Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 16:38: 4 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: ./YInAg2.save/ file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 42 29 8 1087 645 100 Max 43 30 9 1090 659 105 Sum 1519 1069 313 39189 23505 3695 bravais-lattice index = 14 lattice parameter (alat) = 9.2387 a.u. unit-cell volume = 557.6024 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.238750 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for In read from file: /users/gautes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1241 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 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 In 13.00 114.81800 In( 1.00) Ag 11.00 107.86820 Ag( 1.00) Y 11.00 88.90590 Y( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 308 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0108696 -0.0062755 0.0088750), wk = 0.0032468 k( 3) = ( 0.0217391 -0.0125511 0.0177499), wk = 0.0032468 k( 4) = ( 0.0326087 -0.0188266 0.0266249), wk = 0.0032468 k( 5) = ( 0.0434783 -0.0251022 0.0354999), wk = 0.0032468 k( 6) = ( 0.0543478 -0.0313777 0.0443748), wk = 0.0032468 k( 7) = ( 0.0652174 -0.0376533 0.0532498), wk = 0.0032468 k( 8) = ( 0.0760870 -0.0439288 0.0621247), wk = 0.0032468 k( 9) = ( 0.0869565 -0.0502044 0.0709997), wk = 0.0032468 k( 10) = ( 0.0978261 -0.0564799 0.0798747), wk = 0.0032468 k( 11) = ( 0.1086957 -0.0627555 0.0887496), wk = 0.0032468 k( 12) = ( 0.1195652 -0.0690310 0.0976246), wk = 0.0032468 k( 13) = ( 0.1304348 -0.0753066 0.1064996), wk = 0.0032468 k( 14) = ( 0.1413043 -0.0815821 0.1153745), wk = 0.0032468 k( 15) = ( 0.1521739 -0.0878576 0.1242495), wk = 0.0032468 k( 16) = ( 0.1630435 -0.0941332 0.1331244), wk = 0.0032468 k( 17) = ( 0.1739130 -0.1004087 0.1419994), wk = 0.0032468 k( 18) = ( 0.1847826 -0.1066843 0.1508744), wk = 0.0032468 k( 19) = ( 0.1956522 -0.1129598 0.1597493), wk = 0.0032468 k( 20) = ( 0.2065217 -0.1192354 0.1686243), wk = 0.0032468 k( 21) = ( 0.2173913 -0.1255109 0.1774993), wk = 0.0032468 k( 22) = ( 0.2282609 -0.1317865 0.1863742), wk = 0.0032468 k( 23) = ( 0.2391304 -0.1380620 0.1952492), wk = 0.0032468 k( 24) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0032468 k( 25) = ( 0.2608696 -0.1506131 0.2129991), wk = 0.0032468 k( 26) = ( 0.2717391 -0.1568887 0.2218741), wk = 0.0032468 k( 27) = ( 0.2826087 -0.1631642 0.2307490), wk = 0.0032468 k( 28) = ( 0.2934783 -0.1694398 0.2396240), wk = 0.0032468 k( 29) = ( 0.3043478 -0.1757153 0.2484990), wk = 0.0032468 k( 30) = ( 0.3152174 -0.1819908 0.2573739), wk = 0.0032468 k( 31) = ( 0.3260870 -0.1882664 0.2662489), wk = 0.0032468 k( 32) = ( 0.3369565 -0.1945419 0.2751238), wk = 0.0032468 k( 33) = ( 0.3478261 -0.2008175 0.2839988), wk = 0.0032468 k( 34) = ( 0.3586956 -0.2070930 0.2928738), wk = 0.0032468 k( 35) = ( 0.3695652 -0.2133686 0.3017487), wk = 0.0032468 k( 36) = ( 0.3804348 -0.2196441 0.3106237), wk = 0.0032468 k( 37) = ( 0.3913044 -0.2259197 0.3194987), wk = 0.0032468 k( 38) = ( 0.4021739 -0.2321952 0.3283736), wk = 0.0032468 k( 39) = ( 0.4130435 -0.2384708 0.3372486), wk = 0.0032468 k( 40) = ( 0.4239130 -0.2447463 0.3461235), wk = 0.0032468 k( 41) = ( 0.4347826 -0.2510219 0.3549985), wk = 0.0032468 k( 42) = ( 0.4456522 -0.2572974 0.3638735), wk = 0.0032468 k( 43) = ( 0.4565217 -0.2635729 0.3727484), wk = 0.0032468 k( 44) = ( 0.4673913 -0.2698485 0.3816234), wk = 0.0032468 k( 45) = ( 0.4782609 -0.2761240 0.3904984), wk = 0.0032468 k( 46) = ( 0.4891304 -0.2823996 0.3993733), wk = 0.0032468 k( 47) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 k( 48) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 k( 49) = ( 0.5000000 -0.2761240 0.4171233), wk = 0.0032468 k( 50) = ( 0.5000000 -0.2635729 0.4259982), wk = 0.0032468 k( 51) = ( 0.5000000 -0.2510219 0.4348732), wk = 0.0032468 k( 52) = ( 0.5000000 -0.2384708 0.4437481), wk = 0.0032468 k( 53) = ( 0.5000000 -0.2259197 0.4526231), wk = 0.0032468 k( 54) = ( 0.5000000 -0.2133686 0.4614981), wk = 0.0032468 k( 55) = ( 0.5000000 -0.2008175 0.4703730), wk = 0.0032468 k( 56) = ( 0.5000000 -0.1882664 0.4792480), wk = 0.0032468 k( 57) = ( 0.5000000 -0.1757153 0.4881230), wk = 0.0032468 k( 58) = ( 0.5000000 -0.1631642 0.4969979), wk = 0.0032468 k( 59) = ( 0.5000000 -0.1506131 0.5058729), wk = 0.0032468 k( 60) = ( 0.5000000 -0.1380620 0.5147478), wk = 0.0032468 k( 61) = ( 0.5000000 -0.1255109 0.5236228), wk = 0.0032468 k( 62) = ( 0.5000000 -0.1129598 0.5324978), wk = 0.0032468 k( 63) = ( 0.5000000 -0.1004087 0.5413727), wk = 0.0032468 k( 64) = ( 0.5000000 -0.0878577 0.5502477), wk = 0.0032468 k( 65) = ( 0.5000000 -0.0753066 0.5591227), wk = 0.0032468 k( 66) = ( 0.5000000 -0.0627555 0.5679976), wk = 0.0032468 k( 67) = ( 0.5000000 -0.0502044 0.5768726), wk = 0.0032468 k( 68) = ( 0.5000000 -0.0376533 0.5857475), wk = 0.0032468 k( 69) = ( 0.5000000 -0.0251022 0.5946225), wk = 0.0032468 k( 70) = ( 0.5000000 -0.0125511 0.6034975), wk = 0.0032468 k( 71) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0032468 k( 72) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0032468 k( 73) = ( 0.4926471 0.0127357 0.6123724), wk = 0.0032468 k( 74) = ( 0.4852941 0.0254713 0.6123724), wk = 0.0032468 k( 75) = ( 0.4779412 0.0382070 0.6123724), wk = 0.0032468 k( 76) = ( 0.4705882 0.0509427 0.6123724), wk = 0.0032468 k( 77) = ( 0.4632353 0.0636783 0.6123724), wk = 0.0032468 k( 78) = ( 0.4558823 0.0764140 0.6123724), wk = 0.0032468 k( 79) = ( 0.4485294 0.0891497 0.6123724), wk = 0.0032468 k( 80) = ( 0.4411765 0.1018853 0.6123724), wk = 0.0032468 k( 81) = ( 0.4338235 0.1146210 0.6123724), wk = 0.0032468 k( 82) = ( 0.4264706 0.1273567 0.6123724), wk = 0.0032468 k( 83) = ( 0.4191177 0.1400923 0.6123724), wk = 0.0032468 k( 84) = ( 0.4117647 0.1528280 0.6123724), wk = 0.0032468 k( 85) = ( 0.4044118 0.1655637 0.6123724), wk = 0.0032468 k( 86) = ( 0.3970588 0.1782994 0.6123724), wk = 0.0032468 k( 87) = ( 0.3897059 0.1910350 0.6123724), wk = 0.0032468 k( 88) = ( 0.3823529 0.2037707 0.6123724), wk = 0.0032468 k( 89) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 90) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 91) = ( 0.3673469 0.2120879 0.5998750), wk = 0.0032468 k( 92) = ( 0.3596939 0.2076694 0.5873776), wk = 0.0032468 k( 93) = ( 0.3520408 0.2032509 0.5748802), wk = 0.0032468 k( 94) = ( 0.3443878 0.1988324 0.5623828), wk = 0.0032468 k( 95) = ( 0.3367347 0.1944139 0.5498855), wk = 0.0032468 k( 96) = ( 0.3290816 0.1899954 0.5373881), wk = 0.0032468 k( 97) = ( 0.3214286 0.1855769 0.5248907), wk = 0.0032468 k( 98) = ( 0.3137755 0.1811584 0.5123933), wk = 0.0032468 k( 99) = ( 0.3061224 0.1767399 0.4998959), wk = 0.0032468 k( 100) = ( 0.2984694 0.1723214 0.4873985), wk = 0.0032468 k( 101) = ( 0.2908163 0.1679029 0.4749011), wk = 0.0032468 k( 102) = ( 0.2831633 0.1634844 0.4624037), wk = 0.0032468 k( 103) = ( 0.2755102 0.1590659 0.4499063), wk = 0.0032468 k( 104) = ( 0.2678571 0.1546474 0.4374089), wk = 0.0032468 k( 105) = ( 0.2602041 0.1502289 0.4249115), wk = 0.0032468 k( 106) = ( 0.2525510 0.1458104 0.4124141), wk = 0.0032468 k( 107) = ( 0.2448980 0.1413919 0.3999167), wk = 0.0032468 k( 108) = ( 0.2372449 0.1369734 0.3874193), wk = 0.0032468 k( 109) = ( 0.2295918 0.1325549 0.3749219), wk = 0.0032468 k( 110) = ( 0.2219388 0.1281364 0.3624245), wk = 0.0032468 k( 111) = ( 0.2142857 0.1237179 0.3499271), wk = 0.0032468 k( 112) = ( 0.2066327 0.1192994 0.3374297), wk = 0.0032468 k( 113) = ( 0.1989796 0.1148809 0.3249323), wk = 0.0032468 k( 114) = ( 0.1913265 0.1104624 0.3124349), wk = 0.0032468 k( 115) = ( 0.1836735 0.1060439 0.2999375), wk = 0.0032468 k( 116) = ( 0.1760204 0.1016254 0.2874401), wk = 0.0032468 k( 117) = ( 0.1683673 0.0972069 0.2749427), wk = 0.0032468 k( 118) = ( 0.1607143 0.0927884 0.2624453), wk = 0.0032468 k( 119) = ( 0.1530612 0.0883699 0.2499479), wk = 0.0032468 k( 120) = ( 0.1454082 0.0839514 0.2374505), wk = 0.0032468 k( 121) = ( 0.1377551 0.0795329 0.2249531), wk = 0.0032468 k( 122) = ( 0.1301020 0.0751144 0.2124557), wk = 0.0032468 k( 123) = ( 0.1224490 0.0706960 0.1999583), wk = 0.0032468 k( 124) = ( 0.1147959 0.0662775 0.1874610), wk = 0.0032468 k( 125) = ( 0.1071429 0.0618590 0.1749635), wk = 0.0032468 k( 126) = ( 0.0994898 0.0574405 0.1624662), wk = 0.0032468 k( 127) = ( 0.0918367 0.0530220 0.1499688), wk = 0.0032468 k( 128) = ( 0.0841837 0.0486035 0.1374714), wk = 0.0032468 k( 129) = ( 0.0765306 0.0441850 0.1249740), wk = 0.0032468 k( 130) = ( 0.0688775 0.0397665 0.1124766), wk = 0.0032468 k( 131) = ( 0.0612245 0.0353480 0.0999792), wk = 0.0032468 k( 132) = ( 0.0535714 0.0309295 0.0874818), wk = 0.0032468 k( 133) = ( 0.0459184 0.0265110 0.0749844), wk = 0.0032468 k( 134) = ( 0.0382653 0.0220925 0.0624870), wk = 0.0032468 k( 135) = ( 0.0306122 0.0176740 0.0499896), wk = 0.0032468 k( 136) = ( 0.0229592 0.0132555 0.0374922), wk = 0.0032468 k( 137) = ( 0.0153061 0.0088370 0.0249948), wk = 0.0032468 k( 138) = ( 0.0076531 0.0044185 0.0124974), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 141) = ( 0.0125000 0.0072169 0.0051031), wk = 0.0032468 k( 142) = ( 0.0250000 0.0144338 0.0102062), wk = 0.0032468 k( 143) = ( 0.0375000 0.0216506 0.0153093), wk = 0.0032468 k( 144) = ( 0.0500000 0.0288675 0.0204124), wk = 0.0032468 k( 145) = ( 0.0625000 0.0360844 0.0255155), wk = 0.0032468 k( 146) = ( 0.0750000 0.0433013 0.0306186), wk = 0.0032468 k( 147) = ( 0.0875000 0.0505181 0.0357217), wk = 0.0032468 k( 148) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0032468 k( 149) = ( 0.1125000 0.0649519 0.0459279), wk = 0.0032468 k( 150) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0032468 k( 151) = ( 0.1375000 0.0793857 0.0561341), wk = 0.0032468 k( 152) = ( 0.1500000 0.0866025 0.0612372), wk = 0.0032468 k( 153) = ( 0.1625000 0.0938194 0.0663403), wk = 0.0032468 k( 154) = ( 0.1750000 0.1010363 0.0714435), wk = 0.0032468 k( 155) = ( 0.1875000 0.1082532 0.0765466), wk = 0.0032468 k( 156) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0032468 k( 157) = ( 0.2125000 0.1226869 0.0867528), wk = 0.0032468 k( 158) = ( 0.2250000 0.1299038 0.0918559), wk = 0.0032468 k( 159) = ( 0.2375000 0.1371207 0.0969590), wk = 0.0032468 k( 160) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0032468 k( 161) = ( 0.2625000 0.1515544 0.1071652), wk = 0.0032468 k( 162) = ( 0.2750000 0.1587713 0.1122683), wk = 0.0032468 k( 163) = ( 0.2875000 0.1659882 0.1173714), wk = 0.0032468 k( 164) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0032468 k( 165) = ( 0.3125000 0.1804220 0.1275776), wk = 0.0032468 k( 166) = ( 0.3250000 0.1876388 0.1326807), wk = 0.0032468 k( 167) = ( 0.3375000 0.1948557 0.1377838), wk = 0.0032468 k( 168) = ( 0.3500000 0.2020726 0.1428869), wk = 0.0032468 k( 169) = ( 0.3625000 0.2092895 0.1479900), wk = 0.0032468 k( 170) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0032468 k( 171) = ( 0.3875000 0.2237232 0.1581962), wk = 0.0032468 k( 172) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0032468 k( 173) = ( 0.4125000 0.2381570 0.1684024), wk = 0.0032468 k( 174) = ( 0.4250000 0.2453739 0.1735055), wk = 0.0032468 k( 175) = ( 0.4375000 0.2525907 0.1786086), wk = 0.0032468 k( 176) = ( 0.4500000 0.2598076 0.1837117), wk = 0.0032468 k( 177) = ( 0.4625000 0.2670245 0.1888148), wk = 0.0032468 k( 178) = ( 0.4750000 0.2742414 0.1939179), wk = 0.0032468 k( 179) = ( 0.4875000 0.2814583 0.1990210), wk = 0.0032468 k( 180) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 181) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 182) = ( 0.5044643 0.2757879 0.2114143), wk = 0.0032468 k( 183) = ( 0.5089286 0.2629006 0.2187044), wk = 0.0032468 k( 184) = ( 0.5133929 0.2500133 0.2259946), wk = 0.0032468 k( 185) = ( 0.5178571 0.2371260 0.2332847), wk = 0.0032468 k( 186) = ( 0.5223214 0.2242387 0.2405749), wk = 0.0032468 k( 187) = ( 0.5267857 0.2113514 0.2478650), wk = 0.0032468 k( 188) = ( 0.5312500 0.1984642 0.2551552), wk = 0.0032468 k( 189) = ( 0.5357143 0.1855769 0.2624453), wk = 0.0032468 k( 190) = ( 0.5401786 0.1726896 0.2697355), wk = 0.0032468 k( 191) = ( 0.5446429 0.1598023 0.2770256), wk = 0.0032468 k( 192) = ( 0.5491071 0.1469150 0.2843158), wk = 0.0032468 k( 193) = ( 0.5535714 0.1340277 0.2916059), wk = 0.0032468 k( 194) = ( 0.5580357 0.1211405 0.2988961), wk = 0.0032468 k( 195) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0032468 k( 196) = ( 0.5669643 0.0953659 0.3134764), wk = 0.0032468 k( 197) = ( 0.5714286 0.0824786 0.3207665), wk = 0.0032468 k( 198) = ( 0.5758929 0.0695913 0.3280567), wk = 0.0032468 k( 199) = ( 0.5803571 0.0567040 0.3353468), wk = 0.0032468 k( 200) = ( 0.5848214 0.0438168 0.3426370), wk = 0.0032468 k( 201) = ( 0.5892857 0.0309295 0.3499271), wk = 0.0032468 k( 202) = ( 0.5937500 0.0180422 0.3572173), wk = 0.0032468 k( 203) = ( 0.5982143 0.0051549 0.3645074), wk = 0.0032468 k( 204) = ( 0.6026786 -0.0077324 0.3717975), wk = 0.0032468 k( 205) = ( 0.6071429 -0.0206196 0.3790877), wk = 0.0032468 k( 206) = ( 0.6116071 -0.0335069 0.3863778), wk = 0.0032468 k( 207) = ( 0.6160714 -0.0463942 0.3936680), wk = 0.0032468 k( 208) = ( 0.6205357 -0.0592815 0.4009581), wk = 0.0032468 k( 209) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 210) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 211) = ( 0.6176471 -0.0679236 0.4202556), wk = 0.0032468 k( 212) = ( 0.6102941 -0.0636783 0.4322629), wk = 0.0032468 k( 213) = ( 0.6029412 -0.0594331 0.4442702), wk = 0.0032468 k( 214) = ( 0.5955882 -0.0551879 0.4562775), wk = 0.0032468 k( 215) = ( 0.5882353 -0.0509427 0.4682848), wk = 0.0032468 k( 216) = ( 0.5808823 -0.0466974 0.4802921), wk = 0.0032468 k( 217) = ( 0.5735294 -0.0424522 0.4922994), wk = 0.0032468 k( 218) = ( 0.5661765 -0.0382070 0.5043067), wk = 0.0032468 k( 219) = ( 0.5588235 -0.0339618 0.5163140), wk = 0.0032468 k( 220) = ( 0.5514706 -0.0297166 0.5283213), wk = 0.0032468 k( 221) = ( 0.5441177 -0.0254713 0.5403286), wk = 0.0032468 k( 222) = ( 0.5367647 -0.0212261 0.5523359), wk = 0.0032468 k( 223) = ( 0.5294118 -0.0169809 0.5643432), wk = 0.0032468 k( 224) = ( 0.5220588 -0.0127357 0.5763505), wk = 0.0032468 k( 225) = ( 0.5147059 -0.0084904 0.5883578), wk = 0.0032468 k( 226) = ( 0.5073529 -0.0042452 0.6003651), wk = 0.0032468 k( 227) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0032468 k( 228) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0032468 k( 229) = ( 0.5000000 0.0087477 0.6000013), wk = 0.0032468 k( 230) = ( 0.5000000 0.0174955 0.5876301), wk = 0.0032468 k( 231) = ( 0.5000000 0.0262432 0.5752590), wk = 0.0032468 k( 232) = ( 0.5000000 0.0349909 0.5628878), wk = 0.0032468 k( 233) = ( 0.5000000 0.0437387 0.5505166), wk = 0.0032468 k( 234) = ( 0.5000000 0.0524864 0.5381455), wk = 0.0032468 k( 235) = ( 0.5000000 0.0612341 0.5257743), wk = 0.0032468 k( 236) = ( 0.5000000 0.0699819 0.5134032), wk = 0.0032468 k( 237) = ( 0.5000000 0.0787296 0.5010320), wk = 0.0032468 k( 238) = ( 0.5000000 0.0874773 0.4886608), wk = 0.0032468 k( 239) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0032468 k( 240) = ( 0.5000000 0.1049728 0.4639185), wk = 0.0032468 k( 241) = ( 0.5000000 0.1137205 0.4515473), wk = 0.0032468 k( 242) = ( 0.5000000 0.1224682 0.4391762), wk = 0.0032468 k( 243) = ( 0.5000000 0.1312160 0.4268050), wk = 0.0032468 k( 244) = ( 0.5000000 0.1399637 0.4144339), wk = 0.0032468 k( 245) = ( 0.5000000 0.1487114 0.4020627), wk = 0.0032468 k( 246) = ( 0.5000000 0.1574592 0.3896915), wk = 0.0032468 k( 247) = ( 0.5000000 0.1662069 0.3773204), wk = 0.0032468 k( 248) = ( 0.5000000 0.1749546 0.3649492), wk = 0.0032468 k( 249) = ( 0.5000000 0.1837024 0.3525781), wk = 0.0032468 k( 250) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0032468 k( 251) = ( 0.5000000 0.2011978 0.3278358), wk = 0.0032468 k( 252) = ( 0.5000000 0.2099456 0.3154646), wk = 0.0032468 k( 253) = ( 0.5000000 0.2186933 0.3030934), wk = 0.0032468 k( 254) = ( 0.5000000 0.2274410 0.2907223), wk = 0.0032468 k( 255) = ( 0.5000000 0.2361887 0.2783511), wk = 0.0032468 k( 256) = ( 0.5000000 0.2449365 0.2659800), wk = 0.0032468 k( 257) = ( 0.5000000 0.2536842 0.2536088), wk = 0.0032468 k( 258) = ( 0.5000000 0.2624319 0.2412376), wk = 0.0032468 k( 259) = ( 0.5000000 0.2711797 0.2288665), wk = 0.0032468 k( 260) = ( 0.5000000 0.2799274 0.2164953), wk = 0.0032468 k( 261) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 262) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 263) = ( 0.4955357 0.2860977 0.2187044), wk = 0.0032468 k( 264) = ( 0.4910714 0.2835202 0.2332847), wk = 0.0032468 k( 265) = ( 0.4866071 0.2809428 0.2478650), wk = 0.0032468 k( 266) = ( 0.4821429 0.2783653 0.2624453), wk = 0.0032468 k( 267) = ( 0.4776786 0.2757879 0.2770256), wk = 0.0032468 k( 268) = ( 0.4732143 0.2732104 0.2916059), wk = 0.0032468 k( 269) = ( 0.4687500 0.2706329 0.3061862), wk = 0.0032468 k( 270) = ( 0.4642857 0.2680555 0.3207665), wk = 0.0032468 k( 271) = ( 0.4598214 0.2654780 0.3353468), wk = 0.0032468 k( 272) = ( 0.4553571 0.2629006 0.3499271), wk = 0.0032468 k( 273) = ( 0.4508929 0.2603231 0.3645074), wk = 0.0032468 k( 274) = ( 0.4464286 0.2577457 0.3790877), wk = 0.0032468 k( 275) = ( 0.4419643 0.2551682 0.3936680), wk = 0.0032468 k( 276) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0032468 k( 277) = ( 0.4330357 0.2500133 0.4228286), wk = 0.0032468 k( 278) = ( 0.4285714 0.2474358 0.4374089), wk = 0.0032468 k( 279) = ( 0.4241071 0.2448584 0.4519892), wk = 0.0032468 k( 280) = ( 0.4196429 0.2422809 0.4665695), wk = 0.0032468 k( 281) = ( 0.4151786 0.2397035 0.4811498), wk = 0.0032468 k( 282) = ( 0.4107143 0.2371260 0.4957301), wk = 0.0032468 k( 283) = ( 0.4062500 0.2345485 0.5103104), wk = 0.0032468 k( 284) = ( 0.4017857 0.2319711 0.5248907), wk = 0.0032468 k( 285) = ( 0.3973214 0.2293936 0.5394710), wk = 0.0032468 k( 286) = ( 0.3928571 0.2268162 0.5540512), wk = 0.0032468 k( 287) = ( 0.3883929 0.2242387 0.5686316), wk = 0.0032468 k( 288) = ( 0.3839286 0.2216613 0.5832118), wk = 0.0032468 k( 289) = ( 0.3794643 0.2190838 0.5977921), wk = 0.0032468 k( 290) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 291) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 292) = ( 0.6176471 -0.0849044 0.4082483), wk = 0.0032468 k( 293) = ( 0.6102941 -0.0976401 0.4082483), wk = 0.0032468 k( 294) = ( 0.6029412 -0.1103758 0.4082483), wk = 0.0032468 k( 295) = ( 0.5955882 -0.1231115 0.4082483), wk = 0.0032468 k( 296) = ( 0.5882353 -0.1358471 0.4082483), wk = 0.0032468 k( 297) = ( 0.5808823 -0.1485828 0.4082483), wk = 0.0032468 k( 298) = ( 0.5735294 -0.1613185 0.4082483), wk = 0.0032468 k( 299) = ( 0.5661765 -0.1740541 0.4082483), wk = 0.0032468 k( 300) = ( 0.5588235 -0.1867898 0.4082483), wk = 0.0032468 k( 301) = ( 0.5514706 -0.1995255 0.4082483), wk = 0.0032468 k( 302) = ( 0.5441177 -0.2122611 0.4082483), wk = 0.0032468 k( 303) = ( 0.5367647 -0.2249968 0.4082483), wk = 0.0032468 k( 304) = ( 0.5294118 -0.2377325 0.4082483), wk = 0.0032468 k( 305) = ( 0.5220588 -0.2504681 0.4082483), wk = 0.0032468 k( 306) = ( 0.5147059 -0.2632038 0.4082483), wk = 0.0032468 k( 307) = ( 0.5073529 -0.2759395 0.4082483), wk = 0.0032468 k( 308) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0108696 0.0000000 0.0108696), wk = 0.0032468 k( 3) = ( 0.0217391 -0.0000000 0.0217391), wk = 0.0032468 k( 4) = ( 0.0326087 0.0000000 0.0326087), wk = 0.0032468 k( 5) = ( 0.0434783 -0.0000000 0.0434783), wk = 0.0032468 k( 6) = ( 0.0543478 -0.0000000 0.0543478), wk = 0.0032468 k( 7) = ( 0.0652174 0.0000000 0.0652174), wk = 0.0032468 k( 8) = ( 0.0760870 0.0000000 0.0760870), wk = 0.0032468 k( 9) = ( 0.0869565 -0.0000000 0.0869565), wk = 0.0032468 k( 10) = ( 0.0978261 -0.0000000 0.0978261), wk = 0.0032468 k( 11) = ( 0.1086957 -0.0000000 0.1086957), wk = 0.0032468 k( 12) = ( 0.1195652 -0.0000000 0.1195652), wk = 0.0032468 k( 13) = ( 0.1304348 0.0000000 0.1304348), wk = 0.0032468 k( 14) = ( 0.1413043 0.0000000 0.1413043), wk = 0.0032468 k( 15) = ( 0.1521739 -0.0000000 0.1521739), wk = 0.0032468 k( 16) = ( 0.1630435 -0.0000000 0.1630435), wk = 0.0032468 k( 17) = ( 0.1739130 -0.0000000 0.1739130), wk = 0.0032468 k( 18) = ( 0.1847826 0.0000000 0.1847826), wk = 0.0032468 k( 19) = ( 0.1956522 -0.0000000 0.1956522), wk = 0.0032468 k( 20) = ( 0.2065217 -0.0000000 0.2065217), wk = 0.0032468 k( 21) = ( 0.2173913 -0.0000000 0.2173913), wk = 0.0032468 k( 22) = ( 0.2282609 -0.0000000 0.2282609), wk = 0.0032468 k( 23) = ( 0.2391304 -0.0000000 0.2391304), wk = 0.0032468 k( 24) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0032468 k( 25) = ( 0.2608696 0.0000000 0.2608696), wk = 0.0032468 k( 26) = ( 0.2717391 0.0000000 0.2717391), wk = 0.0032468 k( 27) = ( 0.2826087 0.0000000 0.2826087), wk = 0.0032468 k( 