 3932 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8419 3.8419 5.7988 5.7988 6.0143 6.0143 6.2261 6.2261 8.2466 8.2466 9.5550 9.5550 10.6062 10.6062 11.5741 11.5741 13.3287 13.3287 13.6303 13.6303 k = 0.5854-0.6249 0.6543 ( 3928 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8275 3.8275 5.8023 5.8023 6.0077 6.0077 6.2771 6.2771 8.1836 8.1836 9.5440 9.5440 10.6451 10.6451 11.6696 11.6696 13.2712 13.2712 13.5991 13.5991 k = 0.5712-0.6301 0.6598 ( 3928 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8151 3.8151 5.8053 5.8053 6.0020 6.0020 6.3239 6.3239 8.1257 8.1257 9.5346 9.5346 10.6795 10.6795 11.7628 11.7628 13.2210 13.2210 13.5118 13.5118 k = 0.5570-0.6353 0.6652 ( 3936 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.8050 3.8050 5.8077 5.8077 5.9974 5.9974 6.3652 6.3652 8.0747 8.0747 9.5268 9.5268 10.7089 10.7089 11.8504 11.8504 13.1788 13.1788 13.4283 13.4283 k = 0.5427-0.6404 0.6706 ( 3936 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7971 3.7971 5.8097 5.8097 5.9937 5.9937 6.3995 6.3995 8.0325 8.0325 9.5207 9.5207 10.7326 10.7326 11.9280 11.9280 13.1451 13.1451 13.3540 13.3540 k = 0.5285-0.6456 0.6760 ( 3936 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7914 3.7914 5.8111 5.8111 5.9911 5.9911 6.4253 6.4253 8.0008 8.0008 9.5163 9.5163 10.7499 10.7499 11.9902 11.9902 13.1206 13.1206 13.2942 13.2942 k = 0.5142-0.6508 0.6814 ( 3932 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7880 3.7880 5.8119 5.8119 5.9895 5.9895 6.4414 6.4414 7.9811 7.9811 9.5137 9.5137 10.7605 10.7605 12.0311 12.0311 13.1056 13.1056 13.2549 13.2549 k = 0.5000-0.6560 0.6869 ( 3924 PWs) bands (ev): -45.9717 -45.9717 -22.6945 -22.6945 -22.0541 -22.0541 -22.0281 -22.0281 3.7869 3.7869 5.8122 5.8122 5.9890 5.9890 6.4469 6.4469 7.9744 7.9744 9.5128 9.5128 10.7641 10.7641 12.0454 12.0454 13.1006 13.1006 13.2411 13.2411 k = 0.5000 0.1818 0.6483 ( 3928 PWs) bands (ev): -45.9817 -45.9817 -22.6714 -22.6714 -22.0553 -22.0553 -21.9625 -21.9625 2.3229 2.3229 2.4023 2.4023 7.1282 7.1282 7.3395 7.3395 10.1597 10.1597 11.0985 11.0985 12.0760 12.0760 13.2155 13.2155 13.9728 13.9728 13.9802 13.9802 k = 0.4904 0.1783 0.6358 ( 3927 PWs) bands (ev): -45.9817 -45.9817 -22.6714 -22.6714 -22.0553 -22.0553 -21.9625 -21.9625 2.2325 2.2325 2.4941 2.4941 7.1132 7.1132 7.3565 7.3565 10.1585 10.1585 11.0988 11.0988 12.0735 12.0735 13.2150 13.2150 13.9715 13.9715 13.9794 13.9794 k = 0.4808 0.1748 0.6234 ( 3926 PWs) bands (ev): -45.9817 -45.9817 -22.6713 -22.6713 -22.0551 -22.0551 -21.9624 -21.9624 2.1130 2.1130 2.6176 