28) = ( 0.2934783 0.0000000 0.2934783), wk = 0.0032468 k( 29) = ( 0.3043478 0.0000000 0.3043478), wk = 0.0032468 k( 30) = ( 0.3152174 0.0000000 0.3152174), wk = 0.0032468 k( 31) = ( 0.3260870 -0.0000000 0.3260870), wk = 0.0032468 k( 32) = ( 0.3369565 0.0000000 0.3369565), wk = 0.0032468 k( 33) = ( 0.3478261 -0.0000000 0.3478261), wk = 0.0032468 k( 34) = ( 0.3586956 0.0000000 0.3586957), wk = 0.0032468 k( 35) = ( 0.3695652 0.0000000 0.3695652), wk = 0.0032468 k( 36) = ( 0.3804348 -0.0000000 0.3804348), wk = 0.0032468 k( 37) = ( 0.3913044 -0.0000000 0.3913044), wk = 0.0032468 k( 38) = ( 0.4021739 -0.0000000 0.4021739), wk = 0.0032468 k( 39) = ( 0.4130435 -0.0000000 0.4130435), wk = 0.0032468 k( 40) = ( 0.4239130 -0.0000000 0.4239130), wk = 0.0032468 k( 41) = ( 0.4347826 0.0000000 0.4347826), wk = 0.0032468 k( 42) = ( 0.4456522 -0.0000000 0.4456522), wk = 0.0032468 k( 43) = ( 0.4565217 -0.0000000 0.4565217), wk = 0.0032468 k( 44) = ( 0.4673913 -0.0000000 0.4673913), wk = 0.0032468 k( 45) = ( 0.4782609 -0.0000000 0.4782609), wk = 0.0032468 k( 46) = ( 0.4891304 -0.0000000 0.4891304), wk = 0.0032468 k( 47) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 48) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 49) = ( 0.5000000 0.0108696 0.5108696), wk = 0.0032468 k( 50) = ( 0.5000000 0.0217391 0.5217391), wk = 0.0032468 k( 51) = ( 0.5000000 0.0326087 0.5326087), wk = 0.0032468 k( 52) = ( 0.5000000 0.0434783 0.5434783), wk = 0.0032468 k( 53) = ( 0.5000000 0.0543478 0.5543478), wk = 0.0032468 k( 54) = ( 0.5000000 0.0652174 0.5652174), wk = 0.0032468 k( 55) = ( 0.5000000 0.0760870 0.5760870), wk = 0.0032468 k( 56) = ( 0.5000000 0.0869565 0.5869565), wk = 0.0032468 k( 57) = ( 0.5000000 0.0978261 0.5978261), wk = 0.0032468 k( 58) = ( 0.5000000 0.1086957 0.6086957), wk = 0.0032468 k( 59) = ( 0.5000000 0.1195652 0.6195652), wk = 0.0032468 k( 60) = ( 0.5000000 0.1304348 0.6304348), wk = 0.0032468 k( 61) = ( 0.5000000 0.1413043 0.6413044), wk = 0.0032468 k( 62) = ( 0.5000000 0.1521739 0.6521739), wk = 0.0032468 k( 63) = ( 0.5000000 0.1630435 0.6630435), wk = 0.0032468 k( 64) = ( 0.5000000 0.1739130 0.6739130), wk = 0.0032468 k( 65) = ( 0.5000000 0.1847826 0.6847826), wk = 0.0032468 k( 66) = ( 0.5000000 0.1956522 0.6956522), wk = 0.0032468 k( 67) = ( 0.5000000 0.2065217 0.7065217), wk = 0.0032468 k( 68) = ( 0.5000000 0.2173913 0.7173913), wk = 0.0032468 k( 69) = ( 0.5000000 0.2282609 0.7282609), wk = 0.0032468 k( 70) = ( 0.5000000 0.2391304 0.7391304), wk = 0.0032468 k( 71) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 72) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 73) = ( 0.4926471 0.2573529 0.7500000), wk = 0.0032468 k( 74) = ( 0.4852941 0.2647059 0.7500000), wk = 0.0032468 k( 75) = ( 0.4779412 0.2720588 0.7500000), wk = 0.0032468 k( 76) = ( 0.4705882 0.2794118 0.7500000), wk = 0.0032468 k( 77) = ( 0.4632353 0.2867647 0.7500000), wk = 0.0032468 k( 78) = ( 0.4558823 0.2941177 0.7500000), wk = 0.0032468 k( 79) = ( 0.4485294 0.3014706 0.7500000), wk = 0.0032468 k( 80) = ( 0.4411765 0.3088235 0.7500000), wk = 0.0032468 k( 81) = ( 0.4338235 0.3161765 0.7500000), wk = 0.0032468 k( 82) = ( 0.4264706 0.3235294 0.7500000), wk = 0.0032468 k( 83) = ( 0.4191177 0.3308824 0.7500000), wk = 0.0032468 k( 84) = ( 0.4117647 0.3382353 0.7500000), wk = 0.0032468 k( 85) = ( 0.4044118 0.3455882 0.7500000), wk = 0.0032468 k( 86) = ( 0.3970588 0.3529412 0.7500000), wk = 0.0032468 k( 87) = ( 0.3897059 0.3602941 0.7500000), wk = 0.0032468 k( 88) = ( 0.3823529 0.3676471 0.7500000), wk = 0.0032468 k( 89) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 90) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 91) = ( 0.3673469 0.3673469 0.7346939), wk = 0.0032468 k( 92) = ( 0.3596939 0.3596939 0.7193878), wk = 0.0032468 k( 93) = ( 0.3520408 0.3520408 0.7040816), wk = 0.0032468 k( 94) = ( 0.3443878 0.3443878 0.6887755), wk = 0.0032468 k( 95) = ( 0.3367347 0.3367347 0.6734694), wk = 0.0032468 k( 96) = ( 0.3290816 0.3290816 0.6581633), wk = 0.0032468 k( 97) = ( 0.3214286 0.3214286 0.6428571), wk = 0.0032468 k( 98) = ( 0.3137755 0.3137755 0.6275510), wk = 0.0032468 k( 99) = ( 0.3061224 0.3061224 0.6122449), wk = 0.0032468 k( 100) = ( 0.2984694 0.2984694 0.5969388), wk = 0.0032468 k( 101) = ( 0.2908163 0.2908163 0.5816327), wk = 0.0032468 k( 102) = ( 0.2831633 0.2831633 0.5663265), wk = 0.0032468 k( 103) = ( 0.2755102 0.2755102 0.5510204), wk = 0.0032468 k( 104) = ( 0.2678571 0.2678571 0.5357143), wk = 0.0032468 k( 105) = ( 0.2602041 0.2602041 0.5204082), wk = 0.0032468 k( 106) = ( 0.2525510 0.2525510 0.5051020), wk = 0.0032468 k( 107) = ( 0.2448980 0.2448980 0.4897959), wk = 0.0032468 k( 108) = ( 0.2372449 0.2372449 0.4744898), wk = 0.0032468 k( 109) = ( 0.2295918 0.2295918 0.4591837), wk = 0.0032468 k( 110) = ( 0.2219388 0.2219388 0.4438776), wk = 0.0032468 k( 111) = ( 0.2142857 0.2142857 0.4285714), wk = 0.0032468 k( 112) = ( 0.2066327 0.2066327 0.4132653), wk = 0.0032468 k( 113) = ( 0.1989796 0.1989796 0.3979592), wk = 0.0032468 k( 114) = ( 0.1913265 0.1913265 0.3826531), wk = 0.0032468 k( 115) = ( 0.1836735 0.1836735 0.3673469), wk = 0.0032468 k( 116) = ( 0.1760204 0.1760204 0.3520408), wk = 0.0032468 k( 117) = ( 0.1683673 0.1683674 0.3367347), wk = 0.0032468 k( 118) = ( 0.1607143 0.1607143 0.3214286), wk = 0.0032468 k( 119) = ( 0.1530612 0.1530612 0.3061225), wk = 0.0032468 k( 120) = ( 0.1454082 0.1454082 0.2908163), wk = 0.0032468 k( 121) = ( 0.1377551 0.1377551 0.2755102), wk = 0.0032468 k( 122) = ( 0.1301020 0.1301020 0.2602041), wk = 0.0032468 k( 123) = ( 0.1224490 0.1224490 0.2448980), wk = 0.0032468 k( 124) = ( 0.1147959 0.1147959 0.2295918), wk = 0.0032468 k( 125) = ( 0.1071429 0.1071429 0.2142857), wk = 0.0032468 k( 126) = ( 0.0994898 0.0994898 0.1989796), wk = 0.0032468 k( 127) = ( 0.0918367 0.0918367 0.1836735), wk = 0.0032468 k( 128) = ( 0.0841837 0.0841837 0.1683674), wk = 0.0032468 k( 129) = ( 0.0765306 0.0765306 0.1530612), wk = 0.0032468 k( 130) = ( 0.0688775 0.0688775 0.1377551), wk = 0.0032468 k( 131) = ( 0.0612245 0.0612245 0.1224490), wk = 0.0032468 k( 132) = ( 0.0535714 0.0535714 0.1071429), wk = 0.0032468 k( 133) = ( 0.0459184 0.0459184 0.0918367), wk = 0.0032468 k( 134) = ( 0.0382653 0.0382653 0.0765306), wk = 0.0032468 k( 135) = ( 0.0306122 0.0306122 0.0612245), wk = 0.0032468 k( 136) = ( 0.0229592 0.0229592 0.0459184), wk = 0.0032468 k( 137) = ( 0.0153061 0.0153061 0.0306122), wk = 0.0032468 k( 138) = ( 0.0076531 0.0076531 0.0153061), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 141) = ( 0.0125000 0.0125000 0.0125000), wk = 0.0032468 k( 142) = ( 0.0250000 0.0250000 0.0250000), wk = 0.0032468 k( 143) = ( 0.0375000 0.0375000 0.0375000), wk = 0.0032468 k( 144) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0032468 k( 145) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0032468 k( 146) = ( 0.0750000 0.0750000 0.0750000), wk = 0.0032468 k( 147) = ( 0.0875000 0.0875000 0.0875000), wk = 0.0032468 k( 148) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0032468 k( 149) = ( 0.1125000 0.1125000 0.1125000), wk = 0.0032468 k( 150) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0032468 k( 151) = ( 0.1375000 0.1375000 0.1375000), wk = 0.0032468 k( 152) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0032468 k( 153) = ( 0.1625000 0.1625000 0.1625000), wk = 0.0032468 k( 154) = ( 0.1750000 0.1750000 0.1750000), wk = 0.0032468 k( 155) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0032468 k( 156) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0032468 k( 157) = ( 0.2125000 0.2125000 0.2125000), wk = 0.0032468 k( 158) = ( 0.2250000 0.2250000 0.2250000), wk = 0.0032468 k( 159) = ( 0.2375000 0.2375000 0.2375000), wk = 0.0032468 k( 160) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032468 k( 161) = ( 0.2625000 0.2625000 0.2625000), wk = 0.0032468 k( 162) = ( 0.2750000 0.2750000 0.2750000), wk = 0.0032468 k( 163) = ( 0.2875000 0.2875000 0.2875000), wk = 0.0032468 k( 164) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0032468 k( 165) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0032468 k( 166) = ( 0.3250000 0.3250000 0.3250000), wk = 0.0032468 k( 167) = ( 0.3375000 0.3375000 0.3375000), wk = 0.0032468 k( 168) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0032468 k( 169) = ( 0.3625000 0.3625000 0.3625000), wk = 0.0032468 k( 170) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0032468 k( 171) = ( 0.3875000 0.3875000 0.3875000), wk = 0.0032468 k( 172) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0032468 k( 173) = ( 0.4125000 0.4125000 0.4125000), wk = 0.0032468 k( 174) = ( 0.4250000 0.4250000 0.4250000), wk = 0.0032468 k( 175) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0032468 k( 176) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0032468 k( 177) = ( 0.4625000 0.4625000 0.4625000), wk = 0.0032468 k( 178) = ( 0.4750000 0.4750000 0.4750000), wk = 0.0032468 k( 179) = ( 0.4875000 0.4875000 0.4875000), wk = 0.0032468 k( 180) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 181) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 182) = ( 0.5044643 0.4910714 0.5044643), wk = 0.0032468 k( 183) = ( 0.5089286 0.4821429 0.5089286), wk = 0.0032468 k( 184) = ( 0.5133929 0.4732143 0.5133929), wk = 0.0032468 k( 185) = ( 0.5178571 0.4642857 0.5178571), wk = 0.0032468 k( 186) = ( 0.5223214 0.4553571 0.5223214), wk = 0.0032468 k( 187) = ( 0.5267857 0.4464286 0.5267857), wk = 0.0032468 k( 188) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0032468 k( 189) = ( 0.5357143 0.4285714 0.5357143), wk = 0.0032468 k( 190) = ( 0.5401786 0.4196429 0.5401786), wk = 0.0032468 k( 191) = ( 0.5446429 0.4107143 0.5446429), wk = 0.0032468 k( 192) = ( 0.5491071 0.4017857 0.5491071), wk = 0.0032468 k( 193) = ( 0.5535714 0.3928571 0.5535714), wk = 0.0032468 k( 194) = ( 0.5580357 0.3839286 0.5580357), wk = 0.0032468 k( 195) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0032468 k( 196) = ( 0.5669643 0.3660714 0.5669643), wk = 0.0032468 k( 197) = ( 0.5714286 0.3571429 0.5714286), wk = 0.0032468 k( 198) = ( 0.5758929 0.3482143 0.5758929), wk = 0.0032468 k( 199) = ( 0.5803571 0.3392857 0.5803571), wk = 0.0032468 k( 200) = ( 0.5848214 0.3303571 0.5848214), wk = 0.0032468 k( 201) = ( 0.5892857 0.3214286 0.5892857), wk = 0.0032468 k( 202) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0032468 k( 203) = ( 0.5982143 0.3035714 0.5982143), wk = 0.0032468 k( 204) = ( 0.6026786 0.2946429 0.6026786), wk = 0.0032468 k( 205) = ( 0.6071429 0.2857143 0.6071429), wk = 0.0032468 k( 206) = ( 0.6116071 0.2767857 0.6116071), wk = 0.0032468 k( 207) = ( 0.6160714 0.2678571 0.6160714), wk = 0.0032468 k( 208) = ( 0.6205357 0.2589286 0.6205357), wk = 0.0032468 k( 209) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 210) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 211) = ( 0.6176471 0.2500000 0.6323529), wk = 0.0032468 k( 212) = ( 0.6102941 0.2500000 0.6397059), wk = 0.0032468 k( 213) = ( 0.6029412 0.2500000 0.6470588), wk = 0.0032468 k( 214) = ( 0.5955882 0.2500000 0.6544118), wk = 0.0032468 k( 215) = ( 0.5882353 0.2500000 0.6617647), wk = 0.0032468 k( 216) = ( 0.5808823 0.2500000 0.6691177), wk = 0.0032468 k( 217) = ( 0.5735294 0.2500000 0.6764706), wk = 0.0032468 k( 218) = ( 0.5661765 0.2500000 0.6838235), wk = 0.0032468 k( 219) = ( 0.5588235 0.2500000 0.6911765), wk = 0.0032468 k( 220) = ( 0.5514706 0.2500000 0.6985294), wk = 0.0032468 k( 221) = ( 0.5441177 0.2500000 0.7058824), wk = 0.0032468 k( 222) = ( 0.5367647 0.2500000 0.7132353), wk = 0.0032468 k( 223) = ( 0.5294118 0.2500000 0.7205882), wk = 0.0032468 k( 224) = ( 0.5220588 0.2500000 0.7279412), wk = 0.0032468 k( 225) = ( 0.5147059 0.2500000 0.7352941), wk = 0.0032468 k( 226) = ( 0.5073529 0.2500000 0.7426471), wk = 0.0032468 k( 227) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 228) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 229) = ( 0.5000000 0.2575758 0.7424242), wk = 0.0032468 k( 230) = ( 0.5000000 0.2651515 0.7348485), wk = 0.0032468 k( 231) = ( 0.5000000 0.2727273 0.7272727), wk = 0.0032468 k( 232) = ( 0.5000000 0.2803030 0.7196970), wk = 0.0032468 k( 233) = ( 0.5000000 0.2878788 0.7121212), wk = 0.0032468 k( 234) = ( 0.5000000 0.2954546 0.7045455), wk = 0.0032468 k( 235) = ( 0.5000000 0.3030303 0.6969697), wk = 0.0032468 k( 236) = ( 0.5000000 0.3106061 0.6893939), wk = 0.0032468 k( 237) = ( 0.5000000 0.3181818 0.6818182), wk = 0.0032468 k( 238) = ( 0.5000000 0.3257576 0.6742424), wk = 0.0032468 k( 239) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0032468 k( 240) = ( 0.5000000 0.3409091 0.6590909), wk = 0.0032468 k( 241) = ( 0.5000000 0.3484849 0.6515152), wk = 0.0032468 k( 242) = ( 0.5000000 0.3560606 0.6439394), wk = 0.0032468 k( 243) = ( 0.5000000 0.3636364 0.6363636), wk = 0.0032468 k( 244) = ( 0.5000000 0.3712121 0.6287879), wk = 0.0032468 k( 245) = ( 0.5000000 0.3787879 0.6212121), wk = 0.0032468 k( 246) = ( 0.5000000 0.3863636 0.6136364), wk = 0.0032468 k( 247) = ( 0.5000000 0.3939394 0.6060606), wk = 0.0032468 k( 248) = ( 0.5000000 0.4015152 0.5984848), wk = 0.0032468 k( 249) = ( 0.5000000 0.4090909 0.5909091), wk = 0.0032468 k( 250) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0032468 k( 251) = ( 0.5000000 0.4242424 0.5757576), wk = 0.0032468 k( 252) = ( 0.5000000 0.4318182 0.5681818), wk = 0.0032468 k( 253) = ( 0.5000000 0.4393939 0.5606061), wk = 0.0032468 k( 254) = ( 0.5000000 0.4469697 0.5530303), wk = 0.0032468 k( 255) = ( 0.5000000 0.4545455 0.5454546), wk = 0.0032468 k( 256) = ( 0.5000000 0.4621212 0.5378788), wk = 0.0032468 k( 257) = ( 0.5000000 0.4696970 0.5303030), wk = 0.0032468 k( 258) = ( 0.5000000 0.4772727 0.5227273), wk = 0.0032468 k( 259) = ( 0.5000000 0.4848485 0.5151515), wk = 0.0032468 k( 260) = ( 0.5000000 0.4924242 0.5075758), wk = 0.0032468 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 263) = ( 0.4955357 0.4955357 0.5089286), wk = 0.0032468 k( 264) = ( 0.4910714 0.4910714 0.5178571), wk = 0.0032468 k( 265) = ( 0.4866071 0.4866071 0.5267857), wk = 0.0032468 k( 266) = ( 0.4821429 0.4821429 0.5357143), wk = 0.0032468 k( 267) = ( 0.4776786 0.4776786 0.5446429), wk = 0.0032468 k( 268) = ( 0.4732143 0.4732143 0.5535714), wk = 0.0032468 k( 269) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0032468 k( 270) = ( 0.4642857 0.4642857 0.5714286), wk = 0.0032468 k( 271) = ( 0.4598214 0.4598214 0.5803571), wk = 0.0032468 k( 272) = ( 0.4553571 0.4553571 0.5892857), wk = 0.0032468 k( 273) = ( 0.4508929 0.4508929 0.5982143), wk = 0.0032468 k( 274) = ( 0.4464286 0.4464286 0.6071429), wk = 0.0032468 k( 275) = ( 0.4419643 0.4419643 0.6160714), wk = 0.0032468 k( 276) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0032468 k( 277) = ( 0.4330357 0.4330357 0.6339286), wk = 0.0032468 k( 278) = ( 0.4285714 0.4285714 0.6428571), wk = 0.0032468 k( 279) = ( 0.4241071 0.4241071 0.6517857), wk = 0.0032468 k( 280) = ( 0.4196429 0.4196429 0.6607143), wk = 0.0032468 k( 281) = ( 0.4151786 0.4151786 0.6696429), wk = 0.0032468 k( 282) = ( 0.4107143 0.4107143 0.6785714), wk = 0.0032468 k( 283) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0032468 k( 284) = ( 0.4017857 0.4017857 0.6964286), wk = 0.0032468 k( 285) = ( 0.3973214 0.3973214 0.7053571), wk = 0.0032468 k( 286) = ( 0.3928571 0.3928571 0.7142857), wk = 0.0032468 k( 287) = ( 0.3883929 0.3883929 0.7232143), wk = 0.0032468 k( 288) = ( 0.3839286 0.3839286 0.7321429), wk = 0.0032468 k( 289) = ( 0.3794643 0.3794643 0.7410714), wk = 0.0032468 k( 290) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 291) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 292) = ( 0.6176471 0.2352941 0.6176471), wk = 0.0032468 k( 293) = ( 0.6102941 0.2205882 0.6102941), wk = 0.0032468 k( 294) = ( 0.6029412 0.2058823 0.6029412), wk = 0.0032468 k( 295) = ( 0.5955882 0.1911765 0.5955882), wk = 0.0032468 k( 296) = ( 0.5882353 0.1764706 0.5882353), wk = 0.0032468 k( 297) = ( 0.5808823 0.1617647 0.5808824), wk = 0.0032468 k( 298) = ( 0.5735294 0.1470588 0.5735294), wk = 0.0032468 k( 299) = ( 0.5661765 0.1323529 0.5661765), wk = 0.0032468 k( 300) = ( 0.5588235 0.1176471 0.5588235), wk = 0.0032468 k( 301) = ( 0.5514706 0.1029412 0.5514706), wk = 0.0032468 k( 302) = ( 0.5441177 0.0882353 0.5441177), wk = 0.0032468 k( 303) = ( 0.5367647 0.0735294 0.5367647), wk = 0.0032468 k( 304) = ( 0.5294118 0.0588235 0.5294118), wk = 0.0032468 k( 305) = ( 0.5220588 0.0441176 0.5220588), wk = 0.0032468 k( 306) = ( 0.5147059 0.0294118 0.5147059), wk = 0.0032468 k( 307) = ( 0.5073529 0.0147059 0.5073529), wk = 0.0032468 k( 308) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 Dense grid: 39189 G-vectors FFT dimensions: ( 48, 48, 48) Smooth grid: 23505 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.14 Mb ( 162, 56) NL pseudopotentials 0.17 Mb ( 81, 136) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1088) G-vector shells 0.00 Mb ( 319) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.55 Mb ( 162, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.23 Mb ( 136, 2, 56) The potential is recalculated from file : ./YInAg2.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.4 secs Computing kpt #: 2 total cpu time spent up to now is 3.8 secs Computing kpt #: 3 total cpu time spent up to now is 4.3 secs Computing kpt #: 4 total cpu time spent up to now is 4.7 secs Computing kpt #: 5 total cpu time spent up to now is 5.1 secs Computing kpt #: 6 total cpu time spent up to now is 5.5 secs Computing kpt #: 7 total cpu time spent up to now is 5.9 secs Computing kpt #: 8 total cpu time spent up to now is 6.3 secs Computing kpt #: 9 total cpu time spent up to now is 6.7 secs Computing kpt #: 10 total cpu time spent up to now is 7.2 secs Computing kpt #: 11 total cpu time spent up to now is 7.6 secs Computing kpt #: 12 total cpu time spent up to now is 8.0 secs Computing kpt #: 13 total cpu time spent up to now is 8.4 secs Computing kpt #: 14 total cpu time spent up to now is 8.8 secs Computing kpt #: 15 total cpu time spent up to now is 9.2 secs Computing kpt #: 16 total cpu time spent up to now is 9.7 secs Computing kpt #: 17 total cpu time spent up to now is 10.1 secs Computing kpt #: 18 total cpu time spent up to now is 10.5 secs Computing kpt #: 19 total cpu time spent up to now is 10.9 secs Computing kpt #: 20 total cpu time spent up to now is 11.3 secs Computing kpt #: 21 total cpu time spent up to now is 11.7 secs Computing kpt #: 22 total cpu time spent up to now is 12.1 secs Computing kpt #: 23 total cpu time spent up to now is 12.5 secs Computing kpt #: 24 total cpu time spent up to now is 12.9 secs Computing kpt #: 25 total cpu time spent up to now is 13.3 secs Computing kpt #: 26 total cpu time spent up to now is 13.8 secs Computing kpt #: 27 total cpu time spent up to now is 14.2 secs Computing kpt #: 28 total cpu time spent up to now is 14.6 secs Computing kpt #: 29 total cpu time spent up to now is 15.1 secs Computing kpt #: 30 total cpu time spent up to now is 15.5 secs Computing kpt #: 31 total cpu time spent up to now is 15.9 secs Computing kpt #: 32 total cpu time spent up to now is 16.3 secs Computing kpt #: 33 total cpu time spent up to now is 16.7 secs Computing kpt #: 34 total cpu time spent up to now is 17.1 secs Computing kpt #: 35 total cpu time spent up to now is 17.5 secs Computing kpt #: 36 total cpu time spent up to now is 17.9 secs Computing kpt #: 37 total cpu time spent up to now is 18.3 secs Computing kpt #: 38 total cpu time spent up to now is 18.7 secs Computing kpt #: 39 total cpu time spent up to now is 19.0 secs Computing kpt #: 40 total cpu time spent up to now is 19.4 secs Computing kpt #: 41 total cpu time spent up to now is 19.8 secs Computing kpt #: 42 total cpu time spent up to now is 20.2 secs Computing kpt #: 43 total cpu time spent up to now is 20.6 secs Computing kpt #: 44 total cpu time spent up to now is 21.0 secs Computing kpt #: 45 total cpu time spent up to now is 21.4 secs Computing kpt #: 46 total cpu time spent up to now is 21.7 secs Computing kpt #: 47 total cpu time spent up to now is 22.1 secs Computing kpt #: 48 total cpu time spent up to now is 22.5 secs Computing kpt #: 49 total cpu time spent up to now is 22.9 secs Computing kpt #: 50 total cpu time spent up to now is 23.3 secs Computing kpt #: 51 total cpu time spent up to now is 23.7 secs Computing kpt #: 52 total cpu time spent up to now is 24.1 secs Computing kpt #: 53 total cpu time spent up to now is 24.5 secs Computing kpt #: 54 total cpu time spent up to now is 24.9 secs Computing kpt #: 55 total cpu time spent up to now is 25.3 secs Computing kpt #: 56 