2.6176 7.0777 7.0777 7.3982 7.3982 10.1548 10.1548 11.0998 11.0998 12.0659 12.0659 13.2136 13.2136 13.9679 13.9679 13.9766 13.9766 k = 0.4712 0.1713 0.6109 ( 3928 PWs) bands (ev): -45.9818 -45.9818 -22.6711 -22.6711 -22.0548 -22.0548 -21.9624 -21.9624 1.9930 1.9930 2.7443 2.7443 7.0341 7.0341 7.4520 7.4520 10.1487 10.1487 11.1013 11.1013 12.0534 12.0534 13.2111 13.2111 13.9622 13.9622 13.9714 13.9714 k = 0.4615 0.1678 0.5984 ( 3927 PWs) bands (ev): -45.9818 -45.9818 -22.6708 -22.6708 -22.0545 -22.0545 -21.9624 -21.9624 1.8742 1.8742 2.8724 2.8724 6.9884 6.9884 7.5119 7.5119 10.1401 10.1401 11.1035 11.1035 12.0363 12.0363 13.2075 13.2075 13.9545 13.9545 13.9635 13.9635 k = 0.4519 0.1643 0.5860 ( 3929 PWs) bands (ev): -45.9819 -45.9819 -22.6705 -22.6705 -22.0540 -22.0540 -21.9624 -21.9624 1.7567 1.7567 3.0016 3.0016 6.9433 6.9433 7.5751 7.5751 10.1292 10.1292 11.1062 11.1062 12.0151 12.0151 13.2027 13.2027 13.9434 13.9434 13.9538 13.9538 k = 0.4423 0.1608 0.5735 ( 3929 PWs) bands (ev): -45.9820 -45.9820 -22.6701 -22.6701 -22.0534 -22.0534 -21.9623 -21.9623 1.6409 1.6409 3.1317 3.1317 6.8999 6.8999 7.6404 7.6404 10.1160 10.1160 11.1095 11.1095 11.9903 11.9903 13.1966 13.1966 13.9266 13.9266 13.9441 13.9441 k = 0.4327 0.1573 0.5610 ( 3925 PWs) bands (ev): -45.9821 -45.9821 -22.6697 -22.6697 -22.0528 -22.0528 -21.9623 -21.9623 1.5269 1.5269 3.2623 3.2623 6.8590 6.8590 7.7070 7.7070 10.1006 10.1006 11.1133 11.1133 11.9625 11.9625 13.1888 13.1888 13.9036 13.9036 13.9347 13.9347 k = 0.4231 0.1538 0.5486 ( 3925 PWs) bands (ev): -45.9823 -45.9823 -22.6692 -22.6692 -22.0520 -22.0520 -21.9622 -21.9622 1.4146 1.4146 3.3932 3.3932 6.8211 6.8211 7.7741 7.7741 10.0831 10.0831 11.1174 11.1174 11.9322 11.9322 13.1792 13.1792 13.8749 13.8749 13.9254 13.9254 k = 0.4135 0.1503 0.5361 ( 3923 PWs) bands (ev): -45.9824 -45.9824 -22.6686 -22.6686 -22.0512 -22.0512 -21.9622 -21.9622 1.3042 1.3042 3.5243 3.5243 6.7865 6.7865 7.8412 7.8412 10.0639 10.0639 11.1217 11.1217 11.9003 11.9003 13.1675 13.1675 13.8412 13.8412 13.9163 13.9163 k = 0.4038 0.1468 0.5236 ( 3924 PWs) bands (ev): -45.9826 -45.9826 -22.6680 -22.6680 -22.0502 -22.0502 -21.9621 -21.9621 1.1958 1.1958 3.6551 3.6551 6.7557 6.7557 7.9077 7.9077 10.0433 10.0433 11.1259 11.1259 11.8676 11.8676 13.1536 13.1536 13.8038 13.8039 13.9075 13.9075 k = 0.3942 0.1433 0.5112 ( 3926 PWs) bands (ev): -45.9828 -45.9828 -22.6673 -22.6673 -22.0492 -22.0492 -21.9620 -21.9620 1.0893 1.0893 3.7854 3.7854 6.7290 6.7290 7.9729 7.9729 10.0215 10.0215 11.1296 11.1296 11.8349 11.8349 