total cpu time spent up to now is 25.8 secs Computing kpt #: 57 total cpu time spent up to now is 26.2 secs Computing kpt #: 58 total cpu time spent up to now is 26.6 secs Computing kpt #: 59 total cpu time spent up to now is 27.0 secs Computing kpt #: 60 total cpu time spent up to now is 27.4 secs Computing kpt #: 61 total cpu time spent up to now is 27.8 secs Computing kpt #: 62 total cpu time spent up to now is 28.2 secs Computing kpt #: 63 total cpu time spent up to now is 28.7 secs Computing kpt #: 64 total cpu time spent up to now is 29.1 secs Computing kpt #: 65 total cpu time spent up to now is 29.5 secs Computing kpt #: 66 total cpu time spent up to now is 29.8 secs Computing kpt #: 67 total cpu time spent up to now is 30.2 secs Computing kpt #: 68 total cpu time spent up to now is 30.6 secs Computing kpt #: 69 total cpu time spent up to now is 31.0 secs Computing kpt #: 70 total cpu time spent up to now is 31.4 secs Computing kpt #: 71 total cpu time spent up to now is 31.8 secs Computing kpt #: 72 total cpu time spent up to now is 32.2 secs Computing kpt #: 73 total cpu time spent up to now is 32.5 secs Computing kpt #: 74 total cpu time spent up to now is 32.9 secs Computing kpt #: 75 total cpu time spent up to now is 33.3 secs Computing kpt #: 76 total cpu time spent up to now is 33.7 secs Computing kpt #: 77 total cpu time spent up to now is 34.1 secs Computing kpt #: 78 total cpu time spent up to now is 34.5 secs Computing kpt #: 79 total cpu time spent up to now is 34.9 secs Computing kpt #: 80 total cpu time spent up to now is 35.3 secs Computing kpt #: 81 total cpu time spent up to now is 35.7 secs Computing kpt #: 82 total cpu time spent up to now is 36.2 secs Computing kpt #: 83 total cpu time spent up to now is 36.6 secs Computing kpt #: 84 total cpu time spent up to now is 37.0 secs Computing kpt #: 85 total cpu time spent up to now is 37.4 secs Computing kpt #: 86 total cpu time spent up to now is 37.8 secs Computing kpt #: 87 total cpu time spent up to now is 38.2 secs Computing kpt #: 88 total cpu time spent up to now is 38.6 secs Computing kpt #: 89 total cpu time spent up to now is 39.0 secs Computing kpt #: 90 total cpu time spent up to now is 39.4 secs Computing kpt #: 91 total cpu time spent up to now is 39.9 secs Computing kpt #: 92 total cpu time spent up to now is 40.3 secs Computing kpt #: 93 total cpu time spent up to now is 40.7 secs Computing kpt #: 94 total cpu time spent up to now is 41.1 secs Computing kpt #: 95 total cpu time spent up to now is 41.5 secs Computing kpt #: 96 total cpu time spent up to now is 41.9 secs Computing kpt #: 97 total cpu time spent up to now is 42.3 secs Computing kpt #: 98 total cpu time spent up to now is 42.7 secs Computing kpt #: 99 total cpu time spent up to now is 43.1 secs Computing kpt #: 100 total cpu time spent up to now is 43.6 secs Computing kpt #: 101 total cpu time spent up to now is 44.0 secs Computing kpt #: 102 total cpu time spent up to now is 44.4 secs Computing kpt #: 103 total cpu time spent up to now is 44.8 secs Computing kpt #: 104 total cpu time spent up to now is 45.2 secs Computing kpt #: 105 total cpu time spent up to now is 45.6 secs Computing kpt #: 106 total cpu time spent up to now is 46.0 secs Computing kpt #: 107 total cpu time spent up to now is 46.4 secs Computing kpt #: 108 total cpu time spent up to now is 46.8 secs Computing kpt #: 109 total cpu time spent up to now is 47.2 secs Computing kpt #: 110 total cpu time spent up to now is 47.6 secs Computing kpt #: 111 total cpu time spent up to now is 48.0 secs Computing kpt #: 112 total cpu time spent up to now is 48.4 secs Computing kpt #: 113 total cpu time spent up to now is 48.9 secs Computing kpt #: 114 total cpu time spent up to now is 49.3 secs Computing kpt #: 115 total cpu time spent up to now is 49.7 secs Computing kpt #: 116 total cpu time spent up to now is 50.1 secs Computing kpt #: 117 total cpu time spent up to now is 50.5 secs Computing kpt #: 118 total cpu time spent up to now is 51.0 secs Computing kpt #: 119 total cpu time spent up to now is 51.4 secs Computing kpt #: 120 total cpu time spent up to now is 51.9 secs Computing kpt #: 121 total cpu time spent up to now is 52.4 secs Computing kpt #: 122 total cpu time spent up to now is 52.9 secs Computing kpt #: 123 total cpu time spent up to now is 53.4 secs Computing kpt #: 124 total cpu time spent up to now is 53.9 secs Computing kpt #: 125 total cpu time spent up to now is 54.3 secs Computing kpt #: 126 total cpu time spent up to now is 54.8 secs Computing kpt #: 127 total cpu time spent up to now is 55.3 secs Computing kpt #: 128 total cpu time spent up to now is 55.7 secs Computing kpt #: 129 total cpu time spent up to now is 56.2 secs Computing kpt #: 130 total cpu time spent up to now is 56.6 secs Computing kpt #: 131 total cpu time spent up to now is 57.1 secs Computing kpt #: 132 total cpu time spent up to now is 57.5 secs Computing kpt #: 133 total cpu time spent up to now is 57.9 secs Computing kpt #: 134 total cpu time spent up to now is 58.4 secs Computing kpt #: 135 total cpu time spent up to now is 58.8 secs Computing kpt #: 136 total cpu time spent up to now is 59.2 secs Computing kpt #: 137 total cpu time spent up to now is 59.6 secs Computing kpt #: 138 total cpu time spent up to now is 60.1 secs Computing kpt #: 139 total cpu time spent up to now is 60.5 secs Computing kpt #: 140 total cpu time spent up to now is 60.9 secs Computing kpt #: 141 total cpu time spent up to now is 61.4 secs Computing kpt #: 142 total cpu time spent up to now is 61.8 secs Computing kpt #: 143 total cpu time spent up to now is 62.2 secs Computing kpt #: 144 total cpu time spent up to now is 62.7 secs Computing kpt #: 145 total cpu time spent up to now is 63.1 secs Computing kpt #: 146 total cpu time spent up to now is 63.6 secs Computing kpt #: 147 total cpu time spent up to now is 64.0 secs Computing kpt #: 148 total cpu time spent up to now is 64.5 secs Computing kpt #: 149 total cpu time spent up to now is 65.0 secs Computing kpt #: 150 total cpu time spent up to now is 65.6 secs Computing kpt #: 151 total cpu time spent up to now is 66.1 secs Computing kpt #: 152 total cpu time spent up to now is 66.6 secs Computing kpt #: 153 total cpu time spent up to now is 67.1 secs Computing kpt #: 154 total cpu time spent up to now is 67.6 secs Computing kpt #: 155 total cpu time spent up to now is 68.2 secs Computing kpt #: 156 total cpu time spent up to now is 68.6 secs Computing kpt #: 157 total cpu time spent up to now is 69.1 secs Computing kpt #: 158 total cpu time spent up to now is 69.5 secs Computing kpt #: 159 total cpu time spent up to now is 70.0 secs Computing kpt #: 160 total cpu time spent up to now is 70.4 secs Computing kpt #: 161 total cpu time spent up to now is 70.9 secs Computing kpt #: 162 total cpu time spent up to now is 71.4 secs Computing kpt #: 163 total cpu time spent up to now is 71.9 secs Computing kpt #: 164 total cpu time spent up to now is 72.7 secs Computing kpt #: 165 total cpu time spent up to now is 73.3 secs Computing kpt #: 166 total cpu time spent up to now is 73.8 secs Computing kpt #: 167 total cpu time spent up to now is 74.3 secs Computing kpt #: 168 total cpu time spent up to now is 74.8 secs Computing kpt #: 169 total cpu time spent up to now is 75.3 secs Computing kpt #: 170 total cpu time spent up to now is 75.7 secs Computing kpt #: 171 total cpu time spent up to now is 76.2 secs Computing kpt #: 172 total cpu time spent up to now is 76.6 secs Computing kpt #: 173 total cpu time spent up to now is 77.0 secs Computing kpt #: 174 total cpu time spent up to now is 77.4 secs Computing kpt #: 175 total cpu time spent up to now is 77.8 secs Computing kpt #: 176 total cpu time spent up to now is 78.2 secs Computing kpt #: 177 total cpu time spent up to now is 78.6 secs Computing kpt #: 178 total cpu time spent up to now is 79.1 secs Computing kpt #: 179 total cpu time spent up to now is 79.5 secs Computing kpt #: 180 total cpu time spent up to now is 79.9 secs Computing kpt #: 181 total cpu time spent up to now is 80.3 secs Computing kpt #: 182 total cpu time spent up to now is 80.7 secs Computing kpt #: 183 total cpu time spent up to now is 81.1 secs Computing kpt #: 184 total cpu time spent up to now is 81.6 secs Computing kpt #: 185 total cpu time spent up to now is 82.0 secs Computing kpt #: 186 total cpu time spent up to now is 82.4 secs Computing kpt #: 187 total cpu time spent up to now is 82.9 secs Computing kpt #: 188 total cpu time spent up to now is 83.3 secs Computing kpt #: 189 total cpu time spent up to now is 83.8 secs Computing kpt #: 190 total cpu time spent up to now is 84.2 secs Computing kpt #: 191 total cpu time spent up to now is 84.7 secs Computing kpt #: 192 total cpu time spent up to now is 85.1 secs Computing kpt #: 193 total cpu time spent up to now is 85.6 secs Computing kpt #: 194 total cpu time spent up to now is 86.0 secs Computing kpt #: 195 total cpu time spent up to now is 86.5 secs Computing kpt #: 196 total cpu time spent up to now is 86.9 secs Computing kpt #: 197 total cpu time spent up to now is 87.4 secs Computing kpt #: 198 total cpu time spent up to now is 87.8 secs Computing kpt #: 199 total cpu time spent up to now is 88.3 secs Computing kpt #: 200 total cpu time spent up to now is 88.7 secs Computing kpt #: 201 total cpu time spent up to now is 89.1 secs Computing kpt #: 202 total cpu time spent up to now is 89.6 secs Computing kpt #: 203 total cpu time spent up to now is 90.0 secs Computing kpt #: 204 total cpu time spent up to now is 90.4 secs Computing kpt #: 205 total cpu time spent up to now is 90.8 secs Computing kpt #: 206 total cpu time spent up to now is 91.2 secs Computing kpt #: 207 total cpu time spent up to now is 91.6 secs Computing kpt #: 208 total cpu time spent up to now is 92.0 secs Computing kpt #: 209 total cpu time spent up to now is 92.4 secs Computing kpt #: 210 total cpu time spent up to now is 92.8 secs Computing kpt #: 211 total cpu time spent up to now is 93.2 secs Computing kpt #: 212 total cpu time spent up to now is 93.6 secs Computing kpt #: 213 total cpu time spent up to now is 94.1 secs Computing kpt #: 214 total cpu time spent up to now is 94.5 secs Computing kpt #: 215 total cpu time spent up to now is 94.9 secs Computing kpt #: 216 total cpu time spent up to now is 95.3 secs Computing kpt #: 217 total cpu time spent up to now is 95.7 secs Computing kpt #: 218 total cpu time spent up to now is 96.1 secs Computing kpt #: 219 total cpu time spent up to now is 96.5 secs Computing kpt #: 220 total cpu time spent up to now is 96.9 secs Computing kpt #: 221 total cpu time spent up to now is 97.3 secs Computing kpt #: 222 total cpu time spent up to now is 97.7 secs Computing kpt #: 223 total cpu time spent up to now is 98.1 secs Computing kpt #: 224 total cpu time spent up to now is 98.5 secs Computing kpt #: 225 total cpu time spent up to now is 98.9 secs Computing kpt #: 226 total cpu time spent up to now is 99.3 secs Computing kpt #: 227 total cpu time spent up to now is 99.7 secs Computing kpt #: 228 total cpu time spent up to now is 100.1 secs Computing kpt #: 229 total cpu time spent up to now is 100.4 secs Computing kpt #: 230 total cpu time spent up to now is 100.8 secs Computing kpt #: 231 total cpu time spent up to now is 101.2 secs Computing kpt #: 232 total cpu time spent up to now is 101.6 secs Computing kpt #: 233 total cpu time spent up to now is 102.0 secs Computing kpt #: 234 total cpu time spent up to now is 102.4 secs Computing kpt #: 235 total cpu time spent up to now is 102.8 secs Computing kpt #: 236 total cpu time spent up to now is 103.2 secs Computing kpt #: 237 total cpu time spent up to now is 103.6 secs Computing kpt #: 238 total cpu time spent up to now is 104.1 secs Computing kpt #: 239 total cpu time spent up to now is 104.5 secs Computing kpt #: 240 total cpu time spent up to now is 104.9 secs Computing kpt #: 241 total cpu time spent up to now is 105.3 secs Computing kpt #: 242 total cpu time spent up to now is 105.7 secs Computing kpt #: 243 total cpu time spent up to now is 106.1 secs Computing kpt #: 244 total cpu time spent up to now is 106.5 secs Computing kpt #: 245 total cpu time spent up to now is 107.0 secs Computing kpt #: 246 total cpu time spent up to now is 107.4 secs Computing kpt #: 247 total cpu time spent up to now is 107.8 secs Computing kpt #: 248 total cpu time spent up to now is 108.3 secs Computing kpt #: 249 total cpu time spent up to now is 108.7 secs Computing kpt #: 250 total cpu time spent up to now is 109.2 secs Computing kpt #: 251 total cpu time spent up to now is 109.6 secs Computing kpt #: 252 total cpu time spent up to now is 110.0 secs Computing kpt #: 253 total cpu time spent up to now is 110.5 secs Computing kpt #: 254 total cpu time spent up to now is 110.9 secs Computing kpt #: 255 total cpu time spent up to now is 111.4 secs Computing kpt #: 256 total cpu time spent up to now is 111.8 secs Computing kpt #: 257 total cpu time spent up to now is 112.2 secs Computing kpt #: 258 total cpu time spent up to now is 112.7 secs Computing kpt #: 259 total cpu time spent up to now is 113.1 secs Computing kpt #: 260 total cpu time spent up to now is 113.5 secs Computing kpt #: 261 total cpu time spent up to now is 113.9 secs Computing kpt #: 262 total cpu time spent up to now is 114.3 secs Computing kpt #: 263 total cpu time spent up to now is 114.7 secs Computing kpt #: 264 total cpu time spent up to now is 115.2 secs Computing kpt #: 265 total cpu time spent up to now is 115.6 secs Computing kpt #: 266 total cpu time spent up to now is 116.0 secs Computing kpt #: 267 total cpu time spent up to now is 116.5 secs Computing kpt #: 268 total cpu time spent up to now is 116.9 secs Computing kpt #: 269 total cpu time spent up to now is 117.4 secs Computing kpt #: 270 total cpu time spent up to now is 117.8 secs Computing kpt #: 271 total cpu time spent up to now is 118.2 secs Computing kpt #: 272 total cpu time spent up to now is 118.7 secs Computing kpt #: 273 total cpu time spent up to now is 119.1 secs Computing kpt #: 274 total cpu time spent up to now is 119.6 secs Computing kpt #: 275 total cpu time spent up to now is 120.0 secs Computing kpt #: 276 total cpu time spent up to now is 120.5 secs Computing kpt #: 277 total cpu time spent up to now is 121.0 secs Computing kpt #: 278 total cpu time spent up to now is 121.4 secs Computing kpt #: 279 total cpu time spent up to now is 121.9 secs Computing kpt #: 280 total cpu time spent up to now is 122.3 secs Computing kpt #: 281 total cpu time spent up to now is 122.8 secs Computing kpt #: 282 total cpu time spent up to now is 123.2 secs Computing kpt #: 283 total cpu time spent up to now is 123.6 secs Computing kpt #: 284 total cpu time spent up to now is 124.0 secs Computing kpt #: 285 total cpu time spent up to now is 124.4 secs Computing kpt #: 286 total cpu time spent up to now is 124.8 secs Computing kpt #: 287 total cpu time spent up to now is 125.2 secs Computing kpt #: 288 total cpu time spent up to now is 125.7 secs Computing kpt #: 289 total cpu time spent up to now is 126.1 secs Computing kpt #: 290 total cpu time spent up to now is 126.5 secs Computing kpt #: 291 total cpu time spent up to now is 126.9 secs Computing kpt #: 292 total cpu time spent up to now is 127.3 secs Computing kpt #: 293 total cpu time spent up to now is 127.7 secs Computing kpt #: 294 total cpu time spent up to now is 128.1 secs Computing kpt #: 295 total cpu time spent up to now is 128.5 secs Computing kpt #: 296 total cpu time spent up to now is 128.9 secs Computing kpt #: 297 total cpu time spent up to now is 129.3 secs Computing kpt #: 298 total cpu time spent up to now is 129.7 secs Computing kpt #: 299 total cpu time spent up to now is 130.1 secs Computing kpt #: 300 total cpu time spent up to now is 130.5 secs Computing kpt #: 301 total cpu time spent up to now is 130.9 secs Computing kpt #: 302 total cpu time spent up to now is 131.3 secs Computing kpt #: 303 total cpu time spent up to now is 131.7 secs Computing kpt #: 304 total cpu time spent up to now is 132.1 secs Computing kpt #: 305 total cpu time spent up to now is 132.5 secs Computing kpt #: 306 total cpu time spent up to now is 132.9 secs Computing kpt #: 307 total cpu time spent up to now is 133.3 secs Computing kpt #: 308 total cpu time spent up to now is 133.7 secs ethr = 2.17E-08, avg # of iterations = 17.0 total cpu time spent up to now is 133.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5320 -9.5320 -9.5320 -9.5320 -2.0059 -2.0059 -2.0059 -2.0059 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5279 4.5279 7.1659 7.1659 7.1659 7.1659 7.1978 7.1978 7.1978 7.1978 7.4667 7.4667 8.0811 8.0811 8.0811 8.0811 8.3472 8.3472 8.6531 8.6531 8.6531 8.6531 12.5691 12.5691 12.7385 12.7385 12.7385 12.7385 15.2669 15.2669 15.2901 15.2901 15.2901 15.2901 15.3861 15.3861 15.7023 15.7023 k = 0.0109-0.0063 0.0089 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5321 -9.5321 -9.5320 -9.5320 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5296 4.5296 7.1632 7.1632 7.1660 7.1660 7.1982 7.1982 7.2006 7.2006 7.4667 7.4667 8.0811 8.0811 8.0811 8.0811 8.3472 8.3472 8.6517 8.6517 8.6531 8.6531 12.5664 12.5664 12.7351 12.7351 12.7353 12.7353 15.1732 15.1732 15.2897 15.2897 15.3251 15.3251 15.3930 15.3930 15.7074 15.7074 k = 0.0217-0.0126 0.0177 ( 2895 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5322 -9.5322 -9.5321 -9.5321 -2.0058 -2.0058 -2.0058 -2.0058 -1.1617 -1.1617 -1.1582 -1.1582 -1.1581 -1.1581 4.5348 4.5348 7.1567 7.1567 7.1663 7.1663 7.1995 7.1995 7.2073 7.2073 7.4668 7.4668 8.0809 8.0809 8.0810 8.0810 8.3469 8.3469 8.6475 8.6475 8.6529 8.6529 12.5585 12.5585 12.7250 12.7250 12.7256 12.7256 15.0299 15.0299 15.2887 15.2887 15.3387 15.3387 15.4127 15.4127 15.7225 15.7225 k = 0.0326-0.0188 0.0266 ( 2907 PWs) bands (ev): -29.9323 -29.9323 -10.9607 -10.9607 -9.5323 -9.5323 -9.5321 -9.5321 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1580 -1.1580 4.5434 4.5434 7.1486 7.1486 7.1668 7.1668 7.2015 7.2015 7.2159 7.2159 7.4670 7.4670 8.0806 8.0806 8.0806 8.0806 8.3463 8.3463 8.6405 8.6405 8.6527 8.6527 12.5456 12.5456 12.7085 12.7085 12.7098 12.7098 14.8720 14.8720 15.2868 15.2868 15.3455 15.3455 15.4430 15.4430 15.7473 15.7473 k = 0.0435-0.0251 0.0355 ( 2915 PWs) bands (ev): -29.9323 -29.9323 -10.9608 -10.9608 -9.5326 -9.5326 -9.5322 -9.5322 -2.0059 -2.0059 -2.0056 -2.0056 -1.1618 -1.1618 -1.1581 -1.1581 -1.1578 -1.1578 4.5554 4.5554 7.1397 7.1397 7.1676 7.1676 7.2043 7.2043 7.2256 7.2256 7.4672 7.4672 8.0803 8.0803 8.0803 8.0803 8.3456 8.3456 8.6309 8.6309 8.6524 8.6524 12.5279 12.5279 12.6861 12.6861 12.6884 12.6884 14.7100 14.7100 15.2843 15.2843 15.3521 15.3521 15.4829 15.4829 15.7815 15.7815 k = 0.0543-0.0314 0.0444 ( 2922 PWs) bands (ev): -29.9323 -29.9323 -10.9609 -10.9609 -9.5328 -9.5328 -9.5323 -9.5323 -2.0059 -2.0059 -2.0054 -2.0054 -1.1619 -1.1619 -1.1581 -1.1581 -1.1576 -1.1576 4.5708 4.5708 7.1301 7.1301 7.1687 7.1687 7.2078 7.2078 7.2361 7.2361 7.4677 7.4677 8.0798 8.0798 8.0800 8.0800 8.3446 8.3446 8.6186 8.6186 8.6521 8.6521 12.5059 12.5059 12.6585 12.6585 12.6619 12.6619 14.5479 14.5479 15.2811 15.2811 15.3602 15.3602 15.5320 15.5320 15.8244 15.8244 k = 0.0652-0.0377 0.0532 ( 2914 PWs) bands (ev): -29.9323 -29.9323 -10.9611 -10.9611 -9.5332 -9.5332 -9.5323 -9.5323 -2.0059 -2.0059 -2.0051 -2.0051 -1.1618 -1.1618 -1.1579 -1.1579 -1.1571 -1.1571 4.5896 4.5896 7.1200 7.1200 7.1700 7.1700 7.2120 7.2120 7.2473 7.2473 7.4684 7.4684 8.0793 8.0793 8.0798 8.0798 8.3437 8.3437 8.6038 8.6038 8.6516 8.6516 12.4801 12.4801 12.6265 12.6265 12.6311 12.6311 14.3873 14.3873 15.2772 15.2772 15.3700 15.3700 15.5894 15.5894 15.8755 15.8755 k = 0.0761-0.0439 0.0621 ( 2906 PWs) bands (ev): -29.9322 -29.9322 -10.9612 -10.9612 -9.5335 -9.5335 -9.5324 -9.5324 -2.0058 -2.0058 -2.0047 -2.0047 -1.1617 -1.1617 -1.1577 -1.1577 -1.1566 -1.1566 4.6117 4.6117 7.1092 7.1092 7.1717 7.1717 7.2169 7.2169 7.2590 7.2590 7.4695 7.4695 8.0786 8.0786 8.0794 8.0794 8.3425 8.3425 8.5867 8.5867 8.6511 8.6511 12.4510 12.4510 12.5908 12.5908 12.5965 12.5965 14.2289 14.2289 15.2726 15.2726 15.3817 15.3817 15.6546 15.6546 15.9339 15.9339 k = 0.0870-0.0502 0.0710 ( 2914 PWs) bands (ev): -29.9322 -29.9322 -10.9614 -10.9614 -9.5340 -9.5340 -9.5325 -9.5325 -2.0058 -2.0058 -2.0045 -2.0045 -1.1617 -1.1617 -1.1575 -1.1575 -1.1563 -1.1563 4.6371 4.6371 7.0978 7.0978 7.1737 7.1737 7.2223 7.2223 