13.1372 13.1372 13.7646 13.7646 13.8993 13.8993 k = 0.3846 0.1398 0.4987 ( 3928 PWs) bands (ev): -45.9830 -45.9830 -22.6666 -22.6666 -22.0481 -22.0481 -21.9618 -21.9618 0.9848 0.9848 3.9149 3.9149 6.7067 6.7067 8.0362 8.0362 9.9992 9.9992 11.1323 11.1323 11.8032 11.8032 13.1182 13.1182 13.7251 13.7251 13.8918 13.8918 k = 0.3750 0.1363 0.4862 ( 3930 PWs) bands (ev): -45.9832 -45.9832 -22.6658 -22.6658 -22.0470 -22.0470 -21.9617 -21.9617 0.8825 0.8825 4.0430 4.0430 6.6894 6.6894 8.0967 8.0967 9.9769 9.9769 11.1333 11.1333 11.7736 11.7736 13.0967 13.0967 13.6870 13.6870 13.8854 13.8854 k = 0.3654 0.1328 0.4738 ( 3923 PWs) bands (ev): -45.9834 -45.9834 -22.6650 -22.6650 -22.0457 -22.0457 -21.9615 -21.9615 0.7822 0.7822 4.1693 4.1693 6.6775 6.6775 8.1536 8.1536 9.9554 9.9554 11.1320 11.1320 11.7472 11.7472 13.0728 13.0728 13.6512 13.6512 13.8803 13.8803 k = 0.3558 0.1294 0.4613 ( 3926 PWs) bands (ev): -45.9836 -45.9836 -22.6642 -22.6642 -22.0445 -22.0445 -21.9613 -21.9613 0.6841 0.6841 4.2932 4.2932 6.6715 6.6715 8.2060 8.2060 9.9355 9.9355 11.1274 11.1274 11.7251 11.7251 13.0469 13.0469 13.6187 13.6187 13.8766 13.8766 k = 0.3462 0.1259 0.4488 ( 3925 PWs) bands (ev): -45.9839 -45.9839 -22.6633 -22.6633 -22.0431 -22.0431 -21.9611 -21.9611 0.5882 0.5882 4.4140 4.4140 6.6720 6.6720 8.2528 8.2528 9.9181 9.9181 11.1189 11.1189 11.7084 11.7084 13.0196 13.0196 13.5896 13.5896 13.8747 13.8747 k = 0.3365 0.1224 0.4364 ( 3919 PWs) bands (ev): -45.9842 -45.9842 -22.6624 -22.6624 -22.0418 -22.0418 -21.9608 -21.9608 0.4945 0.4945 4.5311 4.5311 6.6796 6.6796 8.2931 8.2931 9.9042 9.9042 11.1058 11.1058 11.6979 11.6979 12.9915 12.9915 13.5642 13.5642 13.8747 13.8747 k = 0.3269 0.1189 0.4239 ( 3921 PWs) bands (ev): -45.9844 -45.9844 -22.6614 -22.6614 -22.0404 -22.0404 -21.9605 -21.9605 0.4031 0.4031 4.6438 4.6438 6.6949 6.6949 8.3259 8.3259 9.8946 9.8946 11.0878 11.0878 11.6942 11.6942 12.9636 12.9636 13.5423 13.5423 13.8767 13.8767 k = 0.3173 0.1154 0.4114 ( 3920 PWs) bands (ev): -45.9847 -45.9847 -22.6605 -22.6605 -22.0389 -22.0389 -21.9602 -21.9602 0.3140 0.3140 4.7512 4.7512 6.7186 6.7186 8.3504 8.3504 9.8901 9.8901 11.0652 11.0652 11.6971 11.6971 12.9364 12.9364 13.5237 13.5237 13.8810 13.8810 k = 0.3077 0.1119 0.3990 ( 3917 PWs) bands (ev): -45.9850 -45.9850 -22.6595 -22.6595 -22.0375 -22.0375 -21.9598 -21.9598 0.2272 0.2272 4.8526 4.8526 6.7511 6.7511 8.3659 8.3659 9.8912 9.8912 11.0384 11.0384 11.7064 11.7064 12.9107 12.9107 13.5082 13.5082 13.8876 13.8876 k = 0.2981 0.1084 0.3865 ( 3916 PWs) bands (ev): -45.9853 -45.9853 -22.6585 -22.6585 -22.0360 -22.0360 -21.9593 -21.9593 0.1428 0.1428 4.9474 4.9474 6.7931 6.7931 8.3724 8.3724 9.8983 9.8983 11.0079 11.0079 11.7216 11.7216 12.8873 12.8873 13.4956 13.4956 13.8965 13.8965 k = 0.2885 0.1049 0.3740 ( 3916 PWs) bands (ev): -45.9856 -45.9856 -22.6575 -22.6575 -22.0346 -22.0346 -21.9588 -21.9588 0.0608 0.0608 5.0350 5.0350 6.8445 6.8445 8.3699 8.3699 9.9111 9.9111 10.9747 10.9747 11.7419 11.7419 12.8665 12.8665 13.4857 13.4857 13.9081 13.9081 k = 0.2788 0.1014 0.3615 ( 3918 PWs) bands (ev): -45.9859 -45.9859 -22.6565 -22.6565 -22.0331 -22.0331 -21.9583 -21.9583 -0.0189 -0.0189 5.1152 5.1152 6.9053 6.9053 8.3592 8.3592 9.9293 9.9293 10.9395 10.9395 11.7667 11.7667 12.8490 12.8490 13.4784 13.4784 13.9222 13.9222 k = 0.2692 0.0979 0.3491 ( 3914 PWs) bands (ev): -45.9862 -45.9862 -22.6555 -22.6555 -22.0317 -22.0317 -21.9577 -21.9577 -0.0961 -0.0961 5.1880 5.1880 6.9749 6.9749 8.3413 8.3413 9.9520 9.9520 10.9029 10.9029 11.7953 11.7953 12.8349 12.8349 13.4736 13.4736 13.9390 13.9390 k = 0.2596 0.0944 0.3366 ( 3914 PWs) bands (ev): -45.9865 -45.9865 -22.6545 -22.6545 -22.0303 -22.0303 -21.9570 -21.9570 -0.1708 -0.1708 5.2538 5.2538 7.0523 7.0523 8.3177 8.3177 9.9783 9.9783 10.8656 10.8656 11.8271 11.8271 12.8246 12.8246 13.4713 13.4713 13.9586 13.9586 k = 0.2500 0.0909 0.3241 ( 3912 PWs) bands (ev): -45.9868 -45.9868 -22.6535 -22.6535 -22.0290 -22.0290 -21.9563 -21.9563 -0.2430 -0.2430 5.3129 5.3129 7.1357 7.1357 8.2903 8.2903 10.0072 10.0072 10.8281 10.8281 11.8617 11.8617 12.8183 12.8183 13.4713 13.4713 13.9810 13.9810 k = 0.2404 0.0874 0.3117 ( 3912 PWs) bands (ev): -45.9871 -45.9871 -22.6525 -22.6525 -22.0277 -22.0277 -21.9555 -21.9555 -0.3127 -0.3127 5.3661 5.3661 7.2228 7.2228 8.2615 8.2615 10.0376 10.0376 10.7908 10.7908 11.8987 11.8987 12.8160 12.8160 13.4736 13.4736 14.0062 14.0062 k = 0.2308 0.0839 0.2992 ( 3912 PWs) bands (ev): -45.9874 -45.9874 -22.6516 -22.6516 -22.0264 -22.0264 -21.9547 -21.9547 -0.3798 -0.3798 5.4142 5.4142 7.3100 7.3100 8.2350 8.2350 10.0685 10.0685 10.7542 10.7542 11.9377 11.9377 12.8176 12.8176 13.4781 13.4781 14.0340 14.0340 k = 0.2212 0.0804 0.2867 ( 3912 PWs) bands (ev): -45.9877 -45.9877 -22.6506 -22.6506 -22.0252 -22.0252 -21.9538 -21.9538 -0.4444 -0.4444 5.4580 5.4580 7.3925 7.3925 8.2153 8.2153 10.0991 10.0991 10.7185 10.7185 11.9783 11.9783 12.8232 12.8232 13.4846 13.4846 14.0641 14.0641 k = 0.2115 0.0769 0.2743 ( 3913 PWs) bands (ev): -45.9881 -45.9881 -22.6497 -22.6497 -22.0241 -22.0241 -21.9529 -21.9529 -0.5064 -0.5064 5.4984 