7.2714 7.2714 7.4709 7.4709 8.0777 8.0777 8.0790 8.0790 8.3411 8.3411 8.5671 8.5671 8.6505 8.6505 12.4192 12.4192 12.5522 12.5522 12.5590 12.5590 14.0732 14.0732 15.2674 15.2674 15.3951 15.3951 15.7264 15.7264 15.9987 15.9987 k = 0.0978-0.0565 0.0799 ( 2918 PWs) bands (ev): -29.9322 -29.9322 -10.9616 -10.9616 -9.5345 -9.5345 -9.5327 -9.5327 -2.0058 -2.0058 -2.0041 -2.0041 -1.1616 -1.1616 -1.1573 -1.1573 -1.1558 -1.1558 4.6657 4.6657 7.0857 7.0857 7.1759 7.1759 7.2283 7.2283 7.2843 7.2843 7.4728 7.4728 8.0767 8.0767 8.0786 8.0786 8.3395 8.3395 8.5455 8.5455 8.6499 8.6499 12.3851 12.3851 12.5114 12.5114 12.5191 12.5191 13.9203 13.9203 15.2615 15.2615 15.4104 15.4104 15.8040 15.8040 16.0690 16.0690 k = 0.1087-0.0628 0.0887 ( 2918 PWs) bands (ev): -29.9322 -29.9322 -10.9619 -10.9619 -9.5350 -9.5350 -9.5328 -9.5328 -2.0057 -2.0057 -2.0037 -2.0037 -1.1616 -1.1616 -1.1570 -1.1570 -1.1553 -1.1553 4.6974 4.6974 7.0730 7.0730 7.1785 7.1785 7.2349 7.2349 7.2978 7.2978 7.4752 7.4752 8.0754 8.0754 8.0781 8.0781 8.3376 8.3376 8.5221 8.5221 8.6492 8.6492 12.3493 12.3493 12.4692 12.4692 12.4776 12.4776 13.7703 13.7703 15.2550 15.2550 15.4273 15.4273 15.8862 15.8862 16.1436 16.1436 k = 0.1196-0.0690 0.0976 ( 2918 PWs) bands (ev): -29.9321 -29.9321 -10.9621 -10.9621 -9.5356 -9.5356 -9.5330 -9.5330 -2.0056 -2.0056 -2.0033 -2.0033 -1.1615 -1.1615 -1.1567 -1.1567 -1.1548 -1.1548 4.7323 4.7323 7.0595 7.0595 7.1814 7.1814 7.2419 7.2419 7.3120 7.3120 7.4781 7.4781 8.0738 8.0738 8.0777 8.0777 8.3356 8.3356 8.4969 8.4969 8.6484 8.6484 12.3124 12.3124 12.4261 12.4261 12.4351 12.4351 13.6233 13.6233 15.2479 15.2479 15.4459 15.4459 15.9719 15.9719 16.2214 16.2214 k = 0.1304-0.0753 0.1065 ( 2926 PWs) bands (ev): -29.9321 -29.9321 -10.9624 -10.9624 -9.5362 -9.5362 -9.5331 -9.5331 -2.0056 -2.0056 -2.0029 -2.0029 -1.1616 -1.1616 -1.1564 -1.1564 -1.1543 -1.1543 4.7701 4.7701 7.0454 7.0454 7.1845 7.1845 7.2494 7.2494 7.3266 7.3266 7.4818 7.4818 8.0717 8.0717 8.0771 8.0771 8.3331 8.3331 8.4705 8.4705 8.6477 8.6477 12.2746 12.2746 12.3827 12.3827 12.3919 12.3919 13.4792 13.4792 15.2402 15.2402 15.4661 15.4661 16.0596 16.0596 16.3009 16.3009 k = 0.1413-0.0816 0.1154 ( 2918 PWs) bands (ev): -29.9321 -29.9321 -10.9626 -10.9626 -9.5368 -9.5368 -9.5333 -9.5333 -2.0055 -2.0055 -2.0024 -2.0024 -1.1615 -1.1615 -1.1560 -1.1560 -1.1537 -1.1537 4.8107 4.8107 7.0308 7.0308 7.1879 7.1879 7.2574 7.2574 7.3418 7.3418 7.4862 7.4862 8.0692 8.0692 8.0766 8.0766 8.3302 8.3302 8.4431 8.4431 8.6469 8.6469 12.2365 12.2365 12.3394 12.3394 12.3486 12.3486 13.3379 13.3379 15.2321 15.2321 15.4879 15.4879 16.1479 16.1479 16.3806 16.3806 k = 0.1522-0.0879 0.1242 ( 2922 PWs) bands (ev): -29.9320 -29.9320 -10.9629 -10.9629 -9.5375 -9.5375 -9.5335 -9.5335 -2.0055 -2.0055 -2.0020 -2.0020 -1.1615 -1.1615 -1.1556 -1.1556 -1.1532 -1.1532 4.8542 4.8542 7.0155 7.0155 7.1915 7.1915 7.2656 7.2656 7.3574 7.3574 7.4912 7.4912 8.0661 8.0661 8.0761 8.0761 8.3266 8.3266 8.4152 8.4152 8.6462 8.6462 12.1983 12.1983 12.2968 12.2968 12.3057 12.3057 13.1993 13.1993 15.2234 15.2234 15.5110 15.5110 16.2349 16.2349 16.4584 16.4584 k = 0.1630-0.0941 0.1331 ( 2922 PWs) bands (ev): -29.9320 -29.9320 -10.9632 -10.9632 -9.5382 -9.5382 -9.5337 -9.5337 -2.0054 -2.0054 -2.0016 -2.0016 -1.1615 -1.1615 -1.1551 -1.1551 -1.1526 -1.1526 4.9002 4.9002 6.9999 6.9999 7.1953 7.1953 7.2742 7.2742 7.3734 7.3734 7.4970 7.4970 8.0623 8.0623 8.0757 8.0757 8.3217 8.3217 8.3880 8.3880 8.6454 8.6454 12.1604 12.1604 12.2552 12.2552 12.2634 12.2634 13.0634 13.0634 15.2142 15.2142 15.5355 15.5355 16.3184 16.3184 16.5321 16.5321 k = 0.1739-0.1004 0.1420 ( 2922 PWs) bands (ev): -29.9319 -29.9319 -10.9635 -10.9635 -9.5389 -9.5389 -9.5338 -9.5338 -2.0053 -2.0053 -2.0011 -2.0011 -1.1616 -1.1616 -1.1546 -1.1546 -1.1521 -1.1521 4.9487 4.9487 6.9840 6.9840 7.1994 7.1994 7.2830 7.2830 7.3897 7.3897 7.5036 7.5036 8.0576 8.0576 8.0753 8.0753 8.3137 8.3137 8.3633 8.3633 8.6446 8.6446 12.1230 12.1230 12.2148 12.2148 12.2221 12.2221 12.9300 12.9300 15.2047 15.2047 15.5612 15.5612 16.3958 16.3958 16.5989 16.5989 k = 0.1848-0.1067 0.1509 ( 2914 PWs) bands (ev): -29.9319 -29.9319 -10.9638 -10.9638 -9.5396 -9.5396 -9.5340 -9.5340 -2.0052 -2.0052 -2.0007 -2.0007 -1.1616 -1.1616 -1.1541 -1.1541 -1.1516 -1.1516 4.9995 4.9995 6.9679 6.9679 7.2038 7.2038 7.2919 7.2919 7.4063 7.4063 7.5110 7.5110 8.0519 8.0519 8.0751 8.0751 8.2995 8.2995 8.3452 8.3452 8.6438 8.6438 12.0862 12.0862 12.1761 12.1761 12.1820 12.1820 12.7989 12.7989 15.1947 15.1947 15.5878 15.5878 16.4641 16.4641 16.6558 16.6558 k = 0.1957-0.1130 0.1597 ( 2902 PWs) bands (ev): -29.9319 -29.9319 -10.9641 -10.9641 -9.5404 -9.5404 -9.5342 -9.5342 -2.0050 -2.0050 -2.0002 -2.0002 -1.1615 -1.1615 -1.1535 -1.1535 -1.1511 -1.1511 5.0523 5.0523 6.9520 6.9520 7.2082 7.2082 7.3011 7.3011 7.4228 7.4228 7.5194 7.5194 8.0447 8.0447 8.0748 8.0748 8.2781 8.2781 8.3347 8.3347 8.6432 8.6432 12.0503 12.0503 12.1391 12.1391 12.1432 12.1432 12.6702 12.6702 15.1845 15.1845 15.6152 15.6152 16.5200 16.5200 16.6997 16.6997 k = 0.2065-0.1192 0.1686 ( 2902 PWs) bands (ev): -29.9318 -29.9318 -10.9645 -10.9645 -9.5411 -9.5411 -9.5345 -9.5345 -2.0049 -2.0049 -1.9999 -1.9999 -1.1616 -1.1616 -1.1530 -1.1530 -1.1507 -1.1507 5.1070 5.1070 6.9363 6.9363 7.2128 7.2128 7.3102 7.3102 7.4394 7.4394 7.5286 7.5286 8.0358 8.0358 8.0748 8.0748 8.2535 8.2535 8.3285 8.3285 8.6425 8.6425 12.0152 12.0152 12.1042 12.1042 12.1060 12.1060 12.5436 12.5436 15.1739 15.1739 15.6430 15.6430 16.5601 16.5601 16.7278 16.7278 k = 0.2174-0.1255 0.1775 ( 2906 PWs) bands (ev): -29.9318 -29.9318 -10.9648 -10.9648 -9.5419 -9.5419 -9.5347 -9.5347 -2.0049 -2.0049 -1.9995 -1.9995 -1.1617 -1.1617 -1.1525 -1.1525 -1.1503 -1.1503 5.1632 5.1632 6.9212 6.9212 7.2175 7.2175 7.3191 7.3191 7.4556 7.4556 7.5387 7.5387 8.0249 8.0249 8.0749 8.0749 8.2288 8.2288 8.3241 8.3241 8.6416 8.6416 11.9813 11.9813 12.0703 12.0703 12.0714 12.0714 12.4190 12.4190 15.1630 15.1630 15.6709 15.6709 16.5821 16.5821 16.7384 16.7384 k = 0.2283-0.1318 0.1864 ( 2902 PWs) bands (ev): -29.9317 -29.9317 -10.9651 -10.9651 -9.5426 -9.5426 -9.5349 -9.5349 -2.0048 -2.0048 -1.9991 -1.9991 -1.1618 -1.1618 -1.1519 -1.1519 -1.1499 -1.1499 5.2207 5.2207 6.9069 6.9069 7.2223 7.2223 7.3279 7.3279 7.4715 7.4715 7.5499 7.5499 8.0117 8.0117 8.0752 8.0752 8.2056 8.2056 8.3204 8.3204 8.6410 8.6410 11.9484 11.9484 12.0360 12.0360 12.0409 12.0409 12.2968 12.2968 15.1519 15.1519 15.6984 15.6984 16.5848 16.5848 16.7310 16.7310 k = 0.2391-0.1381 0.1952 ( 2906 PWs) bands (ev): -29.9317 -29.9317 -10.9655 -10.9655 -9.5433 -9.5433 -9.5351 -9.5351 -2.0048 -2.0048 -1.9989 -1.9989 -1.1618 -1.1618 -1.1513 -1.1513 -1.1497 -1.1497 5.2791 5.2791 6.8938 6.8938 7.2272 7.2272 7.3364 7.3364 7.4868 7.4868 7.5623 7.5623 7.9961 7.9961 8.0757 8.0757 8.1845 8.1845 8.3172 8.3172 8.6404 8.6404 11.9167 11.9167 12.0023 12.0023 12.0128 12.0128 12.1774 12.1774 15.1407 15.1407 15.7248 15.7248 16.5687 16.5687 16.7067 16.7067 k = 0.2500-0.1443 0.2041 ( 2906 PWs) bands (ev): -29.9316 -29.9316 -10.9658 -10.9658 -9.5441 -9.5441 -9.5353 -9.5353 -2.0047 -2.0047 -1.9986 -1.9986 -1.1619 -1.1619 -1.1508 -1.1508 -1.1495 -1.1495 5.3380 5.3380 6.8821 6.8821 7.2321 7.2321 7.3445 7.3445 7.5015 7.5015 7.5757 7.5757 7.9783 7.9783 8.0765 8.0765 8.1658 8.1658 8.3143 8.3143 8.6399 8.6399 11.8862 11.8862 11.9652 11.9652 11.9870 11.9870 12.0650 12.0650 15.1293 15.1293 15.7491 15.7491 16.5361 16.5361 16.6677 16.6677 k = 0.2609-0.1506 0.2130 ( 2906 PWs) bands (ev): -29.9316 -29.9316 -10.9661 -10.9661 -9.5448 -9.5448 -9.5356 -9.5356 -2.0046 -2.0046 -1.9984 -1.9984 -1.1620 -1.1620 -1.1502 -1.1502 -1.1493 -1.1493 5.3969 5.3969 6.8723 6.8723 7.2370 7.2370 7.3519 7.3519 7.5155 7.5155 7.5901 7.5901 7.9586 7.9586 8.0776 8.0776 8.1494 8.1494 8.3116 8.3116 8.6394 8.6394 11.8571 11.8571 11.9023 11.9023 11.9637 11.9637 11.9816 11.9816 15.1180 15.1180 15.7701 15.7701 16.4898 16.4898 16.6167 16.6167 k = 0.2717-0.1569 0.2219 ( 2906 PWs) bands (ev): -29.9315 -29.9315 -10.9664 -10.9664 -9.5455 -9.5455 -9.5358 -9.5358 -2.0046 -2.0046 -1.9982 -1.9982 -1.1621 -1.1621 -1.1496 -1.1496 -1.1492 -1.1492 5.4553 5.4553 6.8647 6.8647 7.2420 7.2420 7.3587 7.3587 7.5288 7.5288 7.6055 7.6055 7.9378 7.9378 8.0791 8.0791 8.1351 8.1351 8.3091 8.3091 8.6390 8.6390 11.7995 11.7995 11.8292 11.8292 11.9416 11.9416 11.9428 11.9428 15.1066 15.1066 15.7861 15.7861 16.4332 16.4332 16.5565 16.5565 k = 0.2826-0.1632 0.2307 ( 2922 PWs) bands (ev): -29.9315 -29.9315 -10.9667 -10.9667 -9.5462 -9.5462 -9.5360 -9.5360 -2.0046 -2.0046 -1.9981 -1.9981 -1.1623 -1.1623 -1.1492 -1.1492 -1.1492 -1.1492 5.5126 5.5126 6.8598 6.8598 7.2469 7.2469 7.3644 7.3644 7.5415 7.5415 7.6214 7.6214 7.9166 7.9166 8.0810 8.0810 8.1223 8.1223 8.3068 8.3068 8.6387 8.6387 11.6862 11.6862 11.8027 11.8027 11.9151 11.9151 11.9242 11.9242 15.0952 15.0952 15.7949 15.7949 16.3694 16.3694 16.4897 16.4897 k = 0.2935-0.1694 0.2396 ( 2922 PWs) bands (ev): -29.9314 -29.9314 -10.9670 -10.9670 -9.5468 -9.5468 -9.5362 -9.5362 -2.0045 -2.0045 -1.9980 -1.9980 -1.1624 -1.1624 -1.1492 -1.1492 -1.1486 -1.1486 5.5683 5.5683 6.8580 6.8580 7.2517 7.2517 7.3691 7.3691 7.5539 7.5539 7.6379 7.6379 7.8958 7.8958 8.0836 8.0836 8.1107 8.1107 8.3046 8.3046 8.6385 8.6385 11.5714 11.5714 11.7775 11.7775 11.8932 11.8932 11.9080 11.9080 15.0840 15.0840 15.7941 15.7941 16.3012 16.3012 16.4185 16.4185 k = 0.3043-0.1757 0.2485 ( 2918 PWs) bands (ev): -29.9314 -29.9314 -10.9673 -10.9673 -9.5474 -9.5474 -9.5364 -9.5364 -2.0045 -2.0045 -1.9978 -1.9978 -1.1625 -1.1625 -1.1492 -1.1492 -1.1481 -1.1481 5.6217 5.6217 6.8597 6.8597 7.2565 7.2565 7.3726 7.3726 7.5661 7.5661 7.6547 7.6547 7.8760 7.8760 8.0868 8.0868 8.0999 8.0999 8.3027 8.3027 8.6384 8.6384 11.4566 11.4566 11.7537 11.7537 11.8743 11.8743 11.8939 11.8939 15.0729 15.0729 15.7812 15.7812 16.2309 16.2309 16.3446 16.3446 k = 0.3152-0.1820 0.2574 ( 2926 PWs) bands (ev): -29.9313 -29.9313 -10.9676 -10.9676 -9.5480 -9.5480 -9.5366 -9.5366 -2.0044 -2.0044 -1.9979 -1.9979 -1.1626 -1.1626 -1.1494 -1.1494 -1.1476 -1.1476 5.6721 5.6721 6.8653 6.8653 7.2612 7.2612 7.3747 7.3747 7.5779 7.5779 7.6715 7.6715 7.8578 7.8578 8.0896 8.0896 8.0907 8.0907 8.3010 8.3010 8.6385 8.6385 11.3423 11.3423 11.7314 11.7314 11.8578 11.8578 11.8819 11.8819 15.0620 15.0620 15.7551 15.7551 16.1601 16.1601 16.2696 16.2696 k = 0.3261-0.1883 0.2662 ( 2918 PWs) bands (ev): -29.9313 -29.9313 -10.9679 -10.9679 -9.5486 -9.5486 -9.5368 -9.5368 -2.0043 -2.0043 -1.9978 -1.9978 -1.1626 -1.1626 -1.1495 -1.1495 -1.1470 -1.1470 5.7190 5.7190 6.8750 6.8750 7.2657 7.2657 7.3753 7.3753 7.5898 7.5898 7.6882 7.6882 7.8416 7.8416 8.0796 8.0796 8.0956 8.0956 8.2994 8.2994 8.6388 8.6388 11.2288 11.2288 11.7103 11.7103 11.8435 11.8435 11.8720 11.8720 15.0514 15.0514 15.7163 15.7163 16.0895 16.0895 16.1945 16.1945 k = 0.3370-0.1945 0.2751 ( 2918 PWs) bands (ev): -29.9313 -29.9313 -10.9681 -10.9681 -9.5491 -9.5491 -9.5370 -9.5370 -2.0043 -2.0043 -1.9977 -1.9977 -1.1627 -1.1627 -1.1496 -1.1496 -1.1465 -1.1465 5.7618 5.7618 6.8890 6.8890 7.2701 7.2701 7.3742 7.3742 7.6017 7.6017 7.7045 7.7045 7.8279 7.8279 8.0696 8.0696 8.1015 8.1015 8.2980 8.2980 8.6392 8.6392 11.1162 11.1162 11.6907 11.6907 11.8312 11.8312 11.8639 11.8639 15.0412 15.0412 15.6672 15.6672 16.0198 16.0198 16.1203 16.1203 k = 0.3478-0.2008 0.2840 ( 2918 PWs) bands (ev): -29.9312 -29.9312 -10.9684 -10.9684 -9.5496 -9.5496 -9.5372 -9.5372 -2.0043 -2.0043 -1.9978 -1.9978 -1.1628 -1.1628 -1.1498 -1.1498 -1.1461 -1.1461 5.8001 5.8001 6.9071 6.9071 7.2744 7.2744 7.3715 7.3715 7.6138 7.6138 7.7204 7.7204 7.8167 7.8167 8.0597 8.0597 8.1086 8.1086 8.2969 8.2969 8.6398 8.6398 11.0047 11.0047 11.6724 11.6724 11.8208 11.8208 11.8575 11.8575 15.0313 15.0313 15.6112 15.6112 15.9515 15.9515 16.0479 16.0479 k = 0.3587-0.2071 0.2929 ( 2934 PWs) bands (ev): -29.9312 -29.9312 -10.9686 -10.9686 -9.5501 -9.5501 -9.5374 -9.5374 -2.0043 -2.0043 -1.9979 -1.9979 -1.1630 -1.1630 -1.1501 -1.1501 -1.1457 -1.1457 5.8337 5.8337 6.9291 6.9291 7.2784 7.2784 7.3672 7.3672 7.6260 7.6260 7.7355 7.7355 7.8080 7.8080 8.0498 8.0498 8.1170 8.1170 8.2958 8.2958 8.6406 8.6406 10.8946 10.8946 11.6555 11.6555 11.8121 11.8121 11.8527 11.8527 15.0217 15.0217 15.5516 15.5516 15.8850 15.8850 15.9779 15.9779 k = 0.3696-0.2134 0.3017 ( 2938 PWs) bands (ev): -29.9311 -29.9311 -10.9688 -10.9688 -9.5506 -9.5506 -9.5376 -9.5376 -2.0043 -2.0043 -1.9980 -1.9980 -1.1631 -1.1631 -1.1504 -1.1504 -1.1454 -1.1454 5.8627 5.8627 6.9544 6.9544 7.2823 7.2823 7.3617 7.3617 7.6385 7.6385 7.7499 7.7499 7.8021 7.8021 8.0397 8.0397 8.1271 8.1271 8.2950 8.2950 8.6418 8.6418 10.7863 10.7863 11.6399 11.6399 11.8049 11.8049 11.8493 11.8493 15.0127 15.0127 15.4912 15.4912 15.8211 15.8211 15.9110 15.9110 k = 0.3804-0.2196 0.3106 ( 2930 PWs) bands (ev): -29.9311 -29.9311 -10.9690 -10.9690 -9.5510 -9.5510 -9.5377 -9.5377 -2.0042 -2.0042 -1.9980 -1.9980 -1.1632 -1.1632 -1.1505 -1.1505 -1.1450 -1.1450 5.8870 5.8870 6.9823 6.9823 7.2859 7.2859 7.3552 7.3552 7.6512 7.6512 7.7635 7.7635 7.7987 7.7987 8.0297 8.0297 8.1388 8.1388 8.2943 8.2943 8.6433 8.6433 10.6802 10.6802 11.6257 11.6257 11.7992 11.7992 11.8472 11.8472 15.0042 15.0042 15.4320 15.4320 15.7604 15.7604 15.8476 15.8476 k = 0.3913-0.2259 0.3195 ( 2926 PWs) bands (ev): -29.9311 -29.9311 -10.9692 -10.9692 -9.5513 -9.5513 -9.5379 -9.5379 -2.0042 -2.0042 -1.9980 -1.9980 -1.1632 -1.1632 -1.1508 -1.1508 -1.1446 -1.1446 5.9071 5.9071 7.0117 7.0117 7.2892 7.2892 7.3479 7.3479 7.6641 7.6641 7.7761 7.7761 7.7973 7.7973 8.0196 8.0196 8.1525 8.1525 8.2937 8.2937 8.6452 8.6452 10.5769 10.5769 11.6127 11.6127 11.7947 11.7947 11.8460 11.8460 14.9963 14.9963 15.3754 15.3754 15.7032 15.7032 15.7883 15.7883 k = 0.4022-0.2322 0.3284 ( 2946 PWs) bands (ev): -29.9311 -29.9311 -10.9694 -10.9694 -9.5517 -9.5517 -9.5380 -9.5380 -2.0043 -2.0043 -1.9982 -1.9982 -1.1634 -1.1634 -1.1512 -1.1512 -1.1443 -1.1443 5.9234 5.9234 7.0416 7.0416 7.2923 7.2923 7.3400 7.3400 7.6770 7.6770 7.7874 7.7874 7.7978 7.7978 8.0095 8.0095 8.1680 8.1680 8.2932 8.2932 8.6474 8.6474 10.4770 10.4770 11.6010 11.6010 11.7913 11.7913 11.8458 11.8458 14.9889 14.9889 15.3225 15.3225 15.6502 15.6502 15.7333 15.7333 k = 0.4130-0.2385 0.3372 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9695 -10.9695 -9.5520 -9.5520 -9.5381 -9.5381 -2.0043 -2.0043 -1.9983 -1.9983 -1.1635 -1.1635 -1.1514 -1.1514 -1.1440 -1.1440 5.9364 5.9364 7.0708 7.0708 7.2951 7.2951 7.3321 7.3321 7.6898 7.6898 7.7976 7.7976 7.8000 7.8000 7.9996 7.9996 8.1853 8.1853 8.2928 8.2928 8.6502 8.6502 10.3815 10.3815 11.5906 11.5906 11.7887 11.7887 11.8462 11.8462 14.9823 14.9823 15.2740 15.2740 15.6017 15.6017 15.6831 15.6831 k = 0.4239-0.2447 0.3461 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9697 -10.9697 -9.5522 -9.5522 -9.5382 -9.5382 -2.0042 -2.0042 -1.9984 -1.9984 -1.1635 -1.1635 -1.1516 -1.1516 -1.1438 -1.1438 5.9466 5.9466 7.0985 7.0985 7.2976 7.2976 7.3244 7.3244 7.7022 7.7022 7.8034 7.8034 7.8065 7.8065 7.9898 7.9898 8.2040 8.2040 8.2926 8.2926 8.6536 8.6536 10.2913 10.2913 11.5814 11.5814 11.7870 11.7870 11.8470 11.8470 14.9763 14.9763 15.2305 15.2305 15.5581 15.5581 15.6380 15.6380 k = 0.4348-0.2510 0.3550 ( 2954 PWs) bands (ev): -29.9310 -29.9310 -10.9698 -10.9698 -9.5525 -9.5525 -9.5383 -9.5383 -2.0043 -2.0043 -1.9985 -1.9985 -1.1636 -1.1636 -1.1519 -1.1519 -1.1436 -1.1436 5.9544 5.9544 7.1236 7.1236 7.2997 7.2997 7.3173 7.3173 7.7138 7.7138 7.8077 7.8077 7.8142 7.8142 7.9804 7.9804 8.2236 8.2236 8.2923 8.2923 8.6576 8.6576 10.2078 10.2078 11.5735 11.5735 11.7858 11.7858 11.8482 11.8482 14.9710 14.9710 15.1922 15.1922 15.5197 15.5197 15.5983 15.5983 k = 0.4457-0.2573 0.3639 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9699 -10.9699 -9.5527 -9.5527 -9.5384 -9.5384 -2.0042 -2.0042 -1.9985 -1.9985 -1.1636 -1.1636 -1.1520 -1.1520 -1.1434 -1.1434 5.9602 5.9602 7.1457 7.1457 7.3014 7.3014 7.3110 7.3110 7.7244 7.7244 7.8126 7.8126 7.8206 7.8206 7.9715 7.9715 8.2432 8.2432 8.2922 8.2922 8.6621 8.6621 10.1324 10.1324 11.5669 11.5669 11.7851 11.7851 11.8496 11.8496 14.9665 14.9665 15.1596 15.1596 15.4868 15.4868 15.5643 15.5643 k = 0.4565-0.2636 0.3727 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5528 -9.5528 -9.5385 -9.5385 -2.0042 -2.0042 -1.9986 -1.9986 -1.1637 -1.1637 -1.1522 -1.1522 -1.1432 -1.1432 5.9646 5.9646 7.1641 7.1641 7.3024 7.3024 7.3061 7.3061 7.7337 7.7337 7.8176 7.8176 7.8256 7.8256 7.9635 7.9635 8.2617 8.2617 8.2920 8.2920 8.6668 8.6668 10.0669 10.0669 11.5614 11.5614 11.7847 11.7847 11.8509 11.8509 14.9627 14.9627 15.1326 15.1326 15.4595 15.4595 15.5361 15.5361 k = 0.4674-0.2698 0.3816 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9700 -10.9700 -9.5529 -9.5529 -9.5385 -9.5385 -2.0042 -2.0042 -1.9986 -1.9986 -1.1637 -1.1637 -1.1523 -1.1523 -1.1431 -1.1431 5.9676 5.9676 7.1787 7.1787 7.3001 7.3001 7.3050 7.3050 7.7413 7.7413 7.8222 7.8222 7.8294 7.8294 7.9566 7.9566 8.2777 8.2777 8.2920 8.2920 8.6714 8.6714 10.0132 10.0132 11.5572 11.5572 11.7845 11.7845 11.8520 11.8520 14.9598 14.9598 15.1116 15.1116 15.4381 15.4381 15.5140 15.5140 k = 0.4783-0.2761 0.3905 ( 2950 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5530 -9.5530 -9.5386 -9.5386 -2.0043 -2.0043 -1.9987 -1.9987 -1.1638 -1.1638 -1.1524 -1.1524 -1.1430 -1.1430 5.9696 5.9696 7.1892 7.1892 7.2971 7.2971 7.3056 7.3056 7.7469 7.7469 7.8259 7.8259 7.8321 7.8321 7.9512 7.9512 8.2903 8.2903 8.2919 8.2919 8.6754 8.6754 9.9730 9.9730 11.5542 11.5542 11.7845 11.7845 11.8529 11.8529 14.9577 14.9577 15.0965 15.0965 15.4227 15.4227 15.4982 15.4982 k = 0.4891-0.2824 0.3994 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0043 -2.0043 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1430 -1.1430 5.9707 5.9707 7.1955 7.1955 7.2951 7.2951 7.3061 7.3061 7.7504 7.7504 7.8284 7.8284 7.8336 7.8336 7.9478 7.9478 8.2919 8.2919 8.2982 8.2982 8.6781 8.6781 9.9481 9.9481 11.5523 11.5523 11.7845 11.7845 11.8535 11.8535 14.9564 14.9564 15.0874 15.0874 15.4134 15.4134 15.4886 15.4886 k = 0.5000-0.2887 0.4082 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0043 -2.0043 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1429 -1.1429 5.9711 5.9711 7.1976 7.1976 7.2944 7.2944 7.3062 7.3062 7.7516 7.7516 7.8293 7.8293 7.8342 7.8342 7.9466 7.9466 8.2919 8.2919 8.3009 8.3009 8.6791 8.6791 9.9397 9.9397 11.5517 11.5517 11.7845 11.7845 11.8537 11.8537 14.9560 14.9560 15.0844 15.0844 15.4103 15.4103 15.4854 15.4854 k = 0.5000-0.2887 0.4082 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0043 -2.0043 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1429 -1.1429 5.9711 5.9711 7.1976 7.1976 7.2944 7.2944 7.3062 7.3062 7.7516 7.7516 7.8293 7.8293 7.8342 7.8342 7.9466 7.9466 8.2919 8.2919 8.3009 8.3009 8.6791 8.6791 9.9397 9.9397 11.5517 11.5517 11.7845 11.7845 11.8537 11.8537 14.9560 14.9560 15.0844 15.0844 15.4103 15.4103 15.4854 15.4854 k = 0.5000-0.2761 0.4171 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0042 -2.0042 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1429 -1.1429 5.9714 5.9714 7.1977 7.1977 7.2936 7.2936 7.3077 7.3077 7.7481 7.7481 7.8298 7.8298 7.8360 7.8360 7.9455 7.9455 8.2883 8.2883 8.3078 8.3078 8.6783 8.6783 9.9401 9.9401 11.5171 11.5171 11.7948 11.7948 11.8730 11.8730 14.9588 14.9588 15.0914 15.0914 15.4096 15.4096 15.4846 15.4846 k = 0.5000-0.2636 0.4260 ( 2950 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5387 -9.5387 -2.0041 -2.0041 -1.9987 -1.9987 -1.1637 -1.1637 -1.1525 -1.1525 -1.1429 -1.1429 5.9725 5.9725 7.1979 7.1979 7.2922 7.2922 7.3112 7.3112 7.7391 7.7391 7.8290 7.8290 7.8427 7.8427 7.9425 7.9425 8.2841 8.2841 8.3217 8.3217 8.6761 8.6761 9.9414 9.9414 11.4433 11.4433 11.7840 11.7840 11.9426 11.9426 14.9660 14.9660 15.1134 15.1134 15.4071 15.4071 15.4824 15.4824 k = 0.5000-0.2510 0.4349 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5530 -9.5530 -9.5388 -9.5388 -2.0040 -2.0040 -1.9987 -1.9987 -1.1635 -1.1635 -1.1524 -1.1524 -1.1429 -1.1429 5.9742 5.9742 7.1980 7.1980 7.2915 7.2915 7.3155 7.3155 7.7264 7.7264 7.8268 7.8268 7.8523 7.8523 7.9382 7.9382 8.2805 8.2805 8.3402 8.3402 8.6725 8.6725 9.9434 9.9434 11.3586 11.3586 11.7504 11.7504 12.0373 12.0373 14.9748 14.9748 15.1518 15.1518 15.4024 15.4024 15.4794 15.4794 k = 0.5000-0.2385 0.4437 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5529 -9.5529 -9.5389 -9.5389 -2.0039 -2.0039 -1.9987 -1.9987 -1.1633 -1.1633 -1.1523 -1.1523 -1.1429 -1.1429 5.9766 5.9766 7.1978 7.1978 7.2922 7.2922 7.3201 7.3201 7.7116 7.7116 7.8234 7.8234 7.8632 7.8632 7.9337 7.9337 8.2773 8.2773 8.3625 8.3625 8.6681 8.6681 9.9463 9.9463 11.2717 11.2717 11.7020 11.7020 12.1413 12.1413 14.9836 14.9836 15.2064 15.2064 15.3947 15.3947 15.4765 15.4765 k = 0.5000-0.2259 0.4526 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5528 -9.5528 -9.5390 -9.5390 -2.0037 -2.0037 -1.9986 -1.9986 -1.1631 -1.1631 -1.1522 -1.1522 -1.1429 -1.1429 5.9796 5.9796 7.1969 7.1969 7.2949 7.2949 7.3248 7.3248 7.6957 7.6957 7.8188 7.8188 7.8744 7.8744 7.9297 7.9297 8.2740 8.2740 8.3872 8.3872 8.6636 8.6636 9.9501 9.9501 11.1857 11.1857 11.6419 11.6419 12.2501 12.2501 14.9918 14.9918 15.2740 15.2740 15.3838 15.3838 15.4750 15.4750 k = 0.5000-0.2134 0.4615 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5527 -9.5527 -9.5392 -9.5392 -2.0035 -2.0035 -1.9986 -1.9986 -1.1628 -1.1628 -1.1521 -1.1521 -1.1430 -1.1430 5.9832 5.9832 7.1952 7.1952 7.2995 7.2995 7.3294 7.3294 7.6793 7.6793 7.8133 7.8133 7.8855 7.8855 7.9268 7.9268 8.2705 8.2705 8.4125 8.4125 8.6602 8.6602 9.9547 9.9547 11.1020 11.1020 11.5723 11.5723 12.3620 12.3620 14.9997 14.9997 15.3388 15.3388 15.3815 15.3815 15.4763 15.4763 k = 0.5000-0.2008 0.4704 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5526 -9.5526 -9.5394 -9.5394 -2.0033 -2.0033 -1.9987 -1.9987 -1.1626 -1.1626 -1.1520 -1.1520 -1.1430 -1.1430 5.9872 5.9872 7.1927 7.1927 7.3061 7.3061 7.3338 7.3338 7.6628 7.6628 7.8071 7.8071 7.8960 7.8960 7.9254 7.9254 8.2668 8.2668 8.4356 8.4356 8.6600 8.6600 9.9602 9.9602 11.0211 11.0211 11.4952 11.4952 12.4762 12.4762 15.0077 15.0077 15.3348 15.3348 15.4409 15.4409 15.4897 15.4897 k = 0.5000-0.1883 0.4792 ( 2944 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5524 -9.5524 -9.5397 -9.5397 -2.0031 -2.0031 -1.9987 -1.9987 -1.1623 -1.1623 -1.1519 -1.1519 -1.1431 -1.1431 5.9917 5.9917 7.1894 7.1894 7.3142 7.3142 7.3381 7.3381 7.6469 7.6469 7.8004 7.8004 7.9056 7.9056 7.9260 7.9260 8.2628 8.2628 8.4532 8.4532 8.6661 8.6661 9.9666 9.9666 10.9433 10.9433 11.4122 11.4122 12.5920 12.5920 15.0157 15.0157 15.3089 15.3089 15.4667 15.4667 15.5602 15.5602 k = 0.5000-0.1757 0.4881 ( 2938 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5523 -9.5523 -9.5399 -9.5399 -2.0028 -2.0028 -1.9986 -1.9986 -1.1619 -1.1619 -1.1517 -1.1517 -1.1431 -1.1431 5.9966 5.9966 7.1856 7.1856 7.3232 7.3232 7.3425 7.3425 7.6322 7.6322 7.7936 7.7936 7.9131 7.9131 7.9294 7.9294 8.2586 8.2586 8.4621 8.4621 8.6814 8.6814 9.9739 9.9739 10.8691 10.8691 11.3251 11.3251 12.7090 12.7090 15.0240 15.0240 15.2767 15.2767 15.4727 15.4727 15.6547 15.6547 k = 0.5000-0.1632 0.4970 ( 2938 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5521 -9.5521 -9.5402 -9.5402 -2.0025 -2.0025 -1.9986 -1.9986 -1.1616 -1.1616 -1.1515 -1.1515 -1.1432 -1.1432 6.0017 6.0017 7.1815 7.1815 7.3317 7.3317 7.3476 7.3476 7.6192 7.6192 7.7869 7.7869 7.9183 7.9183 7.9357 7.9357 8.2542 8.2542 8.4609 8.4609 8.7067 8.7067 9.9821 9.9821 10.7984 10.7984 11.2352 11.2352 12.8269 12.8269 15.0322 15.0322 15.2393 15.2393 15.4772 15.4772 15.7498 15.7498 k = 0.5000-0.1506 0.5059 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5519 -9.5519 -9.5405 -9.5405 -2.0022 -2.0022 -1.9986 -1.9986 -1.1612 -1.1612 -1.1513 -1.1513 -1.1433 -1.1433 6.0071 6.0071 7.1771 7.1771 7.3382 7.3382 7.3541 7.3541 7.6086 7.6086 7.7804 7.7804 7.9222 7.9222 7.9438 7.9438 8.2496 8.2496 8.4511 8.4511 8.7405 8.7405 9.9913 9.9913 10.7314 10.7314 11.1439 11.1439 12.9454 12.9454 15.0401 15.0401 15.1975 15.1975 15.4815 15.4815 15.8397 15.8397 k = 0.5000-0.1381 0.5147 ( 2938 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5516 -9.5516 -9.5408 -9.5408 -2.0019 -2.0019 -1.9986 -1.9986 -1.1609 -1.1609 -1.1511 -1.1511 -1.1434 -1.1434 6.0125 6.0125 7.1728 7.1728 7.3422 7.3422 7.3620 7.3620 7.6010 7.6010 7.7743 7.7743 7.9259 7.9259 7.9522 7.9522 8.2448 8.2448 8.4350 8.4350 8.7803 8.7803 10.0014 10.0014 10.6681 10.6681 11.0524 11.0524 13.0642 13.0642 15.0466 15.0466 15.1523 15.1523 15.4859 15.4859 15.9201 15.9201 k = 0.5000-0.1255 0.5236 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5514 -9.5514 -9.5411 -9.5411 -2.0016 -2.0016 -1.9987 -1.9987 -1.1606 -1.1606 -1.1509 -1.1509 -1.1435 -1.1435 6.0180 6.0180 7.1685 7.1685 7.3445 7.3445 7.3695 7.3695 7.5972 7.5972 7.7686 7.7686 7.9298 7.9298 7.9606 7.9606 8.2400 8.2400 8.4142 8.4142 8.8241 8.8241 10.0126 10.0126 10.6085 10.6085 10.9618 10.9618 13.1828 13.1828 15.0465 15.0465 15.1086 15.1086 15.4904 15.4904 15.9882 15.9882 k = 0.5000-0.1130 0.5325 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5512 -9.5512 -9.5415 -9.5415 -2.0013 -2.0013 -1.9987 -1.9987 -1.1603 -1.1603 -1.1506 -1.1506 -1.1437 -1.1437 6.0233 6.0233 7.1644 7.1644 7.3458 7.3458 7.3756 7.3756 7.5975 7.5975 7.7633 7.7633 7.9341 7.9341 7.9688 7.9688 8.2353 8.2353 8.3905 8.3905 8.8702 8.8702 10.0249 10.0249 10.5526 10.5526 10.8731 10.8731 13.3012 13.3012 15.0187 15.0187 15.0876 15.0876 15.4948 15.4948 16.0424 16.0424 k = 0.5000-0.1004 0.5414 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5509 -9.5509 -9.5418 -9.5418 -2.0011 -2.0011 -1.9987 -1.9987 -1.1600 -1.1600 -1.1504 -1.1504 -1.1438 -1.1438 6.0285 6.0285 7.1605 7.1605 7.3462 7.3462 7.3797 7.3797 7.6021 7.6021 7.7584 7.7584 7.9386 7.9386 7.9767 7.9767 8.2306 8.2306 8.3648 8.3648 8.9173 8.9173 10.0383 10.0383 10.5004 10.5004 10.7875 10.7875 13.4189 13.4189 14.9636 14.9636 15.0888 15.0888 15.4990 15.4990 16.0833 16.0833 k = 0.5000-0.0879 0.5502 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5507 -9.5507 -9.5421 -9.5421 -2.0008 -2.0008 -1.9987 -1.9987 -1.1598 -1.1598 -1.1501 -1.1501 -1.1439 -1.1439 6.0333 6.0333 7.1570 7.1570 7.3459 7.3459 7.3818 7.3818 7.6103 7.6103 7.7539 7.7539 7.9434 7.9434 7.9845 7.9845 8.2261 8.2261 8.3380 8.3380 8.9644 8.9644 10.0529 10.0529 10.4517 10.4517 10.7062 10.7062 13.5356 13.5356 14.8983 14.8983 15.0948 15.0948 15.5030 15.5030 16.1125 16.1125 k = 0.5000-0.0753 0.5591 ( 2950 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5505 -9.5505 -9.5425 -9.5425 -2.0006 -2.0006 -1.9987 -1.9987 -1.1596 -1.1596 -1.1498 -1.1498 -1.1441 -1.1441 6.0377 6.0377 7.1539 7.1539 7.3451 7.3451 7.3825 7.3825 7.6214 7.6214 7.7496 7.7496 7.9482 7.9482 7.9921 7.9921 8.2218 8.2218 8.3110 8.3110 9.0103 9.0103 10.0687 10.0687 10.4065 10.4065 10.6303 10.6303 13.6510 13.6510 14.8269 14.8269 15.1015 15.1015 15.5066 15.5066 16.1325 16.1325 k = 0.5000-0.0628 0.5680 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5502 -9.5502 -9.5428 -9.5428 -2.0004 -2.0004 -1.9987 -1.9987 -1.1594 -1.1594 -1.1495 -1.1495 -1.1443 -1.1443 6.0416 6.0416 7.1512 7.1512 7.3438 7.3438 7.3824 7.3824 7.6342 7.6342 7.7454 7.7454 7.9529 7.9529 7.9998 7.9998 8.2177 8.2177 8.2848 8.2848 9.0535 9.0535 10.0857 10.0857 10.3649 10.3649 10.5613 10.5613 13.7649 13.7649 14.7504 14.7504 15.1079 15.1079 15.5099 15.5099 16.1456 16.1456 k = 0.5000-0.0502 0.5769 ( 2950 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5500 -9.5500 -9.5430 -9.5430 -2.0002 -2.0002 -1.9987 -1.9987 -1.1593 -1.1593 -1.1493 -1.1493 -1.1444 -1.1444 6.0449 6.0449 7.1490 7.1490 7.3423 7.3423 7.3818 7.3818 7.6476 7.6476 7.7413 7.7413 7.9573 7.9573 8.0075 8.0075 8.2135 8.2135 8.2606 8.2606 9.0926 9.0926 10.1039 10.1039 10.3268 10.3268 10.5007 10.5007 13.8768 13.8768 14.6691 14.6691 15.1135 15.1135 15.5126 15.5126 16.1538 16.1538 k = 0.5000-0.0377 0.5857 ( 2958 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5498 -9.5498 -9.5433 -9.5433 -2.0001 -2.0001 -1.9988 -1.9988 -1.1592 -1.1592 -1.1491 -1.1491 -1.1446 -1.1446 6.0476 6.0476 7.1472 7.1472 7.3408 7.3408 7.3810 7.3810 7.6603 7.6603 7.7372 7.7372 7.9610 7.9610 8.0149 8.0149 8.2085 8.2085 8.2404 8.2404 9.1258 9.1258 10.1230 10.1230 10.2927 10.2927 10.4502 10.4502 13.9864 13.9864 14.5833 14.5833 15.1181 15.1181 15.5148 15.5148 16.1587 16.1587 k = 0.5000-0.0251 0.5946 ( 2958 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5434 -9.5434 -1.9999 -1.9999 -1.9989 -1.9989 -1.1591 -1.1591 -1.1489 -1.1489 -1.1447 -1.1447 6.0495 6.0495 7.1459 7.1459 7.3395 7.3395 7.3804 7.3804 7.6712 7.6712 7.7332 7.7332 7.9639 7.9639 8.0217 8.0217 8.2015 8.2015 8.2272 8.2272 9.1514 9.1514 10.1424 10.1424 10.2630 10.2630 10.4118 10.4118 14.0933 14.0933 14.4936 14.4936 15.1216 15.1216 15.5164 15.5164 16.1614 16.1614 k = 0.5000-0.0126 0.6035 ( 2948 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9998 -1.9998 -1.9988 -1.9988 -1.1590 -1.1590 -1.1487 -1.1487 -1.1448 -1.1448 6.0507 6.0507 7.1452 7.1452 7.3386 7.3386 7.3801 7.3801 7.6789 7.6789 7.7301 7.7301 7.9657 7.9657 8.0267 8.0267 8.1942 8.1942 8.2212 8.2212 9.1676 9.1676 10.1601 10.1601 10.2396 10.2396 10.3876 10.3876 14.1966 14.1966 14.4006 14.4006 15.1237 15.1237 15.5174 15.5174 16.1627 16.1627 k = 0.5000-0.0000 0.6124 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9997 -1.9997 -1.9988 -1.9988 -1.1589 -1.1589 -1.1487 -1.1487 -1.1447 -1.1447 6.0511 6.0511 7.1450 7.1450 7.3384 7.3384 7.3800 7.3800 7.6818 7.6818 7.7289 7.7289 7.9664 7.9664 8.0286 8.0286 8.1912 8.1912 8.2197 8.2197 9.1732 9.1732 10.1688 10.1688 10.2290 10.2290 10.3793 10.3793 14.2782 14.2782 14.3225 14.3225 15.1244 15.1244 15.5177 15.5177 16.1631 16.1631 k = 0.5000-0.0000 0.6124 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9997 -1.9997 -1.9988 -1.9988 -1.1589 -1.1589 -1.1487 -1.1487 -1.1447 -1.1447 6.0511 6.0511 7.1450 7.1450 7.3384 7.3384 7.3800 7.3800 7.6818 7.6818 7.7289 7.7289 7.9664 7.9664 8.0286 8.0286 8.1912 8.1912 8.2197 8.2197 9.1732 9.1732 10.1688 10.1688 10.2290 10.2290 10.3793 10.3793 14.2782 14.2782 14.3225 14.3225 15.1244 15.1244 15.5177 15.5177 16.1631 16.1631 k = 0.4926 0.0127 0.6124 ( 2951 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9998 -1.9998 -1.9988 -1.9988 -1.1590 -1.1590 -1.1487 -1.1487 -1.1448 -1.1448 6.0509 6.0509 7.1453 7.1453 7.3386 7.3386 7.3801 7.3801 7.6802 7.6802 7.7297 7.7297 7.9659 7.9659 8.0276 8.0276 8.1923 8.1923 8.2203 8.2203 9.1694 9.1694 10.1555 10.1555 10.2142 10.2142 10.4148 10.4148 14.2271 14.2271 14.3708 14.3708 15.1265 15.1265 15.5179 15.5179 16.1631 16.1631 k = 0.4853 0.0255 0.6124 ( 2957 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5435 -9.5435 -1.9999 -1.9999 -1.9989 -1.9989 -1.1590 -1.1590 -1.1488 -1.1488 -1.1448 -1.1448 6.0502 6.0502 7.1465 7.1465 7.3394 7.3394 7.3804 7.3804 7.6758 7.6758 7.7318 7.7318 7.9646 7.9646 8.0249 8.0249 8.1953 8.1953 8.2225 8.2225 9.1594 9.1594 10.1241 10.1241 10.1844 10.1844 10.4968 10.4968 14.1545 14.1545 14.4351 14.4351 15.1330 15.1330 15.5181 15.5181 16.1629 16.1629 k = 0.4779 0.0382 0.6124 ( 2957 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5434 -9.5434 -1.9999 -1.9999 -1.9988 -1.9988 -1.1590 -1.1590 -1.1489 -1.1489 -1.1447 -1.1447 6.0490 6.0490 7.1486 7.1486 7.3408 7.3408 7.3811 7.3811 7.6694 7.6694 7.7348 7.7348 7.9624 7.9624 8.0210 8.0210 8.1990 8.1990 8.2272 8.2272 9.1451 9.1451 10.0793 10.0793 10.1607 10.1607 10.5977 10.5977 14.0763 14.0763 14.4996 14.4996 15.1441 15.1441 15.5180 15.5180 16.1618 16.1618 k = 0.4706 0.0509 0.6124 ( 2953 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5498 -9.5498 -9.5432 -9.5432 -1.9999 -1.9999 -1.9988 -1.9988 -1.1590 -1.1590 -1.1490 -1.1490 -1.1446 -1.1446 6.0476 6.0476 7.1516 7.1516 7.3427 7.3427 7.3822 7.3822 7.6614 7.6614 7.7382 7.7382 7.9591 7.9591 8.0164 8.0164 8.2018 8.2018 8.2349 8.2349 9.1278 9.1278 10.0291 10.0291 10.1427 10.1427 10.7082 10.7082 13.9935 13.9935 14.5633 14.5633 15.1598 15.1598 15.5175 15.5175 16.1592 16.1592 k = 0.4632 0.0637 0.6124 ( 2955 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5500 -9.5500 -9.5430 -9.5430 -2.0000 -2.0000 -1.9988 -1.9988 -1.1590 -1.1590 -1.1492 -1.1492 -1.1444 -1.1444 6.0458 6.0458 7.1554 7.1554 7.3448 7.3448 7.3837 7.3837 7.6523 7.6523 7.7418 7.7418 7.9548 7.9548 8.0115 8.0115 8.2033 8.2033 8.2455 8.2455 9.1089 9.1089 9.9785 9.9785 10.1277 10.1277 10.8249 10.8249 13.9065 13.9065 14.6258 14.6258 15.1801 15.1801 15.5160 15.5160 16.1545 16.1545 k = 0.4559 0.0764 0.6124 ( 2955 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5501 -9.5501 -9.5429 -9.5429 -2.0000 -2.0000 -1.9988 -1.9988 -1.1590 -1.1590 -1.1494 -1.1494 -1.1443 -1.1443 6.0438 6.0438 7.1600 7.1600 7.3470 7.3470 7.3857 7.3857 7.6425 7.6425 7.7455 7.7455 7.9496 7.9496 8.0065 8.0065 8.2038 8.2038 8.2581 8.2581 9.0891 9.0891 9.9296 9.9296 10.1146 10.1146 10.9456 10.9456 13.8157 13.8157 14.6869 14.6869 15.2050 15.2050 15.5135 15.5135 16.1470 16.1470 k = 0.4485 0.0891 0.6124 ( 2953 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5502 -9.5502 -9.5427 -9.5427 -2.0000 -2.0000 -1.9987 -1.9987 -1.1590 -1.1590 -1.1495 -1.1495 -1.1442 -1.1442 6.0417 6.0417 7.1654 7.1654 7.3489 7.3489 7.3883 7.3883 7.6322 7.6322 7.7495 7.7495 7.9436 7.9436 8.0015 8.0015 8.2037 8.2037 8.2718 8.2718 9.0693 9.0693 9.8835 9.8835 10.1030 10.1030 11.0689 11.0689 13.7215 13.7215 14.7464 14.7464 15.2344 15.2344 15.5096 15.5096 16.1358 16.1358 k = 0.4412 0.1019 0.6124 ( 2941 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5503 -9.5503 -9.5425 -9.5425 -2.0000 -2.0000 -1.9987 -1.9987 -1.1589 -1.1589 -1.1497 -1.1497 -1.1440 -1.1440 6.0395 6.0395 7.1714 7.1714 7.3506 7.3506 7.3915 7.3915 7.6219 7.6219 7.7538 7.7538 7.9369 7.9369 7.9968 7.9968 8.2032 8.2032 8.2861 8.2861 9.0502 9.0502 9.8406 9.8406 10.0927 10.0927 11.1937 11.1937 13.6244 13.6244 14.8040 14.8040 15.2680 15.2680 15.5042 15.5042 16.1204 16.1204 k = 0.4338 0.1146 0.6124 ( 2943 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5505 -9.5505 -9.5423 -9.5423 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1499 -1.1499 -1.1438 -1.1438 6.0373 6.0373 7.1779 7.1779 7.3516 7.3516 7.3950 7.3950 7.6117 7.6117 7.7583 7.7583 7.9295 7.9295 7.9921 7.9921 8.2025 8.2025 8.3001 8.3001 9.0320 9.0320 9.8012 9.8012 10.0835 10.0835 11.3190 11.3190 13.5250 13.5250 14.8593 14.8593 15.3056 15.3056 15.4971 15.4971 16.0999 16.0999 k = 0.4265 0.1274 0.6124 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5506 -9.5506 -9.5421 -9.5421 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1501 -1.1501 -1.1437 -1.1437 6.0352 6.0352 7.1846 7.1846 7.3521 7.3521 7.3988 7.3988 7.6021 7.6021 7.7633 7.7633 7.9215 7.9215 7.9878 7.9878 8.2016 8.2016 8.3136 8.3136 9.0153 9.0153 9.7657 9.7657 10.0755 10.0755 11.4435 11.4435 13.4240 13.4240 14.9119 14.9119 15.3468 15.3468 15.4887 15.4887 16.0738 16.0738 k = 0.4191 0.1401 0.6124 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5507 -9.5507 -9.5420 -9.5420 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1502 -1.1502 -1.1436 -1.1436 6.0332 6.0332 7.1915 7.1915 7.3521 7.3521 7.4025 7.4025 7.5934 7.5934 7.7687 7.7687 7.9131 7.9131 7.9839 7.9839 8.2007 8.2007 8.3262 8.3262 9.0004 9.0004 9.7343 9.7343 10.0686 10.0686 11.5659 11.5659 13.3224 13.3224 14.9615 14.9615 15.3906 15.3906 15.4796 15.4796 16.0418 16.0418 k = 0.4118 0.1528 0.6124 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5508 -9.5508 -9.5418 -9.5418 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1504 -1.1504 -1.1435 -1.1435 6.0314 6.0314 7.1982 7.1982 7.3517 7.3517 7.4059 7.4059 7.5857 7.5857 7.7745 7.7745 7.9044 7.9044 7.9804 7.9804 8.1998 8.1998 8.3375 8.3375 8.9874 8.9874 9.7073 9.7073 10.0628 10.0628 11.6844 11.6844 13.2219 13.2219 15.0074 15.0074 15.4316 15.4316 15.4749 15.4749 16.0038 16.0038 k = 0.4044 0.1656 0.6124 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5509 -9.5509 -9.5417 -9.5417 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1505 -1.1505 -1.1434 -1.1434 6.0299 6.0299 7.2044 7.2044 7.3510 7.3510 7.4087 7.4087 7.5793 7.5793 7.7804 7.7804 7.8957 7.8957 7.9775 7.9775 8.1989 8.1989 8.3472 8.3472 8.9766 8.9766 9.6848 9.6848 10.0581 10.0581 11.7966 11.7966 13.1247 13.1247 15.0486 15.0486 15.4422 15.4422 15.5023 15.5023 15.9604 15.9604 k = 0.3971 0.1783 0.6124 ( 2939 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5416 -9.5416 -2.0001 -2.0001 -1.9987 -1.9987 -1.1588 -1.1588 -1.1506 -1.1506 -1.1434 -1.1434 6.0286 6.0286 7.2098 7.2098 7.3501 7.3501 7.4108 7.4108 7.5744 7.5744 7.7864 7.7864 7.8875 7.8875 7.9752 7.9752 8.1983 8.1983 8.3550 8.3550 8.9682 8.9682 9.6671 9.6671 10.0544 10.0544 11.8983 11.8983 13.0349 13.0349 15.0839 15.0839 15.4327 15.4327 15.5516 15.5516 15.9128 15.9128 k = 0.3897 0.1910 0.6124 ( 2935 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1433 -1.1433 6.0277 6.0277 7.2140 7.2140 7.3493 7.3493 7.4123 7.4123 7.5709 7.5709 7.7916 7.7916 7.8805 7.8805 7.9735 7.9735 8.1978 8.1978 8.3608 8.3608 8.9621 8.9621 9.6543 9.6543 10.0518 10.0518 11.9831 11.9831 12.9586 12.9586 15.1118 15.1118 15.4220 15.4220 15.6037 15.6037 15.8630 15.8630 k = 0.3824 0.2038 0.6124 ( 2940 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9987 -1.9987 -1.1588 -1.1588 -1.1507 -1.1507 -1.1433 -1.1433 6.0271 6.0271 7.2167 7.2167 7.3486 7.3486 7.4132 7.4132 7.5688 7.5688 7.7954 7.7954 7.8755 7.8755 7.9725 7.9725 8.1975 8.1975 8.3642 8.3642 8.9584 8.9584 9.6466 9.6466 10.0503 10.0503 12.0415 12.0415 12.9053 12.9053 15.1299 15.1299 15.4139 15.4139 15.6517 15.6517 15.8163 15.8163 k = 0.3750 0.2165 0.6124 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.3750 0.2165 0.6124 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.3673 0.2121 0.5999 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5509 -9.5509 -9.5416 -9.5416 -1.9998 -1.9998 -1.9987 -1.9987 -1.1585 -1.1585 -1.1506 -1.1506 -1.1433 -1.1433 6.0291 6.0291 7.2207 7.2207 7.3560 7.3560 7.4196 7.4196 7.5694 7.5694 7.7888 7.7888 7.8785 7.8785 7.9767 7.9767 8.1881 8.1881 8.3439 8.3439 8.9829 8.9829 9.5433 9.5433 10.0632 10.0632 12.0924 12.0924 12.9646 12.9646 15.0981 15.0981 15.4174 15.4174 15.7582 15.7582 15.7929 15.7929 k = 0.3597 0.2077 0.5874 ( 2938 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5508 -9.5508 -9.5417 -9.5417 -1.9994 -1.9994 -1.9987 -1.9987 -1.1580 -1.1580 -1.1505 -1.1505 -1.1432 -1.1432 6.0303 6.0303 7.2241 7.2241 7.3630 7.3630 7.4247 7.4247 7.5736 7.5736 7.7811 7.7811 7.8836 7.8836 7.9807 7.9807 8.1788 8.1788 8.3228 8.3228 8.9886 8.9886 9.4669 9.4669 10.0775 10.0775 12.1236 12.1236 13.0469 13.0469 15.0575 15.0575 15.4263 15.4263 15.7871 15.7871 15.8434 15.8434 k = 0.3520 0.2033 0.5749 ( 2932 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5507 -9.5507 -9.5417 -9.5417 -1.9990 -1.9990 -1.9987 -1.9987 -1.1577 -1.1577 -1.1504 -1.1504 -1.1432 -1.1432 6.0303 6.0303 7.2279 7.2279 7.3692 7.3692 7.4285 7.4285 7.5807 7.5807 7.7740 7.7740 7.8888 7.8888 7.9841 7.9841 8.1689 8.1689 8.3028 8.3028 8.9631 8.9631 9.4262 9.4262 10.0927 10.0927 12.1565 12.1565 13.1329 13.1329 15.0145 15.0145 15.4377 15.4377 15.7760 15.7760 15.9317 15.9317 k = 0.3444 0.1988 0.5624 ( 2936 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5506 -9.5506 -9.5417 -9.5417 -1.9989 -1.9989 -1.9986 -1.9986 -1.1574 -1.1574 -1.1503 -1.1503 -1.1432 -1.1432 6.0289 6.0289 7.2316 7.2316 7.3743 7.3743 7.4310 7.4310 7.5904 7.5904 7.7677 7.7677 7.8938 7.8938 7.9868 7.9868 8.1582 8.1582 8.2844 8.2844 8.9053 8.9053 9.4231 9.4231 10.1089 10.1089 12.1909 12.1909 13.2227 13.2227 14.9692 14.9692 15.4517 15.4517 15.7605 15.7605 16.0227 16.0227 k = 0.3367 0.1944 0.5499 ( 2950 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5505 -9.5505 -9.5417 -9.5417 -1.9990 -1.9990 -1.9984 -1.9984 -1.1572 -1.1572 -1.1503 -1.1503 -1.1432 -1.1432 6.0260 6.0260 7.2352 7.2352 7.3780 7.3780 7.4323 7.4323 7.6019 7.6019 7.7624 7.7624 7.8988 7.8988 7.9890 7.9890 8.1464 8.1464 8.2682 8.2682 8.8259 8.8259 9.4474 9.4474 10.1260 10.1260 12.2269 12.2269 13.3165 13.3165 14.9216 14.9216 15.4683 15.4683 15.7417 15.7417 16.1163 16.1163 k = 0.3291 0.1900 0.5374 ( 2950 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5504 -9.5504 -9.5416 -9.5416 -1.9991 -1.9991 -1.9981 -1.9981 -1.1570 -1.1570 -1.1502 -1.1502 -1.1431 -1.1431 6.0213 6.0213 7.2385 7.2385 7.3804 7.3804 7.4329 7.4329 7.6146 7.6146 7.7585 7.7585 7.9036 7.9036 7.9910 7.9910 8.1332 8.1332 8.2550 8.2550 8.7370 8.7370 9.4878 9.4878 10.1442 10.1442 12.2644 12.2644 13.4144 13.4144 14.8718 14.8718 15.4875 15.4875 15.7203 15.7203 16.2121 16.2121 k = 0.3214 0.1856 0.5249 ( 2950 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5504 -9.5504 -9.5414 -9.5414 -1.9991 -1.9991 -1.9978 -1.9978 -1.1568 -1.1568 -1.1502 -1.1502 -1.1431 -1.1431 6.0147 6.0147 7.2413 7.2413 7.3811 7.3811 7.4329 7.4329 7.6273 7.6273 7.7564 7.7564 7.9081 7.9081 7.9929 7.9929 8.1185 8.1185 8.2450 8.2450 8.6463 8.6463 9.5377 9.5377 10.1634 10.1634 12.3035 12.3035 13.5165 13.5165 14.8199 14.8199 15.5088 15.5088 15.6975 15.6975 16.3100 16.3100 k = 0.3138 0.1812 0.5124 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9699 -10.9699 -9.5503 -9.5503 -9.5413 -9.5413 -1.9992 -1.9992 -1.9976 -1.9976 -1.1567 -1.1567 -1.1502 -1.1502 -1.1430 -1.1430 6.0059 6.0059 7.2431 7.2431 7.3802 7.3802 7.4323 7.4323 7.6386 7.6386 7.7566 7.7566 7.9120 7.9120 7.9951 7.9951 8.1025 8.1025 