5.4984 7.4632 7.4632 8.2090 8.2090 10.1286 10.1286 10.6841 10.6841 12.0204 12.0204 12.8326 12.8326 13.4929 13.4929 14.0956 14.0956 k = 0.2019 0.0734 0.2618 ( 3910 PWs) bands (ev): -45.9884 -45.9884 -22.6488 -22.6488 -22.0230 -22.0230 -21.9519 -21.9519 -0.5659 -0.5659 5.5362 5.5362 7.5143 7.5143 8.2238 8.2238 10.1566 10.1566 10.6514 10.6514 12.0636 12.0636 12.8455 12.8455 13.5028 13.5028 14.1271 14.1271 k = 0.1923 0.0699 0.2493 ( 3909 PWs) bands (ev): -45.9886 -45.9886 -22.6479 -22.6479 -22.0220 -22.0220 -21.9509 -21.9509 -0.6226 -0.6226 5.5719 5.5719 7.5397 7.5397 8.2653 8.2653 10.1824 10.1824 10.6205 10.6205 12.1077 12.1077 12.8619 12.8619 13.5141 13.5141 14.1568 14.1568 k = 0.1827 0.0664 0.2369 ( 3910 PWs) bands (ev): -45.9889 -45.9889 -22.6470 -22.6470 -22.0210 -22.0210 -21.9499 -21.9499 -0.6768 -0.6768 5.6062 5.6062 7.5389 7.5389 8.3334 8.3334 10.2060 10.2060 10.5917 10.5917 12.1526 12.1526 12.8814 12.8814 13.5266 13.5266 14.1829 14.1829 k = 0.1731 0.0629 0.2244 ( 3912 PWs) bands (ev): -45.9892 -45.9892 -22.6462 -22.6462 -22.0201 -22.0201 -21.9488 -21.9488 -0.7282 -0.7282 5.6396 5.6396 7.5168 7.5168 8.4226 8.4226 10.2270 10.2270 10.5654 10.5654 12.1979 12.1979 12.9040 12.9040 13.5398 13.5398 14.2049 14.2049 k = 0.1635 0.0594 0.2119 ( 3914 PWs) bands (ev): -45.9895 -45.9895 -22.6454 -22.6454 -22.0193 -22.0193 -21.9477 -21.9477 -0.7770 -0.7770 5.6726 5.6726 7.4797 7.4797 8.5261 8.5261 10.2455 10.2455 10.5417 10.5417 12.2436 12.2436 12.9295 12.9295 13.5537 13.5537 14.2233 14.2233 k = 0.1538 0.0559 0.1995 ( 3911 PWs) bands (ev): -45.9897 -45.9897 -22.6447 -22.6447 -22.0186 -22.0186 -21.9466 -21.9466 -0.8231 -0.8231 5.7054 5.7054 7.4326 7.4326 8.6380 8.6380 10.2616 10.2616 10.5210 10.5210 12.2893 12.2893 12.9577 12.9577 13.5679 13.5679 14.2392 14.2392 k = 0.1442 0.0524 0.1870 ( 3910 PWs) bands (ev): -45.9900 -45.9900 -22.6440 -22.6440 -22.0179 -22.0179 -21.9455 -21.9455 -0.8665 -0.8665 5.7384 5.7384 7.3791 7.3791 8.7541 8.7541 10.2755 10.2755 10.5035 10.5035 12.3349 12.3349 12.9887 12.9887 13.5823 13.5823 14.2536 14.2536 k = 0.1346 0.0489 0.1745 ( 3910 PWs) bands (ev): -45.9902 -45.9902 -22.6433 -22.6433 -22.0173 -22.0173 -21.9444 -21.9444 -0.9071 -0.9071 5.7717 5.7717 7.3215 7.3215 8.8710 8.8710 10.2877 10.2877 10.4894 10.4894 12.3801 12.3801 13.0225 13.0225 13.5966 13.5966 14.2672 14.2672 k = 0.1250 0.0454 0.1621 ( 3907 PWs) bands (ev): -45.9905 -45.9905 -22.6427 -22.6427 -22.0167 -22.0167 -21.9433 -21.9433 -0.9450 -0.9450 5.8057 5.8057 7.2615 7.2615 8.9862 8.9862 10.2985 10.2985 10.4788 10.4788 12.4245 12.4245 13.0592 13.0592 13.6107 13.6107 14.2805 14.2805 k = 0.1154 0.0420 0.1496 ( 3907 PWs) bands (ev): -45.9907 -45.9907 -22.6421 -22.6421 -22.0162 -22.0162 -21.9423 -21.9423 -0.9801 -0.9801 5.8403 5.8403 7.2000 7.2000 9.0972 9.0972 10.3086 10.3086 10.4719 10.4719 12.4678 12.4678 13.0989 13.0989 13.6244 13.6244 14.2937 14.2937 k = 0.1058 0.0385 0.1371 ( 3908 PWs) bands (ev): -45.9909 -45.9909 -22.6415 -22.6415 -22.0158 -22.0158 -21.9413 -21.9413 -1.0125 -1.0125 5.8756 5.8756 7.1380 7.1380 9.2021 9.2021 10.3186 10.3186 10.4688 10.4688 12.5098 12.5098 13.1418 13.1418 13.6379 13.6379 14.3071 14.3071 k = 0.0962 0.0350 0.1247 ( 3911 PWs) bands (ev): -45.9911 -45.9911 -22.6410 -22.6410 -22.0154 -22.0154 -21.9404 -21.9404 -1.0421 -1.0421 5.9117 5.9117 7.0762 7.0762 9.2988 9.2988 10.3288 10.3288 10.4700 10.4700 12.5500 12.5500 13.1880 13.1880 13.6509 13.6509 14.3207 14.3207 k = 0.0865 0.0315 0.1122 ( 3911 PWs) bands (ev): -45.9912 -45.9912 -22.6406 -22.6406 -22.0150 -22.0150 -21.9395 -21.9395 -1.0689 -1.0689 5.9486 5.9486 7.0149 7.0149 9.3859 9.3859 10.3390 10.3390 10.4759 10.4759 12.5881 12.5881 13.2377 13.2377 13.6635 13.6635 14.3345 14.3345 k = 0.0769 0.0280 0.0997 ( 3911 PWs) bands (ev): -45.9914 -45.9914 -22.6401 -22.6401 -22.0147 -22.0147 -21.9387 -21.9387 -1.0930 -1.0930 5.9860 5.9860 6.9549 6.9549 9.4619 9.4619 10.3486 10.3486 10.4872 10.4872 12.6236 12.6236 13.2906 13.2906 13.6760 13.6760 14.3486 14.3486 k = 0.0673 0.0245 0.0873 ( 3909 PWs) bands (ev): -45.9915 -45.9915 -22.6398 -22.6398 -22.0145 -22.0145 -21.9380 -21.9380 -1.1142 -1.1142 6.0238 6.0238 6.8965 6.8965 9.5263 9.5263 10.3569 10.3569 10.5041 10.5041 12.6561 12.6561 13.3465 13.3465 13.6884 13.6884 14.3626 14.3626 k = 0.0577 0.0210 0.0748 ( 3905 PWs) bands (ev): -45.9916 -45.9916 -22.6395 -22.6395 -22.0143 -22.0143 -21.9373 -21.9373 -1.1326 -1.1326 6.0615 6.0615 6.8405 6.8405 9.5791 9.5791 10.3633 10.3633 10.5259 10.5259 12.6853 12.6853 13.4044 13.4044 13.7012 13.7012 14.3759 14.3759 k = 0.0481 0.0175 0.0623 ( 3906 PWs) bands (ev): -45.9917 -45.9917 -22.6392 -22.6392 -22.0141 -22.0141 -21.9367 -21.9367 -1.1481 -1.1481 6.0986 6.0986 6.7877 6.7877 9.6208 9.6208 10.3680 10.3680 10.5505 10.5505 12.7108 12.7108 13.4623 13.4623 13.7154 13.7154 14.3868 14.3868 k = 0.0385 0.0140 0.0499 ( 3906 PWs) bands (ev): -45.9918 -45.9918 -22.6390 -22.6390 -22.0139 -22.0139 -21.9363 -21.9363 -1.1609 -1.1609 6.1340 6.1340 6.7392 6.7392 9.6526 9.6526 10.3712 10.3712 10.5756 10.5756 12.7322 12.7322 13.5169 13.5169 13.7323 13.7323 14.3910 14.3910 k = 0.0288 