8.2381 8.2381 8.5583 8.5583 9.5936 9.5936 10.1838 10.1838 12.3442 12.3442 13.6228 13.6228 14.7660 14.7660 15.5315 15.5315 15.6744 15.6744 16.4095 16.4095 k = 0.3061 0.1767 0.4999 ( 2942 PWs) bands (ev): -29.9311 -29.9311 -10.9698 -10.9698 -9.5502 -9.5502 -9.5410 -9.5410 -1.9993 -1.9993 -1.9973 -1.9973 -1.1566 -1.1566 -1.1501 -1.1501 -1.1429 -1.1429 5.9947 5.9947 7.2437 7.2437 7.3775 7.3775 7.4314 7.4314 7.6470 7.6470 7.7597 7.7597 7.9152 7.9152 7.9979 7.9979 8.0860 8.0860 8.2339 8.2339 8.4762 8.4762 9.6535 9.6535 10.2054 10.2054 12.3864 12.3864 13.7333 13.7333 14.7102 14.7102 15.5528 15.5528 15.6544 15.6544 16.5102 16.5102 k = 0.2985 0.1723 0.4874 ( 2950 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5501 -9.5501 -9.5408 -9.5408 -1.9994 -1.9994 -1.9972 -1.9972 -1.1566 -1.1566 -1.1502 -1.1502 -1.1429 -1.1429 5.9807 5.9807 7.2428 7.2428 7.3731 7.3731 7.4301 7.4301 7.6515 7.6515 7.7653 7.7653 7.9171 7.9171 8.0013 8.0013 8.0702 8.0702 8.2315 8.2315 8.4024 8.4024 9.7167 9.7167 10.2284 10.2284 12.4301 12.4301 13.8481 13.8481 14.6526 14.6526 15.5639 15.5639 15.6460 15.6460 16.6016 16.6016 k = 0.2908 0.1679 0.4749 ( 2950 PWs) bands (ev): -29.9311 -29.9311 -10.9696 -10.9696 -9.5500 -9.5500 -9.5405 -9.5405 -1.9996 -1.9996 -1.9970 -1.9970 -1.1566 -1.1566 -1.1502 -1.1502 -1.1429 -1.1429 5.9639 5.9639 7.2400 7.2400 7.3671 7.3671 7.4285 7.4285 7.6517 7.6517 7.7723 7.7723 7.9170 7.9170 8.0059 8.0059 8.0571 8.0571 8.2297 8.2297 8.3394 8.3394 9.7826 9.7826 10.2530 10.2530 12.4754 12.4754 13.9672 13.9672 14.5934 14.5934 15.5547 15.5547 15.6597 15.6597 16.5429 16.5429 k = 0.2832 0.1635 0.4624 ( 2946 PWs) bands (ev): -29.9311 -29.9311 -10.9694 -10.9694 -9.5499 -9.5499 -9.5402 -9.5402 -1.9997 -1.9997 -1.9969 -1.9969 -1.1565 -1.1565 -1.1503 -1.1503 -1.1429 -1.1429 5.9439 5.9439 7.2351 7.2351 7.3597 7.3597 7.4265 7.4265 7.6480 7.6480 7.7785 7.7785 7.9143 7.9143 8.0121 8.0121 8.0487 8.0487 8.2250 8.2250 8.2914 8.2914 9.8509 9.8509 10.2791 10.2791 12.5223 12.5223 14.0904 14.0904 14.5326 14.5326 15.5320 15.5320 15.6884 15.6884 16.4615 16.4615 k = 0.2755 0.1591 0.4499 ( 2946 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5497 -9.5497 -9.5399 -9.5399 -1.9998 -1.9998 -1.9968 -1.9968 -1.1566 -1.1566 -1.1504 -1.1504 -1.1429 -1.1429 5.9205 5.9205 7.2279 7.2279 7.3508 7.3508 7.4238 7.4238 7.6411 7.6411 7.7809 7.7809 7.9100 7.9100 8.0209 8.0209 8.0457 8.0457 8.2092 8.2092 8.2666 8.2666 9.9215 9.9215 10.3071 10.3071 12.5707 12.5707 14.2176 14.2176 14.4706 14.4706 15.5042 15.5042 15.7236 15.7236 16.3769 16.3769 k = 0.2679 0.1546 0.4374 ( 2950 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5495 -9.5495 -9.5396 -9.5396 -2.0000 -2.0000 -1.9968 -1.9968 -1.1567 -1.1567 -1.1505 -1.1505 -1.1430 -1.1430 5.8936 5.8936 7.2185 7.2185 7.3409 7.3409 7.4203 7.4203 7.6316 7.6316 7.7770 7.7770 7.9070 7.9070 8.0327 8.0327 8.0472 8.0472 8.1849 8.1849 8.2619 8.2619 9.9944 9.9944 10.3371 10.3371 12.6206 12.6206 14.3474 14.3474 14.4087 14.4087 15.4740 15.4740 15.7622 15.7622 16.2906 16.2906 k = 0.2602 0.1502 0.4249 ( 2946 PWs) bands (ev): -29.9312 -29.9312 -10.9689 -10.9689 -9.5493 -9.5493 -9.5392 -9.5392 -2.0002 -2.0002 -1.9968 -1.9968 -1.1568 -1.1568 -1.1506 -1.1506 -1.1431 -1.1431 5.8629 5.8629 7.2070 7.2070 7.3301 7.3301 7.4159 7.4159 7.6203 7.6203 7.7661 7.7661 7.9081 7.9081 8.0432 8.0432 8.0554 8.0554 8.1641 8.1641 8.2648 8.2648 10.0694 10.0694 10.3693 10.3693 12.6721 12.6721 14.3409 14.3409 14.4860 14.4860 15.4422 15.4422 15.8028 15.8028 16.2038 16.2038 k = 0.2526 0.1458 0.4124 ( 2952 PWs) bands (ev): -29.9313 -29.9313 -10.9687 -10.9687 -9.5491 -9.5491 -9.5389 -9.5389 -2.0004 -2.0004 -1.9968 -1.9968 -1.1570 -1.1570 -1.1507 -1.1507 -1.1433 -1.1433 5.8285 5.8285 7.1936 7.1936 7.3186 7.3186 7.4105 7.4105 7.6076 7.6076 7.7502 7.7502 7.9134 7.9134 8.0472 8.0472 8.0725 8.0725 8.1510 8.1510 8.2706 8.2706 10.1466 10.1466 10.4039 10.4039 12.7252 12.7252 14.2758 14.2758 14.6247 14.6247 15.4091 15.4091 15.8443 15.8443 16.1177 16.1177 k = 0.2449 0.1414 0.3999 ( 2952 PWs) bands (ev): -29.9313 -29.9313 -10.9684 -10.9684 -9.5487 -9.5487 -9.5385 -9.5385 -2.0006 -2.0006 -1.9969 -1.9969 -1.1572 -1.1572 -1.1509 -1.1509 -1.1435 -1.1435 5.7903 5.7903 7.1789 7.1789 7.3067 7.3067 7.4042 7.4042 7.5943 7.5943 7.7321 7.7321 7.9216 7.9216 8.0476 8.0476 8.0926 8.0926 8.1470 8.1470 8.2781 8.2781 10.2260 10.2260 10.4412 10.4412 12.7799 12.7799 14.2094 14.2094 14.7671 14.7671 15.3747 15.3747 15.8861 15.8861 16.0334 16.0334 k = 0.2372 0.1370 0.3874 ( 2936 PWs) bands (ev): -29.9313 -29.9313 -10.9682 -10.9682 -9.5484 -9.5484 -9.5381 -9.5381 -2.0007 -2.0007 -1.9969 -1.9969 -1.1573 -1.1573 -1.1510 -1.1510 -1.1436 -1.1436 5.7485 5.7485 7.1635 7.1635 7.2946 7.2946 7.3971 7.3971 7.5807 7.5807 7.7134 7.7134 7.9316 7.9316 8.0459 8.0459 8.1130 8.1130 8.1518 8.1518 8.2871 8.2871 10.3074 10.3074 10.4814 10.4814 12.8361 12.8361 14.1423 14.1423 14.9121 14.9121 15.3394 15.3394 15.9271 15.9271 15.9520 15.9520 k = 0.2296 0.1326 0.3749 ( 2936 PWs) bands (ev): -29.9314 -29.9314 -10.9679 -10.9679 -9.5480 -9.5480 -9.5378 -9.5378 -2.0009 -2.0009 -1.9970 -1.9970 -1.1575 -1.1575 -1.1512 -1.1512 -1.1439 -1.1439 5.7033 5.7033 7.1480 7.1480 7.2824 7.2824 7.3893 7.3893 7.5669 7.5669 7.6953 7.6953 7.9423 7.9423 8.0431 8.0431 8.1317 8.1317 8.1641 8.1641 8.2974 8.2974 10.3908 10.3908 10.5250 10.5250 12.8940 12.8940 14.0747 14.0747 15.0563 15.0563 15.3058 15.3058 15.8747 15.8747 15.9666 15.9666 k = 0.2219 0.1281 0.3624 ( 2932 PWs) bands (ev): -29.9314 -29.9314 -10.9677 -10.9677 -9.5475 -9.5475 -9.5374 -9.5374 -2.0011 -2.0011 -1.9972 -1.9972 -1.1577 -1.1577 -1.1514 -1.1514 -1.1442 -1.1442 5.6550 5.6550 7.1331 7.1331 7.2704 7.2704 7.3811 7.3811 7.5530 7.5530 7.6779 7.6779 7.9533 7.9533 8.0403 8.0403 8.1489 8.1489 8.1815 8.1815 8.3093 8.3093 10.4757 10.4757 10.5725 10.5725 12.9534 12.9534 14.0067 14.0067 15.1738 15.1738 15.2991 15.2991 15.8028 15.8028 16.0031 16.0031 k = 0.2143 0.1237 0.3499 ( 2938 PWs) bands (ev): -29.9314 -29.9314 -10.9674 -10.9674 -9.5471 -9.5471 -9.5371 -9.5371 -2.0013 -2.0013 -1.9974 -1.9974 -1.1579 -1.1579 -1.1517 -1.1517 -1.1446 -1.1446 5.6040 5.6040 7.1193 7.1193 7.2585 7.2585 7.3727 7.3727 7.5389 7.5389 7.6614 7.6614 7.9642 7.9642 8.0384 8.0384 8.1658 8.1658 8.2005 8.2005 8.3229 8.3229 10.5604 10.5604 10.6258 10.6258 13.0144 13.0144 13.9385 13.9385 15.1786 15.1786 15.4044 15.4044 15.7374 15.7374 16.0358 16.0358 k = 0.2066 0.1193 0.3374 ( 2938 PWs) bands (ev): -29.9315 -29.9315 -10.9671 -10.9671 -9.5465 -9.5465 -9.5368 -9.5368 -2.0016 -2.0016 -1.9977 -1.9977 -1.1581 -1.1581 -1.1520 -1.1520 -1.1450 -1.1450 5.5508 5.5508 7.1070 7.1070 7.2469 7.2469 7.3642 7.3642 7.5247 7.5247 7.6457 7.6457 7.9747 7.9747 8.0377 8.0377 8.1834 8.1834 8.2190 8.2190 8.3384 8.3384 10.6401 10.6401 10.6898 10.6898 13.0770 13.0770 13.8704 13.8704 15.1361 15.1361 15.5544 15.5544 15.6810 15.6810 16.0634 16.0634 k = 0.1990 0.1149 0.3249 ( 2946 PWs) bands (ev): -29.9315 -29.9315 -10.9668 -10.9668 -9.5460 -9.5460 -9.5364 -9.5364 -2.0018 -2.0018 -1.9980 -1.9980 -1.1584 -1.1584 -1.1523 -1.1523 -1.1455 -1.1455 5.4957 5.4957 7.0964 7.0964 7.2357 7.2357 7.3556 7.3556 7.5103 7.5103 7.6308 7.6308 7.9844 7.9844 8.0382 8.0382 8.2017 8.2017 8.2359 8.2359 8.3558 8.3558 10.7095 10.7095 10.7700 10.7700 13.1412 13.1412 13.8024 13.8024 15.0838 15.0838 15.6189 15.6189 15.7263 15.7263 16.0850 16.0850 k = 0.1913 0.1105 0.3124 ( 2938 PWs) bands (ev): -29.9316 -29.9316 -10.9665 -10.9665 -9.5454 -9.5454 -9.5361 -9.5361 -2.0020 -2.0020 -1.9983 -1.9983 -1.1586 -1.1586 -1.1525 -1.1525 -1.1460 -1.1460 5.4393 5.4393 7.0878 7.0878 7.2251 7.2251 7.3471 7.3471 7.4957 7.4957 7.6165 7.6165 7.9934 7.9934 8.0401 8.0401 8.2209 8.2209 8.2510 8.2510 8.3749 8.3749 10.7740 10.7740 10.8609 10.8609 13.2070 13.2070 13.7348 13.7348 15.0268 15.0268 15.5772 15.5772 15.8889 15.8889 16.0999 16.0999 k = 0.1837 0.1060 0.2999 ( 2936 PWs) bands (ev): -29.9316 -29.9316 -10.9662 -10.9662 -9.5448 -9.5448 -9.5358 -9.5358 -2.0023 -2.0023 -1.9986 -1.9986 -1.1588 -1.1588 -1.1528 -1.1528 -1.1465 -1.1465 5.3821 5.3821 7.0810 7.0810 7.2150 7.2150 7.3388 7.3388 7.4810 7.4810 7.6029 7.6029 8.0015 8.0015 8.0431 8.0431 8.2404 8.2404 8.2647 8.2647 8.3950 8.3950 10.8394 10.8394 10.9567 10.9567 13.2744 13.2744 13.6678 13.6678 14.9670 14.9670 15.5389 15.5389 16.0550 16.0550 16.1102 16.1102 k = 0.1760 0.1016 0.2874 ( 2940 PWs) bands (ev): -29.9317 -29.9317 -10.9658 -10.9658 -9.5441 -9.5441 -9.5355 -9.5355 -2.0025 -2.0025 -1.9990 -1.9990 -1.1590 -1.1590 -1.1531 -1.1531 -1.1471 -1.1471 5.3245 5.3245 7.0761 7.0761 7.2056 7.2056 7.3306 7.3306 7.4661 7.4661 7.5897 7.5897 8.0087 8.0087 8.0470 8.0470 8.2588 8.2588 8.2784 8.2784 8.4156 8.4156 10.9075 10.9075 11.0555 11.0555 13.3434 13.3434 13.6015 13.6015 14.9059 14.9059 15.5058 15.5058 16.1039 16.1039 16.2337 16.2337 k = 0.1684 0.0972 0.2749 ( 2938 PWs) bands (ev): -29.9317 -29.9317 -10.9655 -10.9655 -9.5434 -9.5434 -9.5352 -9.5352 -2.0027 -2.0027 -1.9993 -1.9993 -1.1592 -1.1592 -1.1534 -1.1534 -1.1477 -1.1477 5.2670 5.2670 7.0729 7.0729 7.1968 7.1968 7.3226 7.3226 7.4513 7.4513 7.5771 7.5771 8.0152 8.0152 8.0514 8.0514 8.2740 8.2740 8.2948 8.2948 8.4363 8.4363 10.9789 10.9789 11.1564 11.1564 13.4137 13.4137 13.5365 13.5365 14.8448 14.8448 15.4774 15.4774 16.0975 16.0975 16.4079 16.4079 k = 0.1607 0.0928 0.2624 ( 2920 PWs) bands (ev): -29.9317 -29.9317 -10.9652 -10.9652 -9.5427 -9.5427 -9.5349 -9.5349 -2.0029 -2.0029 -1.9997 -1.9997 -1.1593 -1.1593 -1.1536 -1.1536 -1.1482 -1.1482 5.2099 5.2099 7.0712 7.0712 7.1888 7.1888 7.3149 7.3149 7.4365 7.4365 7.5650 7.5650 8.0213 8.0213 8.0563 8.0563 8.2850 8.2850 8.3149 8.3149 8.4566 8.4566 11.0538 11.0538 11.2589 11.2589 13.4659 13.4659 13.4924 13.4924 14.7850 14.7850 15.4529 15.4529 16.0842 16.0842 16.5850 16.5850 k = 0.1531 0.0884 0.2499 ( 2924 PWs) bands (ev): -29.9318 -29.9318 -10.9648 -10.9648 -9.5420 -9.5420 -9.5346 -9.5346 -2.0031 -2.0031 -2.0001 -2.0001 -1.1596 -1.1596 -1.1540 -1.1540 -1.1489 -1.1489 5.1537 5.1537 7.0709 7.0709 7.1815 7.1815 7.3073 7.3073 7.4217 7.4217 7.5534 7.5534 8.0267 8.0267 8.0609 8.0609 8.2935 8.2935 8.3368 8.3368 8.4762 8.4762 11.1321 11.1321 11.3627 11.3627 13.4074 13.4074 13.5618 13.5618 14.7275 14.7275 15.4318 15.4318 16.0654 16.0654 16.7637 16.7637 k = 0.1454 0.0840 0.2375 ( 2924 PWs) bands (ev): -29.9318 -29.9318 -10.9645 -10.9645 -9.5413 -9.5413 -9.5344 -9.5344 -2.0034 -2.0034 -2.0005 -2.0005 -1.1598 -1.1598 -1.1544 -1.1544 -1.1496 -1.1496 5.0986 5.0986 7.0718 7.0718 7.1750 7.1750 7.2998 7.2998 7.4072 7.4072 7.5425 7.5425 8.0318 8.0318 8.0653 8.0653 8.3006 8.3006 8.3596 8.3596 8.4949 8.4949 11.2138 11.2138 11.4672 11.4672 13.3461 13.3461 13.6371 13.6371 14.6735 14.6735 15.4136 15.4136 16.0423 16.0423 16.9431 16.9431 k = 0.1378 0.0795 0.2250 ( 2924 PWs) bands (ev): -29.9319 -29.9319 -10.9642 -10.9642 -9.5406 -9.5406 -9.5341 -9.5341 -2.0036 -2.0036 -2.0009 -2.0009 -1.1600 -1.1600 -1.1547 -1.1547 -1.1503 -1.1503 5.0451 5.0451 7.0737 7.0737 7.1693 7.1693 7.2925 7.2925 7.3928 7.3928 7.5321 7.5321 8.0367 8.0367 8.0693 8.0693 8.3068 8.3068 8.3827 8.3827 8.5126 8.5126 11.2987 11.2987 11.5721 11.5721 13.2863 13.2863 13.7144 13.7144 14.6239 14.6239 15.3978 15.3978 16.0159 16.0159 17.1218 17.1218 k = 0.1301 0.0751 0.2125 ( 2912 PWs) bands (ev): -29.9319 -29.9319 -10.9638 -10.9638 -9.5398 -9.5398 -9.5339 -9.5339 -2.0038 -2.0038 -2.0013 -2.0013 -1.1601 -1.1601 -1.1549 -1.1549 -1.1509 -1.1509 4.9932 4.9932 7.0765 7.0765 7.1645 7.1645 7.2855 7.2855 7.3788 7.3788 7.5225 7.5225 8.0413 8.0413 8.0728 8.0728 8.3123 8.3123 8.4060 8.4060 8.5294 8.5294 11.3866 11.3866 11.6766 11.6766 13.2282 13.2282 13.7933 13.7933 14.5797 14.5797 15.3842 15.3842 15.9872 15.9872 17.2950 17.2950 k = 0.1224 0.0707 0.2000 ( 2912 PWs) bands (ev): -29.9320 -29.9320 -10.9635 -10.9635 -9.5391 -9.5391 -9.5337 -9.5337 -2.0040 -2.0040 -2.0017 -2.0017 -1.1603 -1.1603 -1.1553 -1.1553 -1.1516 -1.1516 4.9433 4.9433 7.0799 7.0799 7.1604 7.1604 7.2785 7.2785 7.3649 7.3649 7.5135 7.5135 8.0458 8.0458 8.0758 8.0758 8.3171 8.3171 8.4291 8.4291 8.5448 8.5448 11.4772 11.4772 11.7802 11.7802 13.1722 13.1722 13.8738 13.8738 14.5419 14.5419 15.3723 15.3723 15.9570 15.9570 17.3614 17.3614 k = 0.1148 0.0663 0.1875 ( 2918 PWs) bands (ev): -29.9320 -29.9320 -10.9632 -10.9632 -9.5384 -9.5384 -9.5335 -9.5335 -2.0042 -2.0042 -2.0022 -2.0022 -1.1605 -1.1605 -1.1556 -1.1556 -1.1523 -1.1523 4.8957 4.8957 7.0838 7.0838 7.1571 7.1571 7.2717 7.2717 7.3514 7.3514 7.5053 7.5053 8.0499 8.0499 8.0783 8.0783 8.3215 8.3215 8.4518 8.4518 8.5590 8.5590 11.5701 11.5701 11.8820 11.8820 13.1185 13.1185 13.9559 13.9559 14.5115 14.5115 15.3620 15.3620 15.9259 15.9259 17.2358 17.2358 k = 0.1071 0.0619 0.1750 ( 2910 PWs) bands (ev): -29.9320 -29.9320 -10.9629 -10.9629 -9.5377 -9.5377 -9.5333 -9.5333 -2.0044 -2.0044 -2.0026 -2.0026 -1.1606 -1.1606 -1.1559 -1.1559 -1.1529 -1.1529 4.8503 4.8503 7.0882 7.0882 7.1546 7.1546 7.2651 7.2651 7.3382 7.3382 7.4980 7.4980 8.0539 8.0539 8.0803 8.0803 8.3254 8.3254 8.4741 8.4741 8.5722 8.5722 11.6649 11.6649 11.9811 11.9811 13.0672 13.0672 14.0395 14.0395 14.4896 14.4896 15.3531 15.3531 15.8946 15.8946 17.1080 17.1080 k = 0.0995 0.0574 0.1625 ( 2900 PWs) bands (ev): -29.9321 -29.9321 -10.9626 -10.9626 -9.5370 -9.5370 -9.5331 -9.5331 -2.0045 -2.0045 -2.0029 -2.0029 -1.1607 -1.1607 -1.1561 -1.1561 -1.1535 -1.1535 4.8075 4.8075 7.0931 7.0931 7.1528 7.1528 7.2587 7.2587 7.3253 7.3253 7.4916 7.4916 8.0576 8.0576 8.0817 8.0817 8.3288 8.3288 8.4959 8.4959 8.5842 8.5842 11.7611 11.7611 12.0767 12.0767 13.0186 13.0186 14.1245 14.1245 14.4775 14.4775 15.3454 15.3454 15.8633 15.8633 16.9793 16.9793 k = 0.0918 0.0530 0.1500 ( 2900 PWs) bands (ev): -29.9321 -29.9321 -10.9623 -10.9623 -9.5363 -9.5363 -9.5330 -9.5330 -2.0047 -2.0047 -2.0033 -2.0033 -1.1609 -1.1609 -1.1564 -1.1564 -1.1542 -1.1542 4.7674 4.7674 7.0981 7.0981 7.1517 7.1517 7.2523 7.2523 7.3127 7.3127 7.4860 7.4860 8.0611 8.0611 8.0828 8.0828 8.3319 8.3319 8.5167 8.5167 8.5950 8.5950 11.8579 11.8579 12.1676 12.1676 12.9730 12.9730 14.2105 14.2105 14.4765 14.4765 15.3388 15.3388 15.8324 15.8324 16.8505 16.8505 k = 0.0842 0.0486 0.1375 ( 2900 PWs) bands (ev): -29.9321 -29.9321 -10.9621 -10.9621 -9.5357 -9.5357 -9.5328 -9.5328 -2.0049 -2.0049 -2.0037 -2.0037 -1.1610 -1.1610 -1.1567 -1.1567 -1.1548 -1.1548 4.7301 4.7301 7.1033 7.1033 7.1512 7.1512 7.2460 7.2460 7.3004 7.3004 7.4813 7.4813 8.0643 8.0643 8.0834 8.0834 8.3346 8.3346 8.5366 8.5366 8.6049 8.6049 11.9546 11.9546 12.2529 12.2529 12.9304 12.9304 14.2969 14.2969 14.4882 14.4882 15.3331 15.3331 15.8019 15.8019 16.7219 16.7219 k = 0.0765 0.0442 0.1250 ( 2904 PWs) bands (ev): -29.9322 -29.9322 -10.9618 -10.9618 -9.5351 -9.5351 -9.5327 -9.5327 -2.0051 -2.0051 -2.0041 -2.0041 -1.1612 -1.1612 -1.1570 -1.1570 -1.1554 -1.1554 4.6957 4.6957 7.1088 7.1088 7.1513 7.1513 7.2399 7.2399 7.2884 7.2884 7.4774 7.4774 8.0672 8.0672 8.0837 8.0837 8.3370 8.3370 8.5552 8.5552 8.6136 8.6136 12.0503 12.0503 12.3315 12.3315 12.8914 12.8914 14.3824 14.3824 14.5149 14.5149 15.3282 15.3282 15.7719 15.7719 16.5944 16.5944 k = 0.0689 0.0398 0.1125 ( 2908 PWs) bands (ev): -29.9322 -29.9322 -10.9616 -10.9616 -9.5346 -9.5346 -9.5326 -9.5326 -2.0053 -2.0053 -2.0044 -2.0044 -1.1613 -1.1613 -1.1573 -1.1573 -1.1559 -1.1559 4.6643 4.6643 7.1144 7.1144 7.1519 7.1519 7.2339 7.2339 7.2767 7.2767 7.4742 7.4742 8.0699 8.0699 8.0837 8.0837 8.3391 8.3391 8.5726 8.5726 8.6214 8.6214 12.1436 12.1436 12.4027 12.4027 12.8560 12.8560 14.4642 14.4642 14.5601 14.5601 15.3241 15.3241 15.7421 15.7421 16.4692 16.4692 k = 0.0612 0.0353 0.1000 ( 2902 PWs) bands (ev): -29.9322 -29.9322 -10.9614 -10.9614 -9.5341 -9.5341 -9.5324 -9.5324 -2.0054 -2.0054 -2.0047 -2.0047 -1.1614 -1.1614 -1.1575 -1.1575 -1.1563 -1.1563 4.6360 4.6360 7.1203 7.1203 7.1530 7.1530 7.2281 7.2281 7.2653 7.2653 7.4718 7.4718 8.0723 8.0723 8.0835 8.0835 8.3409 8.3409 8.5887 8.5887 8.6283 8.6283 12.2331 12.2331 12.4661 12.4661 12.8247 12.8247 14.5398 14.5398 14.6266 14.6266 15.3207 15.3207 15.7121 15.7121 16.3480 16.3480 k = 0.0536 0.0309 0.0875 ( 2910 PWs) bands (ev): -29.9322 -29.9322 -10.9612 -10.9612 -9.5336 -9.5336 -9.5324 -9.5324 -2.0055 -2.0055 -2.0050 -2.0050 -1.1616 -1.1616 -1.1577 -1.1577 -1.1568 -1.1568 4.6109 4.6109 7.1263 7.1263 7.1544 7.1544 7.2225 7.2225 7.2543 7.2543 7.4700 7.4700 8.0743 8.0743 8.0832 8.0832 8.3424 8.3424 8.6032 8.6032 8.6342 8.6342 12.3169 12.3169 12.5216 12.5216 12.7978 12.7978 14.6138 14.6138 14.7096 14.7096 15.3178 15.3178 15.6812 15.6812 16.2326 16.2326 k = 0.0459 0.0265 0.0750 ( 2908 PWs) bands (ev): -29.9323 -29.9323 -10.9611 -10.9611 -9.5332 -9.5332 -9.5323 -9.5323 -2.0056 -2.0056 -2.0053 -2.0053 -1.1616 -1.1616 -1.1578 -1.1578 -1.1572 -1.1572 4.5890 4.5890 7.1326 7.1326 7.1562 7.1562 7.2172 7.2172 7.2436 7.2436 7.4687 7.4687 8.0761 8.0761 8.0828 8.0828 8.3437 8.3437 8.6161 8.6161 8.6393 8.6393 12.3922 12.3922 12.5698 12.5698 12.7758 12.7758 14.6933 14.6933 14.8017 14.8017 15.3155 15.3155 15.6483 15.6483 16.1242 16.1242 k = 0.0383 0.0221 0.0625 ( 2916 PWs) bands (ev): -29.9323 -29.9323 -10.9609 -10.9609 -9.5329 -9.5329 -9.5322 -9.5322 -2.0058 -2.0058 -2.0055 -2.0055 -1.1617 -1.1617 -1.1580 -1.1580 -1.1576 -1.1576 4.5704 4.5704 7.1390 7.1390 7.1581 7.1581 7.2122 7.2122 7.2333 7.2333 7.4679 7.4679 8.0776 8.0776 8.0822 8.0822 8.3447 8.3447 8.6272 8.6272 8.6436 8.6436 12.4560 12.4560 12.6123 12.6123 12.7591 12.7591 14.7811 14.7811 14.8984 14.8984 15.3138 15.3138 15.6122 15.6122 16.0224 16.0224 k = 0.0306 0.0177 0.0500 ( 2916 PWs) bands (ev): -29.9323 -29.9323 -10.9608 -10.9608 -9.5326 -9.5326 -9.5322 -9.5322 -2.0058 -2.0058 -2.0057 -2.0057 -1.1618 -1.1618 -1.1581 -1.1581 -1.1579 -1.1579 4.5551 4.5551 7.1456 7.1456 7.1602 7.1602 7.2077 7.2077 7.2235 7.2235 7.4673 7.4673 8.0788 8.0788 8.0818 8.0818 8.3456 8.3456 8.6364 8.6364 8.6470 8.6470 12.5050 12.5050 12.6506 12.6506 12.7479 12.7479 14.8772 14.8772 14.9979 14.9979 15.3125 15.3125 15.5714 15.5714 15.9264 15.9264 k = 0.0230 0.0133 0.0375 ( 2912 PWs) bands (ev): -29.9323 -29.9323 -10.9607 -10.9607 -9.5324 -9.5324 -9.5321 -9.5321 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1581 -1.1581 4.5432 4.5432 7.1522 7.1522 7.1622 7.1622 7.2038 7.2038 7.2145 7.2145 7.4670 7.4670 8.0798 8.0798 8.0814 8.0814 8.3463 8.3463 8.6436 8.6436 8.6497 8.6497 12.5379 12.5379 12.6850 12.6850 12.7416 12.7416 14.9795 14.9795 15.0983 15.0983 15.3120 15.3120 15.5241 15.5241 15.8386 15.8386 k = 0.0153 0.0088 0.0250 ( 2896 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5322 -9.5322 -9.5321 -9.5321 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1581 -1.1581 4.5347 4.5347 7.1587 7.1587 7.1641 7.1641 7.2006 7.2006 7.2065 7.2065 7.4668 7.4668 8.0805 8.0805 8.0813 8.0813 8.3468 8.3468 8.6489 8.6489 8.6516 8.6516 12.5570 12.5570 12.7133 12.7133 12.7391 12.7391 15.0847 15.0847 15.1951 15.1951 15.3127 15.3127 15.4681 15.4681 15.7662 15.7662 k = 0.0077 0.0044 0.0125 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5321 -9.5321 -9.5320 -9.5320 -2.0058 -2.0058 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5296 4.5296 7.1637 7.1637 7.1654 7.1654 7.1986 7.1986 7.2003 7.2003 7.4667 7.4667 8.0810 8.0810 8.0812 8.0812 8.3472 8.3472 8.6520 8.6520 8.6527 8.6527 12.5664 12.5664 12.7320 12.7320 12.7385 12.7385 15.1873 15.1873 15.2697 15.2697 15.3158 15.3158 15.4078 15.4078 15.7187 15.7187 k = 0.0000 0.0000 0.0000 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5320 -9.5320 -9.5320 -9.5320 -2.0059 -2.0059 -2.0059 -2.0059 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5279 4.5279 7.1659 7.1659 7.1659 7.1659 7.1978 7.1978 7.1978 7.1978 7.4667 7.4667 8.0811 8.0811 8.0811 8.0811 8.3472 8.3472 8.6531 8.6531 8.6531 8.6531 12.5691 12.5691 12.7385 12.7385 12.7385 12.7385 15.2669 15.2669 15.2901 15.2901 15.2901 15.2901 15.3861 15.3861 15.7023 15.7023 k = 0.0000 0.0000 0.0000 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5320 -9.5320 -9.5320 -9.5320 -2.0059 -2.0059 -2.0059 -2.0059 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5279 4.5279 7.1659 7.1659 7.1659 7.1659 7.1978 7.1978 7.1978 7.1978 7.4667 7.4667 8.0811 8.0811 8.0811 8.0811 8.3472 8.3472 8.6531 8.6531 8.6531 8.6531 12.5691 12.5691 12.7385 12.7385 12.7385 12.7385 15.2669 15.2669 15.2901 15.2901 15.2901 15.2901 15.3861 15.3861 15.7023 15.7023 k = 0.0125 0.0072 0.0051 ( 2891 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5321 -9.5321 -9.5320 -9.5320 -2.0058 -2.0058 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1582 -1.1582 4.5296 4.5296 7.1640 7.1640 7.1651 7.1651 7.1987 7.1987 7.2002 7.2002 7.4667 7.4667 8.0809 8.0809 8.0812 8.0812 8.3472 8.3472 8.6523 8.6523 8.6524 8.6524 12.5663 