0.0105 0.0374 ( 3905 PWs) bands (ev): -45.9919 -45.9919 -22.6388 -22.6388 -22.0138 -22.0138 -21.9359 -21.9359 -1.1708 -1.1708 6.1662 6.1662 6.6967 6.6967 9.6758 9.6758 10.3733 10.3733 10.5983 10.5983 12.7492 12.7492 13.5631 13.5631 13.7534 13.7534 14.3833 14.3833 k = 0.0192 0.0070 0.0249 ( 3900 PWs) bands (ev): -45.9919 -45.9919 -22.6387 -22.6387 -22.0138 -22.0138 -21.9356 -21.9356 -1.1779 -1.1779 6.1929 6.1929 6.6625 6.6625 9.6913 9.6913 10.3746 10.3746 10.6164 10.6164 12.7615 12.7615 13.5963 13.5963 13.7778 13.7778 14.3678 14.3678 k = 0.0096 0.0035 0.0125 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9355 -21.9355 -1.1822 -1.1822 6.2111 6.2111 6.6399 6.6399 9.7003 9.7003 10.3753 10.3753 10.6280 10.6280 12.7690 12.7690 13.6150 13.6150 13.7991 13.7991 14.3537 14.3537 k = 0.0000 0.0000 0.0000 ( 3899 PWs) bands (ev): -45.9920 -45.9920 -22.6386 -22.6386 -22.0137 -22.0137 -21.9354 -21.9354 -1.1836 -1.1836 6.2176 6.2176 6.6319 6.6319 9.7032 9.7032 10.3755 10.3755 10.6320 10.6320 12.7715 12.7715 13.6210 13.6210 13.8078 13.8078 14.3480 14.3480 Writing output data file TiSi2.save init_run : 0.13s CPU 5.16s WALL ( 1 calls) electrons : 160.61s CPU 166.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.00s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 160.60s CPU 166.27s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.03s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 536 calls) cegterg : 151.39s CPU 153.81s WALL ( 837 calls) Called by sum_band: Called by *egterg: h_psi : 96.97s CPU 98.57s WALL ( 14418 calls) s_psi : 3.28s CPU 3.29s WALL ( 14418 calls) g_psi : 0.28s CPU 0.30s WALL ( 13045 calls) cdiaghg : 43.70s CPU 44.56s WALL ( 13581 calls) cegterg:over : 4.95s CPU 4.89s WALL ( 13045 calls) cegterg:upda : 3.62s CPU 3.84s WALL ( 13045 calls) cegterg:last : 2.46s CPU 2.48s WALL ( 2915 calls) cdiaghg:chol : 2.43s CPU 2.45s WALL ( 13581 calls) cdiaghg:inve : 0.88s CPU 0.89s WALL ( 13581 calls) cdiaghg:para : 2.60s CPU 2.78s WALL ( 27162 calls) Called by h_psi: h_psi:vloc : 86.83s CPU 88.36s WALL ( 14418 calls) h_psi:vnl : 9.97s CPU 10.05s WALL ( 14418 calls) add_vuspsi : 5.42s CPU 5.37s WALL ( 14418 calls) General routines calbec : 4.50s CPU 4.65s WALL ( 14418 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 82.40s CPU 83.66s WALL ( 986292 calls) davcio : 0.16s CPU 0.20s WALL ( 1072 calls) Parallel routines fft_scatter : 26.52s CPU 26.70s WALL ( 986307 calls) PWSCF : 2m55.15s CPU 4m21.59s WALL This run was terminated on: 21:21:21 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=