12.5663 12.7316 12.7316 12.7390 12.7390 15.1914 15.1914 15.2715 15.2715 15.3030 15.3030 15.4145 15.4145 15.7236 15.7236 k = 0.0250 0.0144 0.0102 ( 2897 PWs) bands (ev): -29.9323 -29.9323 -10.9606 -10.9606 -9.5322 -9.5322 -9.5321 -9.5321 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1581 -1.1581 4.5347 4.5347 7.1596 7.1596 7.1631 7.1631 7.2011 7.2011 7.2062 7.2062 7.4668 7.4668 8.0805 8.0805 8.0813 8.0813 8.3468 8.3468 8.6500 8.6500 8.6505 8.6505 12.5563 12.5563 12.7127 12.7127 12.7404 12.7404 15.1016 15.1016 15.2245 15.2245 15.2348 15.2348 15.5021 15.5021 15.7788 15.7788 k = 0.0375 0.0217 0.0153 ( 2906 PWs) bands (ev): -29.9323 -29.9323 -10.9607 -10.9607 -9.5324 -9.5324 -9.5321 -9.5321 -2.0059 -2.0059 -2.0058 -2.0058 -1.1618 -1.1618 -1.1582 -1.1582 -1.1580 -1.1580 4.5432 4.5432 7.1542 7.1542 7.1601 7.1601 7.2044 7.2044 7.2141 7.2141 7.4670 7.4670 8.0797 8.0797 8.0816 8.0816 8.3463 8.3463 8.6461 8.6461 8.6472 8.6472 12.5334 12.5334 12.6884 12.6884 12.7428 12.7428 15.0142 15.0142 15.1496 15.1496 15.1628 15.1628 15.6003 15.6003 15.8541 15.8541 k = 0.0500 0.0289 0.0204 ( 2918 PWs) bands (ev): -29.9323 -29.9323 -10.9608 -10.9608 -9.5326 -9.5326 -9.5321 -9.5321 -2.0058 -2.0058 -2.0057 -2.0057 -1.1618 -1.1618 -1.1581 -1.1581 -1.1579 -1.1579 4.5552 4.5552 7.1487 7.1487 7.1569 7.1569 7.2083 7.2083 7.2232 7.2232 7.4673 7.4673 8.0785 8.0785 8.0821 8.0821 8.3456 8.3456 8.6407 8.6407 8.6427 8.6427 12.4898 12.4898 12.6680 12.6680 12.7459 12.7459 14.9312 14.9312 15.0641 15.0641 15.0953 15.0953 15.7014 15.7014 15.9408 15.9408 k = 0.0625 0.0361 0.0255 ( 2918 PWs) bands (ev): -29.9323 -29.9323 -10.9609 -10.9609 -9.5329 -9.5329 -9.5322 -9.5322 -2.0057 -2.0057 -2.0056 -2.0056 -1.1617 -1.1617 -1.1580 -1.1580 -1.1577 -1.1577 4.5704 4.5704 7.1435 7.1435 7.1536 7.1536 7.2125 7.2125 7.2330 7.2330 7.4679 7.4679 8.0772 8.0772 8.0826 8.0826 8.3447 8.3447 8.6338 8.6338 8.6369 8.6369 12.4225 12.4225 12.6561 12.6561 12.7497 12.7497 14.8538 14.8538 14.9824 14.9824 15.0264 15.0264 15.8042 15.8042 16.0344 16.0344 k = 0.0750 0.0433 0.0306 ( 2918 PWs) bands (ev): -29.9323 -29.9323 -10.9611 -10.9611 -9.5332 -9.5332 -9.5323 -9.5323 -2.0055 -2.0055 -2.0055 -2.0055 -1.1617 -1.1617 -1.1578 -1.1578 -1.1573 -1.1573 4.5891 4.5891 7.1388 7.1388 7.1505 7.1505 7.2169 7.2169 7.2434 7.2434 7.4688 7.4688 8.0755 8.0755 8.0831 8.0831 8.3436 8.3436 8.6254 8.6254 8.6299 8.6299 12.3354 12.3354 12.6508 12.6508 12.7540 12.7540 14.7822 14.7822 14.9053 14.9053 14.9586 14.9586 15.9081 15.9081 16.1209 16.1209 k = 0.0875 0.0505 0.0357 ( 2912 PWs) bands (ev): -29.9322 -29.9322 -10.9612 -10.9612 -9.5336 -9.5336 -9.5323 -9.5323 -2.0053 -2.0053 -2.0052 -2.0052 -1.1615 -1.1615 -1.1576 -1.1576 -1.1569 -1.1569 4.6109 4.6109 7.1346 7.1346 7.1477 7.1477 7.2213 7.2213 7.2543 7.2543 7.4701 7.4701 8.0735 8.0735 8.0836 8.0836 8.3423 8.3423 8.6155 8.6155 8.6218 8.6218 12.2330 12.2330 12.6493 12.6493 12.7585 12.7585 14.7166 14.7166 14.8332 14.8332 14.8932 14.8932 16.0129 16.0129 16.1993 16.1993 k = 0.1000 0.0577 0.0408 ( 2924 PWs) bands (ev): -29.9322 -29.9322 -10.9614 -10.9614 -9.5341 -9.5341 -9.5324 -9.5324 -2.0052 -2.0052 -2.0051 -2.0051 -1.1615 -1.1615 -1.1574 -1.1574 -1.1566 -1.1566 4.6361 4.6361 7.1310 7.1310 7.1450 7.1450 7.2256 7.2256 7.2655 7.2655 7.4718 7.4718 8.0713 8.0713 8.0840 8.0840 8.3407 8.3407 8.6042 8.6042 8.6123 8.6123 12.1192 12.1192 12.6497 12.6497 12.7632 12.7632 14.6568 14.6568 14.7663 14.7663 14.8311 14.8311 16.1187 16.1187 16.2875 16.2875 k = 0.1125 0.0650 0.0459 ( 2915 PWs) bands (ev): -29.9322 -29.9322 -10.9616 -10.9616 -9.5346 -9.5346 -9.5325 -9.5325 -2.0049 -2.0049 -2.0049 -2.0049 -1.1613 -1.1613 -1.1571 -1.1571 -1.1561 -1.1561 4.6644 4.6644 7.1281 7.1281 7.1429 7.1429 7.2300 7.2300 7.2771 7.2771 7.4740 7.4740 8.0689 8.0689 8.0842 8.0842 8.3388 8.3388 8.5916 8.5916 8.6019 8.6019 11.9965 11.9965 12.6509 12.6509 12.7676 12.7676 14.6025 14.6025 14.7047 14.7047 14.7730 14.7730 16.2256 16.2256 16.3849 16.3849 k = 0.1250 0.0722 0.0510 ( 2912 PWs) bands (ev): -29.9322 -29.9322 -10.9618 -10.9618 -9.5352 -9.5352 -9.5326 -9.5326 -2.0046 -2.0046 -2.0046 -2.0046 -1.1612 -1.1612 -1.1569 -1.1569 -1.1555 -1.1555 4.6957 4.6957 7.1259 7.1259 7.1411 7.1411 7.2343 7.2343 7.2890 7.2890 7.4769 7.4769 8.0662 8.0662 8.0842 8.0842 8.3366 8.3366 8.5777 8.5777 8.5905 8.5905 11.8671 11.8671 12.6523 12.6523 12.7716 12.7716 14.5533 14.5533 14.6485 14.6485 14.7195 14.7195 16.3340 16.3340 16.4904 16.4904 k = 0.1375 0.0794 0.0561 ( 2912 PWs) bands (ev): -29.9321 -29.9321 -10.9621 -10.9621 -9.5358 -9.5358 -9.5327 -9.5327 -2.0044 -2.0044 -2.0043 -2.0043 -1.1610 -1.1610 -1.1566 -1.1566 -1.1549 -1.1549 4.7301 4.7301 7.1243 7.1243 7.1399 7.1399 7.2387 7.2387 7.3010 7.3010 7.4803 7.4803 8.0631 8.0631 8.0840 8.0840 8.3340 8.3340 8.5625 8.5625 8.5780 8.5780 11.7327 11.7327 12.6532 12.6532 12.7747 12.7747 14.5088 14.5088 14.5980 14.5980 14.6712 14.6712 16.4443 16.4443 16.6032 16.6032 k = 0.1500 0.0866 0.0612 ( 2917 PWs) bands (ev): -29.9321 -29.9321 -10.9624 -10.9624 -9.5365 -9.5365 -9.5328 -9.5328 -2.0041 -2.0041 -2.0040 -2.0040 -1.1609 -1.1609 -1.1563 -1.1563 -1.1544 -1.1544 4.7675 4.7675 7.1235 7.1235 7.1392 7.1392 7.2431 7.2431 7.3133 7.3133 7.4844 7.4844 8.0598 8.0598 8.0834 8.0834 8.3309 8.3309 8.5460 8.5460 8.5646 8.5646 11.5947 11.5947 12.6534 12.6534 12.7766 12.7766 14.4685 14.4685 14.5534 14.5534 14.6284 14.6284 16.5565 16.5565 16.7227 16.7227 k = 0.1625 0.0938 0.0663 ( 2917 PWs) bands (ev): -29.9321 -29.9321 -10.9626 -10.9626 -9.5372 -9.5372 -9.5329 -9.5329 -2.0038 -2.0038 -2.0037 -2.0037 -1.1607 -1.1607 -1.1560 -1.1560 -1.1537 -1.1537 4.8076 4.8076 7.1233 7.1233 7.1391 7.1391 7.2478 7.2478 7.3257 7.3257 7.4890 7.4890 8.0563 8.0563 8.0826 8.0826 8.3275 8.3275 8.5284 8.5284 8.5503 8.5503 11.4543 11.4543 12.6524 12.6524 12.7771 12.7771 14.4318 14.4318 14.5152 14.5152 14.5916 14.5916 16.6708 16.6708 16.8481 16.8481 k = 0.1750 0.1010 0.0714 ( 2917 PWs) bands (ev): -29.9320 -29.9320 -10.9629 -10.9629 -9.5379 -9.5379 -9.5331 -9.5331 -2.0035 -2.0035 -2.0034 -2.0034 -1.1605 -1.1605 -1.1557 -1.1557 -1.1531 -1.1531 4.8505 4.8505 7.1238 7.1238 7.1396 7.1396 7.2529 7.2529 7.3382 7.3382 7.4941 7.4941 8.0525 8.0525 8.0814 8.0814 8.3236 8.3236 8.5097 8.5097 8.5352 8.5352 11.3123 11.3123 12.6500 12.6500 12.7758 12.7758 14.3982 14.3982 14.4839 14.4839 14.5612 14.5612 16.7867 16.7867 16.9791 16.9791 k = 0.1875 0.1083 0.0765 ( 2923 PWs) bands (ev): -29.9320 -29.9320 -10.9632 -10.9632 -9.5387 -9.5387 -9.5332 -9.5332 -2.0032 -2.0032 -2.0030 -2.0030 -1.1604 -1.1604 -1.1554 -1.1554 -1.1524 -1.1524 4.8959 4.8959 7.1250 7.1250 7.1408 7.1408 7.2582 7.2582 7.3508 7.3508 7.4997 7.4997 8.0486 8.0486 8.0800 8.0800 8.3193 8.3193 8.4899 8.4899 8.5193 8.5193 11.1697 11.1697 12.6459 12.6459 12.7726 12.7726 14.3673 14.3673 14.4598 14.4598 14.5374 14.5374 16.9040 16.9040 17.1144 17.1144 k = 0.2000 0.1155 0.0816 ( 2929 PWs) bands (ev): -29.9320 -29.9320 -10.9635 -10.9635 -9.5395 -9.5395 -9.5334 -9.5334 -2.0029 -2.0029 -2.0027 -2.0027 -1.1602 -1.1602 -1.1550 -1.1550 -1.1518 -1.1518 4.9437 4.9437 7.1268 7.1268 7.1428 7.1428 7.2642 7.2642 7.3635 7.3635 7.5057 7.5057 8.0444 8.0444 8.0782 8.0782 8.3144 8.3144 8.4691 8.4691 8.5027 8.5027 11.0270 11.0270 12.6399 12.6399 12.7671 12.7671 14.3387 14.3387 14.4432 14.4432 14.5205 14.5205 17.0223 17.0223 17.2335 17.2335 k = 0.2125 0.1227 0.0868 ( 2917 PWs) bands (ev): -29.9319 -29.9319 -10.9638 -10.9638 -9.5403 -9.5403 -9.5335 -9.5335 -2.0025 -2.0025 -2.0023 -2.0023 -1.1599 -1.1599 -1.1546 -1.1546 -1.1510 -1.1510 4.9938 4.9938 7.1294 7.1294 7.1457 7.1457 7.2707 7.2707 7.3763 7.3763 7.5121 7.5121 8.0400 8.0400 8.0761 8.0761 8.3090 8.3090 8.4475 8.4475 8.4857 8.4857 10.8849 10.8849 12.6321 12.6321 12.7594 12.7594 14.3123 14.3123 14.4341 14.4341 14.5106 14.5106 17.1411 17.1411 17.1746 17.1746 k = 0.2250 0.1299 0.0919 ( 2917 PWs) bands (ev): -29.9319 -29.9319 -10.9642 -10.9642 -9.5411 -9.5411 -9.5336 -9.5336 -2.0021 -2.0021 -2.0019 -2.0019 -1.1597 -1.1597 -1.1542 -1.1542 -1.1502 -1.1502 5.0461 5.0461 7.1325 7.1325 7.1495 7.1495 7.2778 7.2778 7.3890 7.3890 7.5186 7.5186 8.0354 8.0354 8.0737 8.0737 8.3030 8.3030 8.4250 8.4250 8.4681 8.4681 10.7438 10.7438 12.6222 12.6222 12.7494 12.7494 14.2880 14.2880 14.4322 14.4322 14.5078 14.5078 17.0298 17.0298 17.2601 17.2601 k = 0.2375 0.1371 0.0970 ( 2923 PWs) bands (ev): -29.9318 -29.9318 -10.9645 -10.9645 -9.5419 -9.5419 -9.5338 -9.5338 -2.0018 -2.0018 -2.0016 -2.0016 -1.1595 -1.1595 -1.1539 -1.1539 -1.1495 -1.1495 5.1002 5.1002 7.1362 7.1362 7.1543 7.1543 7.2857 7.2857 7.4017 7.4017 7.5254 7.5254 8.0306 8.0306 8.0710 8.0710 8.2964 8.2964 8.4018 8.4018 8.4501 8.4501 10.6041 10.6041 12.6105 12.6105 12.7372 12.7372 14.2660 14.2660 14.4374 14.4374 14.5119 14.5119 16.8787 16.8787 17.3788 17.3788 k = 0.2500 0.1443 0.1021 ( 2926 PWs) bands (ev): -29.9318 -29.9318 -10.9648 -10.9648 -9.5427 -9.5427 -9.5339 -9.5339 -2.0014 -2.0014 -2.0012 -2.0012 -1.1593 -1.1593 -1.1535 -1.1535 -1.1488 -1.1488 5.1560 5.1560 7.1405 7.1405 7.1600 7.1600 7.2942 7.2942 7.4144 7.4144 7.5323 7.5323 8.0257 8.0257 8.0682 8.0682 8.2894 8.2894 8.3778 8.3778 8.4317 8.4317 10.4663 10.4663 12.5971 12.5971 12.7228 12.7228 14.2462 14.2462 14.4492 14.4492 14.5228 14.5228 16.7273 16.7273 17.4969 17.4969 k = 0.2625 0.1516 0.1072 ( 2923 PWs) bands (ev): -29.9318 -29.9318 -10.9652 -10.9652 -9.5436 -9.5436 -9.5341 -9.5341 -2.0011 -2.0011 -2.0008 -2.0008 -1.1591 -1.1591 -1.1531 -1.1531 -1.1480 -1.1480 5.2132 5.2132 7.1452 7.1452 7.1670 7.1670 7.3036 7.3036 7.4271 7.4271 7.5393 7.5393 8.0206 8.0206 8.0651 8.0651 8.2818 8.2818 8.3532 8.3532 8.4131 8.4131 10.3306 10.3306 12.5821 12.5821 12.7065 12.7065 14.2286 14.2286 14.4675 14.4675 14.5402 14.5402 16.5776 16.5776 17.6137 17.6137 k = 0.2750 0.1588 0.1123 ( 2926 PWs) bands (ev): -29.9317 -29.9317 -10.9655 -10.9655 -9.5444 -9.5444 -9.5342 -9.5342 -2.0007 -2.0007 -2.0004 -2.0004 -1.1589 -1.1589 -1.1527 -1.1527 -1.1473 -1.1473 5.2717 5.2717 7.1504 7.1504 7.1751 7.1751 7.3138 7.3138 7.4397 7.4397 7.5462 7.5462 8.0155 8.0155 8.0619 8.0619 8.2737 8.2737 8.3281 8.3281 8.3944 8.3944 10.1972 10.1972 12.5658 12.5658 12.6887 12.6887 14.2131 14.2131 14.4918 14.4918 14.5639 14.5639 16.4309 16.4309 17.7278 17.7278 k = 0.2875 0.1660 0.1174 ( 2926 PWs) bands (ev): -29.9317 -29.9317 -10.9658 -10.9658 -9.5452 -9.5452 -9.5344 -9.5344 -2.0004 -2.0004 -2.0000 -2.0000 -1.1586 -1.1586 -1.1523 -1.1523 -1.1465 -1.1465 5.3310 5.3310 7.1560 7.1560 7.1844 7.1844 7.3248 7.3248 7.4521 7.4521 7.5532 7.5532 8.0102 8.0102 8.0585 8.0585 8.2651 8.2651 8.3024 8.3024 8.3756 8.3756 10.0666 10.0666 12.5484 12.5484 12.6696 12.6696 14.1999 14.1999 14.5218 14.5218 14.5934 14.5934 16.2880 16.2880 17.8250 17.8250 k = 0.3000 0.1732 0.1225 ( 2926 PWs) bands (ev): -29.9316 -29.9316 -10.9661 -10.9661 -9.5460 -9.5460 -9.5345 -9.5345 -2.0000 -2.0000 -1.9997 -1.9997 -1.1584 -1.1584 -1.1519 -1.1519 -1.1458 -1.1458 5.3908 5.3908 7.1619 7.1619 7.1949 7.1949 7.3366 7.3366 7.4645 7.4645 7.5602 7.5602 8.0048 8.0048 8.0551 8.0551 8.2561 8.2561 8.2765 8.2765 8.3568 8.3568 9.9389 9.9389 12.5303 12.5303 12.6495 12.6495 14.1887 14.1887 14.5570 14.5570 14.6282 14.6282 16.1496 16.1496 17.7743 17.7743 k = 0.3125 0.1804 0.1276 ( 2929 PWs) bands (ev): -29.9316 -29.9316 -10.9665 -10.9665 -9.5468 -9.5468 -9.5346 -9.5346 -1.9997 -1.9997 -1.9993 -1.9993 -1.1582 -1.1582 -1.1516 -1.1516 -1.1451 -1.1451 5.4509 5.4509 7.1680 7.1680 7.2066 7.2066 7.3493 7.3493 7.4767 7.4767 7.5671 7.5671 7.9993 7.9993 8.0515 8.0515 8.2465 8.2465 8.2505 8.2505 8.3382 8.3382 9.8144 9.8144 12.5117 12.5117 12.6289 12.6289 14.1797 14.1797 14.5971 14.5971 14.6679 14.6679 16.0162 16.0162 17.6676 17.6676 k = 0.3250 0.1876 0.1327 ( 2929 PWs) bands (ev): -29.9316 -29.9316 -10.9668 -10.9668 -9.5475 -9.5475 -9.5348 -9.5348 -1.9994 -1.9994 -1.9989 -1.9989 -1.1580 -1.1580 -1.1512 -1.1512 -1.1444 -1.1444 5.5108 5.5108 7.1743 7.1743 7.2194 7.2194 7.3630 7.3630 7.4888 7.4888 7.5740 7.5740 7.9938 7.9938 8.0478 8.0478 8.2238 8.2238 8.2372 8.2372 8.3199 8.3199 9.6933 9.6933 12.4930 12.4930 12.6080 12.6080 14.1728 14.1728 14.6415 14.6415 14.7120 14.7120 15.8882 15.8882 17.5582 17.5582 k = 0.3375 0.1949 0.1378 ( 2929 PWs) bands (ev): -29.9315 -29.9315 -10.9670 -10.9670 -9.5482 -9.5482 -9.5349 -9.5349 -1.9991 -1.9991 -1.9986 -1.9986 -1.1578 -1.1578 -1.1509 -1.1509 -1.1438 -1.1438 5.5701 5.5701 7.1807 7.1807 7.2331 7.2331 7.3777 7.3777 7.5007 7.5007 7.5808 7.5808 7.9883 7.9883 8.0439 8.0439 8.1975 8.1975 8.2273 8.2273 8.3020 8.3020 9.5760 9.5760 12.4744 12.4744 12.5871 12.5871 14.1679 14.1679 14.6898 14.6898 14.7600 14.7600 15.7660 15.7660 17.4493 17.4493 k = 0.3500 0.2021 0.1429 ( 2929 PWs) bands (ev): -29.9315 -29.9315 -10.9673 -10.9673 -9.5489 -9.5489 -9.5350 -9.5350 -1.9988 -1.9988 -1.9983 -1.9983 -1.1576 -1.1576 -1.1505 -1.1505 -1.1432 -1.1432 5.6284 5.6284 7.1871 7.1871 7.2475 7.2475 7.3937 7.3937 7.5123 7.5123 7.5877 7.5877 7.9827 7.9827 8.0397 8.0397 8.1716 8.1716 8.2173 8.2173 8.2846 8.2846 9.4628 9.4628 12.4561 12.4561 12.5667 12.5667 14.1651 14.1651 14.7415 14.7415 14.8113 14.8113 15.6500 15.6500 17.3416 17.3416 k = 0.3625 0.2093 0.1480 ( 2929 PWs) bands (ev): -29.9314 -29.9314 -10.9676 -10.9676 -9.5496 -9.5496 -9.5351 -9.5351 -1.9985 -1.9985 -1.9979 -1.9979 -1.1574 -1.1574 -1.1502 -1.1502 -1.1426 -1.1426 5.6851 5.6851 7.1934 7.1934 7.2623 7.2623 7.4111 7.4111 7.5235 7.5235 7.5945 7.5945 7.9772 7.9772 8.0346 8.0346 8.1466 8.1466 8.2073 8.2073 8.2679 8.2679 9.3540 9.3540 12.4385 12.4385 12.5469 12.5469 14.1643 14.1643 14.7959 14.7959 14.8653 14.8653 15.5405 15.5405 17.2358 17.2358 k = 0.3750 0.2165 0.1531 ( 2935 PWs) bands (ev): -29.9314 -29.9314 -10.9678 -10.9678 -9.5502 -9.5502 -9.5352 -9.5352 -1.9983 -1.9983 -1.9977 -1.9977 -1.1573 -1.1573 -1.1499 -1.1499 -1.1420 -1.1420 5.7396 5.7396 7.1995 7.1995 7.2771 7.2771 7.4303 7.4303 7.5345 7.5345 7.6014 7.6014 7.9717 7.9717 8.0279 8.0279 8.1233 8.1233 8.1973 8.1973 8.2519 8.2519 9.2500 9.2500 12.4218 12.4218 12.5281 12.5281 14.1654 14.1654 14.8525 14.8525 14.9213 14.9213 15.4379 15.4379 17.1324 17.1324 k = 0.3875 0.2237 0.1582 ( 2947 PWs) bands (ev): -29.9314 -29.9314 -10.9681 -10.9681 -9.5507 -9.5507 -9.5353 -9.5353 -1.9981 -1.9981 -1.9975 -1.9975 -1.1571 -1.1571 -1.1497 -1.1497 -1.1416 -1.1416 5.7915 5.7915 7.2054 7.2054 7.2915 7.2915 7.4514 7.4514 7.5449 7.5449 7.6083 7.6083 7.9662 7.9662 8.0182 8.0182 8.1034 8.1034 8.1875 8.1875 8.2369 8.2369 9.1515 9.1515 12.4060 12.4060 12.5104 12.5104 14.1683 14.1683 14.9104 14.9104 14.9786 14.9786 15.3428 15.3428 17.0321 17.0321 k = 0.4000 0.2309 0.1633 ( 2947 PWs) bands (ev): -29.9314 -29.9314 -10.9683 -10.9683 -9.5513 -9.5513 -9.5354 -9.5354 -1.9979 -1.9979 -1.9972 -1.9972 -1.1570 -1.1570 -1.1494 -1.1494 -1.1412 -1.1412 5.8402 5.8402 7.2110 7.2110 7.3049 7.3049 7.4750 7.4750 7.5548 7.5548 7.6154 7.6154 7.9609 7.9609 8.0036 8.0036 8.0887 8.0887 8.1779 8.1779 8.2231 8.2231 9.0589 9.0589 12.3915 12.3915 12.4941 12.4941 14.1729 14.1729 14.9684 14.9684 15.0363 15.0363 15.2559 15.2559 16.9355 16.9355 k = 0.4125 0.2382 0.1684 ( 2947 PWs) bands (ev): -29.9313 -29.9313 -10.9684 -10.9684 -9.5517 -9.5517 -9.5355 -9.5355 -1.9976 -1.9976 -1.9970 -1.9970 -1.1568 -1.1568 -1.1492 -1.1492 -1.1408 -1.1408 5.8850 5.8850 7.2161 7.2161 7.3169 7.3169 7.5009 7.5009 7.5641 7.5641 7.6225 7.6225 7.9559 7.9559 7.9835 7.9835 8.0798 8.0798 8.1686 8.1686 8.2105 8.2105 8.9731 8.9731 12.3784 12.3784 12.4793 12.4793 14.1790 14.1790 15.0234 15.0234 15.0934 15.0934 15.1797 15.1797 16.8436 16.8436 k = 0.4250 0.2454 0.1735 ( 2938 PWs) bands (ev): -29.9313 -29.9313 -10.9686 -10.9686 -9.5521 -9.5521 -9.5356 -9.5356 -1.9975 -1.9975 -1.9967 -1.9967 -1.1567 -1.1567 -1.1490 -1.1490 -1.1404 -1.1404 5.9253 5.9253 7.2207 7.2207 7.3274 7.3274 7.5292 7.5292 7.5726 7.5726 7.6299 7.6299 7.9512 7.9512 7.9588 7.9588 8.0759 8.0759 8.1596 8.1596 8.1993 8.1993 8.8950 8.8950 12.3668 12.3668 12.4662 12.4662 14.1863 14.1863 15.0576 15.0576 15.1315 15.1315 15.1488 15.1488 16.7575 16.7575 k = 0.4375 0.2526 0.1786 ( 2929 PWs) bands (ev): -29.9313 -29.9313 -10.9687 -10.9687 -9.5524 -9.5524 -9.5356 -9.5356 -1.9973 -1.9973 -1.9965 -1.9965 -1.1565 -1.1565 -1.1488 -1.1488 -1.1400 -1.1400 5.9606 5.9606 7.2248 7.2248 7.3361 7.3361 7.5590 7.5590 7.5802 7.5802 7.6378 7.6378 7.9308 7.9308 7.9469 7.9469 8.0754 8.0754 8.1508 8.1508 8.1897 8.1897 8.8257 8.8257 12.3568 12.3568 12.4549 12.4549 14.1943 14.1943 15.0240 15.0240 15.1571 15.1571 15.2008 15.2008 16.6786 16.6786 k = 0.4500 0.2598 0.1837 ( 2932 PWs) bands (ev): -29.9313 -29.9313 -10.9688 -10.9688 -9.5527 -9.5527 -9.5357 -9.5357 -1.9971 -1.9971 -1.9964 -1.9964 -1.1564 -1.1564 -1.1487 -1.1487 -1.1397 -1.1397 5.9903 5.9903 7.2282 7.2282 7.3430 7.3430 7.5867 7.5867 7.5885 7.5885 7.6476 7.6476 7.9004 7.9004 7.9431 7.9431 8.0775 8.0775 8.1424 8.1424 8.1815 8.1815 8.7662 8.7662 12.3484 12.3484 12.4455 12.4455 14.2024 14.2024 14.9755 14.9755 15.2026 15.2026 15.2477 15.2477 16.6088 16.6088 k = 0.4625 0.2670 0.1888 ( 2926 PWs) bands (ev): -29.9313 -29.9313 -10.9689 -10.9689 -9.5529 -9.5529 -9.5357 -9.5357 -1.9970 -1.9970 -1.9962 -1.9962 -1.1563 -1.1563 -1.1485 -1.1485 -1.1395 -1.1395 6.0140 6.0140 7.2309 7.2309 7.3483 7.3483 7.5920 7.5920 7.6130 7.6130 7.6631 7.6631 7.8683 7.8683 7.9400 7.9400 8.0813 8.0813 8.1342 8.1342 8.1752 8.1752 8.7181 8.7181 12.3419 12.3419 12.4381 12.4381 14.2100 14.2100 14.9342 14.9342 15.2445 15.2445 15.2875 15.2875 16.5503 16.5503 k = 0.4750 0.2742 0.1939 ( 2926 PWs) bands (ev): -29.9313 -29.9313 -10.9690 -10.9690 -9.5531 -9.5531 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1394 -1.1394 6.0312 6.0312 7.2329 7.2329 7.3520 7.3520 7.5958 7.5958 7.6275 7.6275 7.6882 7.6882 7.8349 7.8349 7.9377 7.9377 8.0863 8.0863 8.1266 8.1266 8.1706 8.1706 8.6825 8.6825 12.3372 12.3372 12.4328 12.4328 14.2162 14.2162 14.9033 14.9033 15.2776 15.2776 15.3181 15.3181 16.5058 16.5058 k = 0.4875 0.2815 0.1990 ( 2932 PWs) bands (ev): -29.9313 -29.9313 -10.9690 -10.9690 -9.5532 -9.5532 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0416 6.0416 7.2340 7.2340 7.3541 7.3541 7.5982 7.5982 7.6338 7.6338 7.7188 7.7188 7.8020 7.8020 7.9363 7.9363 8.0911 8.0911 8.1203 8.1203 8.1678 8.1678 8.6606 8.6606 12.3343 12.3343 12.4295 12.4295 14.2204 14.2204 14.8843 14.8843 15.2989 15.2989 15.3375 15.3375 16.4777 16.4777 k = 0.5000 0.2887 0.2041 ( 2938 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1563 -1.1563 -1.1484 -1.1484 -1.1393 -1.1393 6.0451 6.0451 7.2344 7.2344 7.3548 7.3548 7.5990 7.5990 7.6356 7.6356 7.7393 7.7393 7.7810 7.7810 7.9357 7.9357 8.0934 8.0934 8.1176 8.1176 8.1668 8.1668 8.6532 8.6532 12.3334 12.3334 12.4285 12.4285 14.2218 14.2218 14.8778 14.8778 15.3062 15.3062 15.3441 15.3441 16.4681 16.4681 k = 0.5000 0.2887 0.2041 ( 2938 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1563 -1.1563 -1.1484 -1.1484 -1.1393 -1.1393 6.0451 6.0451 7.2344 7.2344 7.3548 7.3548 7.5990 7.5990 7.6356 7.6356 7.7393 7.7393 7.7810 7.7810 7.9357 7.9357 8.0934 8.0934 8.1176 8.1176 8.1668 8.1668 8.6532 8.6532 12.3334 12.3334 12.4285 12.4285 14.2218 14.2218 14.8778 14.8778 15.3062 15.3062 15.3441 15.3441 16.4681 16.4681 k = 0.5045 0.2758 0.2114 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9690 -10.9690 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0450 6.0450 7.2350 7.2350 7.3551 7.3551 7.5966 7.5966 7.6365 7.6365 7.7381 7.7381 7.7831 7.7831 7.9362 7.9362 8.0896 8.0896 8.1202 8.1202 8.1706 8.1706 8.6537 8.6537 12.3282 12.3282 12.4231 12.4231 14.2320 14.2320 14.8730 14.8730 15.3053 15.3053 15.3430 15.3430 16.4682 16.4682 k = 0.5089 0.2629 0.2187 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0446 6.0446 7.2365 7.2365 7.3559 7.3559 7.5900 7.5900 7.6388 7.6388 7.7348 7.7348 7.7888 7.7888 7.9375 7.9375 8.0818 8.0818 8.1246 8.1246 8.1815 8.1815 8.6550 8.6550 12.3103 12.3103 12.4100 12.4100 14.2616 14.2616 14.8585 14.8585 15.3024 15.3024 15.3404 15.3404 16.4682 16.4682 k = 0.5134 0.2500 0.2260 ( 2928 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5359 -9.5359 -1.9970 -1.9970 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1394 -1.1394 6.0439 6.0439 7.2389 7.2389 7.3572 7.3572 7.5800 7.5800 7.6422 7.6422 7.7300 7.7300 7.7971 7.7971 7.9396 7.9396 8.0735 8.0735 8.1284 8.1284 8.1986 8.1986 8.6572 8.6572 12.2747 12.2747 12.3961 12.3961 14.3076 14.3076 14.8344 14.8344 15.2970 15.2970 15.3387 15.3387 16.4677 16.4677 k = 0.5179 0.2371 0.2333 ( 2934 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5361 -9.5361 -1.9970 -1.9970 -1.9962 -1.9962 -1.1562 -1.1562 -1.1484 -1.1484 -1.1396 -1.1396 6.0430 6.0430 7.2421 7.2421 7.3590 7.3590 7.5676 7.5676 7.6463 7.6463 7.7243 7.7243 7.8072 7.8072 7.9420 7.9420 8.0658 8.0658 8.1318 8.1318 8.2205 8.2205 8.6604 8.6604 12.2205 12.2205 12.3851 12.3851 14.3654 14.3654 14.8013 14.8013 15.2878 15.2878 15.3415 15.3415 16.4663 16.4663 k = 0.5223 0.2242 0.2406 ( 2938 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5530 -9.5530 -9.5362 -9.5362 -1.9971 -1.9971 -1.9963 -1.9963 -1.1563 -1.1563 -1.1485 -1.1485 -1.1398 -1.1398 6.0419 6.0419 7.2460 7.2460 7.3611 7.3611 7.5536 7.5536 7.6508 7.6508 7.7182 7.7182 7.8185 7.8185 7.9446 7.9446 8.0591 8.0591 8.1351 8.1351 8.2465 8.2465 8.6646 8.6646 12.1512 12.1512 12.3764 12.3764 14.4277 14.4277 14.7630 14.7630 15.2747 15.2747 15.3519 15.3519 16.4632 16.4632 k = 0.5268 0.2114 0.2479 ( 2936 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5529 -9.5529 -9.5364 -9.5364 -1.9971 -1.9971 -1.9964 -1.9964 -1.1562 -1.1562 -1.1485 -1.1485 -1.1400 -1.1400 6.0406 6.0406 7.2503 7.2503 7.3636 7.3636 7.5387 7.5387 7.6551 7.6551 7.7125 7.7125 7.8306 7.8306 7.9471 7.9471 8.0536 8.0536 8.1389 8.1389 8.2760 8.2760 8.6698 8.6698 12.0706 12.0706 12.3686 12.3686 14.4801 14.4801 14.7302 14.7302 15.2582 15.2582 15.3716 15.3716 16.4579 16.4579 k = 0.5312 0.1985 0.2552 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5528 -9.5528 -9.5367 -9.5367 -1.9972 -1.9972 -1.9965 -1.9965 -1.1563 -1.1563 -1.1485 -1.1485 -1.1402 -1.1402 6.0392 6.0392 7.2550 7.2550 7.3662 7.3662 7.5233 7.5233 7.6585 7.6585 7.7079 7.7079 7.8431 7.8431 7.9494 7.9494 8.0493 8.0493 8.1431 8.1431 8.3088 8.3088 8.6763 8.6763 11.9819 11.9819 12.3609 12.3609 14.4941 14.4941 14.7284 14.7284 15.2396 15.2396 15.4023 15.4023 16.4498 16.4498 k = 0.5357 0.1856 0.2624 ( 2942 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5527 -9.5527 -9.5369 -9.5369 -1.9973 -1.9973 -1.9966 -1.9966 -1.1563 -1.1563 -1.1486 -1.1486 -1.1405 -1.1405 6.0378 6.0378 7.2597 7.2597 7.3688 7.3688 7.5078 7.5078 7.6596 7.6596 7.7057 7.7057 7.8559 7.8559 7.9513 7.9513 8.0463 8.0463 8.1480 8.1480 8.3446 8.3446 8.6840 8.6840 11.8873 11.8873 12.3528 12.3528 14.4556 14.4556 14.7695 14.7695 15.2195 15.2195 15.4453 15.4453 16.4385 16.4385 k = 0.5402 0.1727 0.2697 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5526 -9.5526 -9.5372 -9.5372 -1.9974 -1.9974 -1.9967 -1.9967 -1.1563 -1.1563 -1.1486 -1.1486 -1.1407 -1.1407 6.0364 6.0364 7.2644 7.2644 7.3712 7.3712 7.4928 7.4928 7.6579 7.6579 7.7065 7.7065 7.8688 7.8688 7.9528 7.9528 8.0447 8.0447 8.1538 8.1538 8.3833 8.3833 8.6932 8.6932 11.7883 11.7883 12.3441 12.3441 14.3867 14.3867 14.8295 14.8295 15.1988 15.1988 15.5019 15.5019 16.4236 16.4236 k = 0.5446 0.1598 0.2770 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9694 -10.9694 -9.5524 -9.5524 -9.5375 -9.5375 -1.9974 -1.9974 -1.9969 -1.9969 -1.1563 -1.1563 -1.1487 -1.1487 -1.1410 -1.1410 6.0351 6.0351 7.2688 7.2688 7.3733 7.3733 7.4787 7.4787 7.6535 7.6535 7.7099 7.7099 7.8814 7.8814 7.9539 7.9539 8.0446 8.0446 8.1603 8.1603 8.4248 8.4248 8.7040 8.7040 11.6861 11.6861 12.3347 12.3347 14.3039 14.3039 14.8908 14.8908 15.1782 15.1782 15.5727 15.5727 16.4052 16.4052 k = 0.5491 0.1469 0.2843 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9694 -10.9694 -9.5523 -9.5523 -9.5378 -9.5378 -1.9975 -1.9975 -1.9970 -1.9970 -1.1564 -1.1564 -1.1487 -1.1487 -1.1412 -1.1412 6.0339 6.0339 7.2726 7.2726 7.3746 7.3746 7.4658 7.4658 7.6476 7.6476 7.7147 7.7147 7.8934 7.8934 7.9548 7.9548 8.0461 8.0461 8.1677 8.1677 8.4688 8.4688 8.7166 8.7166 11.5816 11.5816 12.3245 12.3245 14.2138 14.2138 14.9470 14.9470 15.1582 15.1582 15.6567 15.6567 16.3833 16.3833 k = 0.5536 0.1340 0.2916 ( 2944 PWs) bands (ev): -29.9312 -29.9312 -10.9695 -10.9695 -9.5521 -9.5521 -9.5382 -9.5382 -1.9977 -1.9977 -1.9971 -1.9971 -1.1564 -1.1564 -1.1488 -1.1488 -1.1415 -1.1415 6.0328 6.0328 7.2756 7.2756 7.3750 7.3750 7.4547 7.4547 7.6409 7.6409 7.7200 7.7200 7.9040 7.9040 7.9557 7.9557 8.0493 8.0493 8.1759 8.1759 8.5152 8.5152 8.7315 8.7315 11.4755 11.4755 12.3135 12.3135 14.1198 14.1198 14.9961 14.9961 15.1399 15.1399 15.7517 15.7517 16.3584 16.3584 k = 0.5580 0.1211 0.2989 ( 2938 PWs) bands (ev): -29.9311 -29.9311 -10.9695 -10.9695 -9.5519 -9.5519 -9.5385 -9.5385 -1.9977 -1.9977 -1.9973 -1.9973 -1.1564 -1.1564 -1.1488 -1.1488 -1.1418 -1.1418 6.0318 6.0318 7.2777 7.2777 7.3743 7.3743 7.4457 7.4457 7.6340 7.6340 7.7254 7.7254 7.9126 7.9126 7.9571 7.9571 8.0545 8.0545 8.1850 8.1850 8.5636 8.5636 8.7491 8.7491 11.3683 11.3683 12.3017 12.3017 14.0238 14.0238 15.0374 15.0374 15.1248 15.1248 15.8540 15.8540 16.3315 16.3315 k = 0.5625 0.1083 0.3062 ( 2942 PWs) bands (ev): -29.9311 -29.9311 -10.9696 -10.9696 -9.5518 -9.5518 -9.5389 -9.5389 -1.9979 -1.9979 -1.9974 -1.9974 -1.1565 -1.1565 -1.1489 -1.1489 -1.1421 -1.1421 6.0310 6.0310 7.2785 7.2785 7.3724 7.3724 7.4391 7.4391 7.6272 7.6272 7.7305 7.7305 7.9183 7.9183 7.9595 7.9595 8.0615 8.0615 8.1948 8.1948 8.6132 8.6132 8.7701 8.7701 11.2604 11.2604 12.2892 12.2892 13.9273 13.9273 15.0663 15.0663 15.1189 15.1189 15.9586 15.9586 16.3047 16.3047 k = 0.5670 0.0954 0.3135 ( 2938 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5516 -9.5516 -9.5392 -9.5392 -1.9980 -1.9980 -1.9975 -1.9975 -1.1566 -1.1566 -1.1490 -1.1490 -1.1423 -1.1423 6.0305 6.0305 7.2778 7.2778 7.3698 7.3698 7.4347 7.4347 7.6206 7.6206 7.7352 7.7352 7.9210 7.9210 7.9628 7.9628 8.0704 8.0704 8.2053 8.2053 8.6629 8.6629 8.7959 8.7959 11.1521 11.1521 12.2759 12.2759 13.8314 13.8314 15.0719 15.0719 15.1347 15.1347 16.0555 16.0555 16.2844 16.2844 k = 0.5714 0.0825 0.3208 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5515 -9.5515 -9.5396 -9.5396 -1.9981 -1.9981 -1.9977 -1.9977 -1.1567 -1.1567 -1.1491 -1.1491 -1.1425 -1.1425 6.0301 6.0301 7.2756 7.2756 7.3670 7.3670 7.4320 7.4320 7.6143 7.6143 7.7396 7.7396 7.9212 7.9212 7.9665 7.9665 8.0808 8.0808 8.2164 8.2164 8.7102 8.7102 8.8286 8.8286 11.0439 11.0439 12.2618 12.2618 13.7369 13.7369 15.0650 15.0650 15.1626 15.1626 16.1181 16.1181 16.2784 16.2784 k = 0.5759 0.0696 0.3281 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9698 -10.9698 -9.5513 -9.5513 -9.5399 -9.5399 -1.9982 -1.9982 -1.9979 -1.9979 -1.1568 -1.1568 -1.1492 -1.1492 -1.1427 -1.1427 6.0298 6.0298 7.2718 7.2718 7.3646 7.3646 7.4304 7.4304 7.6083 7.6083 7.7438 7.7438 7.9195 7.9195 7.9701 7.9701 8.0923 8.0923 8.2280 8.2280 8.7528 8.7528 8.8707 8.8707 10.9360 10.9360 12.2472 12.2472 13.6447 13.6447 15.0569 15.0569 15.1922 15.1922 16.1221 16.1221 16.2425 16.2425 k = 0.5804 0.0567 0.3353 ( 2942 PWs) bands (ev): -29.9311 -29.9311 -10.9699 -10.9699 -9.5512 -9.5512 -9.5402 -9.5402 -1.9983 -1.9983 -1.9980 -1.9980 -1.1569 -1.1569 -1.1493 -1.1493 -1.1429 -1.1429 6.0297 6.0297 7.2667 7.2667 7.3629 7.3629 7.4294 7.4294 7.6026 7.6026 7.7479 7.7479 7.9167 7.9167 7.9731 7.9731 8.1045 8.1045 8.2399 8.2399 8.7898 8.7898 8.9228 8.9228 10.8290 10.8290 12.2319 12.2319 13.5553 13.5553 15.0505 15.0505 15.2214 15.2214 16.0953 16.0953 16.1951 16.1951 k = 0.5848 0.0438 0.3426 ( 2934 PWs) bands (ev): -29.9310 -29.9310 -10.9699 -10.9699 -9.5511 -9.5511 -9.5405 -9.5405 -1.9984 -1.9984 -1.9981 -1.9981 -1.1570 -1.1570 -1.1494 -1.1494 -1.1430 -1.1430 6.0298 6.0298 7.2608 7.2608 7.3618 7.3618 7.4288 7.4288 7.5974 7.5974 7.7519 7.7519 7.9131 7.9131 7.9755 7.9755 8.1168 8.1168 8.2521 8.2521 8.8224 8.8224 8.9832 8.9832 10.7233 10.7233 12.2160 12.2160 13.4693 13.4693 15.0464 15.0464 15.2499 15.2499 16.0588 16.0588 16.1452 16.1452 k = 0.5893 0.0309 0.3499 ( 2936 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5510 -9.5510 -9.5408 -9.5408 -1.9986 -1.9986 -1.9983 -1.9983 -1.1572 -1.1572 -1.1496 -1.1496 -1.1431 -1.1431 6.0299 6.0299 7.2543 7.2543 7.3612 7.3612 7.4281 7.4281 7.5924 7.5924 7.7561 7.7561 7.9090 7.9090 7.9773 7.9773 8.1289 8.1289 8.2645 8.2645 8.8522 8.8522 9.0495 9.0495 10.6196 10.6196 12.1997 12.1997 13.3870 13.3870 15.0450 15.0450 15.2775 15.2775 16.0188 16.0188 16.0940 16.0940 k = 0.5938 0.0180 0.3572 ( 2938 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5509 -9.5509 -9.5410 -9.5410 -1.9987 -1.9987 -1.9984 -1.9984 -1.1573 -1.1573 -1.1498 -1.1498 -1.1432 -1.1432 6.0300 6.0300 7.2478 7.2478 7.3609 7.3609 7.4274 7.4274 7.5877 7.5877 7.7604 7.7604 7.9045 7.9045 7.9785 7.9785 8.1405 8.1405 8.2769 8.2769 8.8802 8.8802 9.1202 9.1202 10.5187 10.5187 12.1831 12.1831 13.3088 13.3088 15.0464 15.0464 15.3041 15.3041 15.9778 15.9778 16.0420 16.0420 k = 0.5982 0.0052 0.3645 ( 2938 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5508 -9.5508 -9.5412 -9.5412 -1.9989 -1.9989 -1.9985 -1.9985 -1.1575 -1.1575 -1.1499 -1.1499 -1.1432 -1.1432 6.0301 6.0301 7.2415 7.2415 7.3606 7.3606 7.4265 7.4265 7.5833 7.5833 7.7651 7.7651 7.8998 7.8998 7.9791 7.9791 8.1513 8.1513 8.2895 8.2895 8.9063 8.9063 9.1941 9.1941 10.4219 10.4219 12.1661 12.1661 13.2349 13.2349 15.0508 15.0508 15.3294 15.3294 15.9371 15.9371 15.9898 15.9898 k = 0.6027-0.0077 0.3718 ( 2937 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5508 -9.5508 -9.5414 -9.5414 -1.9991 -1.9991 -1.9985 -1.9985 -1.1577 -1.1577 -1.1501 -1.1501 -1.1432 -1.1432 6.0301 6.0301 7.2356 7.2356 7.3601 7.3601 7.4254 7.4254 7.5792 7.5792 7.7700 7.7700 7.8950 7.8950 7.9793 7.9793 8.1612 8.1612 8.3021 8.3021 8.9299 8.9299 9.2704 9.2704 10.3305 10.3305 12.1489 12.1489 13.1654 13.1654 15.0581 15.0581 15.3529 15.3529 15.8977 15.8977 15.9380 15.9380 k = 0.6071-0.0206 0.3791 ( 2933 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5508 -9.5508 -9.5415 -9.5415 -1.9993 -1.9993 -1.9986 -1.9986 -1.1579 -1.1579 -1.1502 -1.1502 -1.1432 -1.1432 6.0300 6.0300 7.2304 7.2304 7.3593 7.3593 7.4240 7.4240 7.5756 7.5756 7.7753 7.7753 7.8902 7.8902 7.9789 7.9789 8.1702 8.1702 8.3147 8.3147 8.9498 8.9498 9.3480 9.3480 10.2466 10.2466 12.1316 12.1316 13.1005 13.1005 15.0684 15.0684 15.3739 15.3739 15.8595 15.8595 15.8883 15.8883 k = 0.6116-0.0335 0.3864 ( 2939 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5508 -9.5508 -9.5416 -9.5416 -1.9995 -1.9995 -1.9986 -1.9986 -1.1581 -1.1581 -1.1504 -1.1504 -1.1433 -1.1433 6.0297 6.0297 7.2260 7.2260 7.3578 7.3578 7.4222 7.4222 7.5725 7.5725 7.7807 7.7807 7.8854 7.8854 7.9780 7.9780 8.1782 8.1782 8.3274 8.3274 8.9644 8.9644 9.4259 9.4259 10.1728 10.1728 12.1142 12.1142 13.0401 13.0401 15.0815 15.0815 15.3913 15.3913 15.8189 15.8189 15.8462 15.8462 k = 0.6161-0.0464 0.3937 ( 2937 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5509 -9.5509 -9.5416 -9.5416 -1.9997 -1.9997 -1.9987 -1.9987 -1.1583 -1.1583 -1.1505 -1.1505 -1.1433 -1.1433 6.0291 6.0291 7.2224 7.2224 7.3555 7.3555 7.4199 7.4199 7.5701 7.5701 7.7863 7.7863 7.8810 7.8810 7.9766 7.9766 8.1854 8.1854 8.3401 8.3401 8.9719 8.9719 9.5027 9.5027 10.1125 10.1125 12.0969 12.0969 12.9843 12.9843 15.0973 15.0973 15.4040 15.4040 15.7724 15.7724 15.8173 15.8173 k = 0.6205-0.0593 0.4010 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0000 -2.0000 -1.9987 -1.9987 -1.1586 -1.1586 -1.1507 -1.1507 -1.1433 -1.1433 6.0282 6.0282 7.2196 7.2196 7.3524 7.3524 7.4170 7.4170 7.5686 7.5686 7.7917 7.7917 7.8769 7.8769 7.9747 7.9747 8.1917 8.1917 8.3528 8.3528 8.9700 8.9700 9.5764 9.5764 10.0699 10.0699 12.0797 12.0797 12.9329 12.9329 15.1157 15.1157 15.4108 15.4108 15.7240 15.7240 15.7996 15.7996 k = 0.6250-0.0722 0.4082 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.6250-0.0722 0.4082 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.6176-0.0679 0.4203 ( 2940 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9987 -1.9987 -1.1588 -1.1588 -1.1507 -1.1507 -1.1433 -1.1433 6.0271 6.0271 7.2167 7.2167 7.3486 7.3486 7.4132 7.4132 7.5688 7.5688 7.7954 7.7954 7.8755 7.8755 7.9725 7.9725 8.1975 8.1975 8.3642 8.3642 8.9584 8.9584 9.6466 9.6466 10.0503 10.0503 12.0415 12.0415 12.9053 12.9053 15.1299 15.1299 15.4139 15.4139 15.6517 15.6517 15.8163 15.8163 k = 0.6103-0.0637 0.4323 ( 2935 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1433 -1.1433 6.0277 6.0277 7.2140 7.2140 7.3493 7.3493 7.4123 7.4123 7.5709 7.5709 7.7916 7.7916 7.8805 7.8805 7.9735 7.9735 8.1978 8.1978 8.3608 8.3608 8.9621 8.9621 9.6543 9.6543 10.0518 10.0518 11.9831 11.9831 12.9586 12.9586 15.1118 15.1118 15.4220 15.4220 15.6037 15.6037 15.8630 15.8630 k = 0.6029-0.0594 0.4443 ( 2939 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5416 -9.5416 -2.0001 -2.0001 -1.9987 -1.9987 -1.1588 -1.1588 -1.1506 -1.1506 -1.1434 -1.1434 6.0286 6.0286 7.2098 7.2098 7.3501 7.3501 7.4108 7.4108 7.5744 7.5744 7.7864 7.7864 7.8875 7.8875 7.9752 7.9752 8.1983 8.1983 8.3550 8.3550 8.9682 8.9682 9.6671 9.6671 10.0544 10.0544 11.8983 11.8983 13.0349 13.0349 15.0839 15.0839 15.4327 15.4327 15.5516 15.5516 15.9128 15.9128 k = 0.5956-0.0552 0.4563 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5509 -9.5509 -9.5417 -9.5417 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1505 -1.1505 -1.1434 -1.1434 6.0299 6.0299 7.2044 7.2044 7.3510 7.3510 7.4087 7.4087 7.5793 7.5793 7.7804 7.7804 7.8957 7.8957 7.9775 7.9775 8.1989 8.1989 8.3472 8.3472 8.9766 8.9766 9.6848 9.6848 10.0581 10.0581 11.7966 11.7966 13.1247 13.1247 15.0486 15.0486 15.4422 15.4422 15.5023 15.5023 15.9604 15.9604 k = 0.5882-0.0509 0.4683 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5508 -9.5508 -9.5418 -9.5418 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1504 -1.1504 -1.1435 -1.1435 6.0314 6.0314 7.1982 7.1982 7.3517 7.3517 7.4059 7.4059 7.5857 7.5857 7.7745 7.7745 7.9044 7.9044 7.9804 7.9804 8.1998 8.1998 8.3375 8.3375 8.9874 8.9874 9.7073 9.7073 10.0628 10.0628 11.6844 11.6844 13.2219 13.2219 15.0074 15.0074 15.4316 15.4316 15.4749 15.4749 16.0038 16.0038 k = 0.5809-0.0467 0.4803 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5507 -9.5507 -9.5420 -9.5420 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1502 -1.1502 -1.1436 -1.1436 6.0332 6.0332 7.1915 7.1915 7.3521 7.3521 7.4025 7.4025 7.5934 7.5934 7.7687 7.7687 7.9131 7.9131 7.9839 7.9839 8.2007 8.2007 8.3262 8.3262 9.0004 9.0004 9.7343 9.7343 10.0686 10.0686 11.5659 11.5659 13.3224 13.3224 14.9615 14.9615 15.3906 15.3906 15.4796 15.4796 16.0418 16.0418 k = 0.5735-0.0425 0.4923 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5506 -9.5506 -9.5421 -9.5421 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1501 -1.1501 -1.1437 -1.1437 6.0352 6.0352 7.1846 7.1846 7.3521 7.3521 7.3988 7.3988 7.6021 7.6021 7.7633 7.7633 7.9215 7.9215 7.9878 7.9878 8.2016 8.2016 8.3136 8.3136 9.0153 9.0153 9.7657 9.7657 10.0755 10.0755 11.4435 11.4435 13.4240 13.4240 14.9119 14.9119 15.3468 15.3468 15.4887 15.4887 16.0738 16.0738 k = 0.5662-0.0382 0.5043 ( 2943 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5505 -9.5505 -9.5423 -9.5423 -2.0001 -2.0001 -1.9987 -1.9987 -1.1589 -1.1589 -1.1499 -1.1499 -1.1438 -1.1438 6.0373 6.0373 7.1779 7.1779 7.3516 7.3516 7.3950 7.3950 7.6117 7.6117 7.7583 7.7583 7.9295 7.9295 7.9921 7.9921 8.2025 8.2025 8.3001 8.3001 9.0320 9.0320 9.8012 9.8012 10.0835 10.0835 11.3190 11.3190 13.5250 13.5250 14.8593 14.8593 15.3056 15.3056 15.4971 15.4971 16.0999 16.0999 k = 0.5588-0.0340 0.5163 ( 2941 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5503 -9.5503 -9.5425 -9.5425 -2.0000 -2.0000 -1.9987 -1.9987 -1.1589 -1.1589 -1.1497 -1.1497 -1.1440 -1.1440 6.0395 6.0395 7.1714 7.1714 7.3506 7.3506 7.3915 7.3915 7.6219 7.6219 7.7538 7.7538 7.9369 7.9369 7.9968 7.9968 8.2032 8.2032 8.2861 8.2861 9.0502 9.0502 9.8406 9.8406 10.0927 10.0927 11.1937 11.1937 13.6244 13.6244 14.8040 14.8040 15.2680 15.2680 15.5042 15.5042 16.1204 16.1204 k = 0.5515-0.0297 0.5283 ( 2953 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5502 -9.5502 -9.5427 -9.5427 -2.0000 -2.0000 -1.9987 -1.9987 -1.1590 -1.1590 -1.1495 -1.1495 -1.1442 -1.1442 6.0417 6.0417 7.1654 7.1654 7.3489 7.3489 7.3883 7.3883 7.6322 7.6322 7.7495 7.7495 7.9436 7.9436 8.0015 8.0015 8.2037 8.2037 8.2718 8.2718 9.0693 9.0693 9.8835 9.8835 10.1030 10.1030 11.0689 11.0689 13.7215 13.7215 14.7464 14.7464 15.2344 15.2344 15.5096 15.5096 16.1358 16.1358 k = 0.5441-0.0255 0.5403 ( 2955 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5501 -9.5501 -9.5429 -9.5429 -2.0000 -2.0000 -1.9988 -1.9988 -1.1590 -1.1590 -1.1494 -1.1494 -1.1443 -1.1443 6.0438 6.0438 7.1600 7.1600 7.3470 7.3470 7.3857 7.3857 7.6425 7.6425 7.7455 7.7455 7.9496 7.9496 8.0065 8.0065 8.2038 8.2038 8.2581 8.2581 9.0891 9.0891 9.9296 9.9296 10.1146 10.1146 10.9456 10.9456 13.8157 13.8157 14.6869 14.6869 15.2050 15.2050 15.5135 15.5135 16.1470 16.1470 k = 0.5368-0.0212 0.5523 ( 2955 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5500 -9.5500 -9.5430 -9.5430 -2.0000 -2.0000 -1.9988 -1.9988 -1.1590 -1.1590 -1.1492 -1.1492 -1.1444 -1.1444 6.0458 6.0458 7.1554 7.1554 7.3448 7.3448 7.3837 7.3837 7.6523 7.6523 7.7418 7.7418 7.9548 7.9548 8.0115 8.0115 8.2033 8.2033 8.2455 8.2455 9.1089 9.1089 9.9785 9.9785 10.1277 10.1277 10.8249 10.8249 13.9065 13.9065 14.6258 14.6258 15.1801 15.1801 15.5160 15.5160 16.1545 16.1545 k = 0.5294-0.0170 0.5643 ( 2953 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5498 -9.5498 -9.5432 -9.5432 -1.9999 -1.9999 -1.9988 -1.9988 -1.1590 -1.1590 -1.1490 -1.1490 -1.1446 -1.1446 6.0476 6.0476 7.1516 7.1516 7.3427 7.3427 7.3822 7.3822 7.6614 7.6614 7.7382 7.7382 7.9591 7.9591 8.0164 8.0164 8.2018 8.2018 8.2349 8.2349 9.1278 9.1278 10.0291 10.0291 10.1427 10.1427 10.7082 10.7082 13.9935 13.9935 14.5633 14.5633 15.1598 15.1598 15.5175 15.5175 16.1592 16.1592 k = 0.5221-0.0127 0.5764 ( 2957 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5434 -9.5434 -1.9999 -1.9999 -1.9988 -1.9988 -1.1590 -1.1590 -1.1489 -1.1489 -1.1447 -1.1447 6.0490 6.0490 7.1486 7.1486 7.3408 7.3408 7.3811 7.3811 7.6694 7.6694 7.7348 7.7348 7.9624 7.9624 8.0210 8.0210 8.1990 8.1990 8.2272 8.2272 9.1451 9.1451 10.0793 10.0793 10.1607 10.1607 10.5977 10.5977 14.0763 14.0763 14.4996 14.4996 15.1441 15.1441 15.5180 15.5180 16.1618 16.1618 k = 0.5147-0.0085 0.5884 ( 2957 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5435 -9.5435 -1.9999 -1.9999 -1.9989 -1.9989 -1.1590 -1.1590 -1.1488 -1.1488 -1.1448 -1.1448 6.0502 6.0502 7.1465 7.1465 7.3394 7.3394 7.3804 7.3804 7.6758 7.6758 7.7318 7.7318 7.9646 7.9646 8.0249 8.0249 8.1953 8.1953 8.2225 8.2225 9.1594 9.1594 10.1241 10.1241 10.1844 10.1844 10.4968 10.4968 14.1545 14.1545 14.4351 14.4351 15.1330 15.1330 15.5181 15.5181 16.1629 16.1629 k = 0.5074-0.0042 0.6004 ( 2951 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9998 -1.9998 -1.9988 -1.9988 -1.1590 -1.1590 -1.1487 -1.1487 -1.1448 -1.1448 6.0509 6.0509 7.1453 7.1453 7.3386 7.3386 7.3801 7.3801 7.6802 7.6802 7.7297 7.7297 7.9659 7.9659 8.0276 8.0276 8.1923 8.1923 8.2203 8.2203 9.1694 9.1694 10.1555 10.1555 10.2142 10.2142 10.4148 10.4148 14.2271 14.2271 14.3708 14.3708 15.1265 15.1265 15.5179 15.5179 16.1631 16.1631 k = 0.5000-0.0000 0.6124 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9997 -1.9997 -1.9988 -1.9988 -1.1589 -1.1589 -1.1487 -1.1487 -1.1447 -1.1447 6.0511 6.0511 7.1450 7.1450 7.3384 7.3384 7.3800 7.3800 7.6818 7.6818 7.7289 7.7289 7.9664 7.9664 8.0286 8.0286 8.1912 8.1912 8.2197 8.2197 9.1732 9.1732 10.1688 10.1688 10.2290 10.2290 10.3793 10.3793 14.2782 14.2782 14.3225 14.3225 15.1244 15.1244 15.5177 15.5177 16.1631 16.1631 k = 0.5000-0.0000 0.6124 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9997 -1.9997 -1.9988 -1.9988 -1.1589 -1.1589 -1.1487 -1.1487 -1.1447 -1.1447 6.0511 6.0511 7.1450 7.1450 7.3384 7.3384 7.3800 7.3800 7.6818 7.6818 7.7289 7.7289 7.9664 7.9664 8.0286 8.0286 8.1912 8.1912 8.2197 8.2197 9.1732 9.1732 10.1688 10.1688 10.2290 10.2290 10.3793 10.3793 14.2782 14.2782 14.3225 14.3225 15.1244 15.1244 15.5177 15.5177 16.1631 16.1631 k = 0.5000 0.0087 0.6000 ( 2952 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9998 -1.9998 -1.9988 -1.9988 -1.1590 -1.1590 -1.1488 -1.1488 -1.1447 -1.1447 6.0510 6.0510 7.1454 7.1454 7.3386 7.3386 7.3800 7.3800 7.6812 7.6812 7.7294 7.7294 7.9661 7.9661 8.0282 8.0282 8.1905 8.1905 8.2196 8.2196 9.1699 9.1699 10.1342 10.1342 10.2168 10.2168 10.4326 10.4326 14.2769 14.2769 14.3214 14.3214 15.1294 15.1294 15.5185 15.5185 16.1637 16.1637 k = 0.5000 0.0175 0.5876 ( 2956 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5496 -9.5496 -9.5435 -9.5435 -1.9998 -1.9998 -1.9988 -1.9988 -1.1590 -1.1590 -1.1488 -1.1488 -1.1447 -1.1447 6.0505 6.0505 7.1471 7.1471 7.3394 7.3394 7.3804 7.3804 7.6797 7.6797 7.7309 7.7309 7.9656 7.9656 8.0273 8.0273 8.1887 8.1887 8.2195 8.2195 9.1601 9.1601 10.0476 10.0476 10.2251 10.2251 10.5305 10.5305 14.2714 14.2714 14.3201 14.3201 15.1438 15.1438 15.5209 15.5209 16.1657 16.1657 k = 0.5000 0.0262 0.5753 ( 2960 PWs) bands (ev): -29.9309 -29.9309 -10.9705 -10.9705 -9.5497 -9.5497 -9.5434 -9.5434 -1.9998 -1.9998 -1.9988 -1.9988 -1.1589 -1.1589 -1.1488 -1.1488 -1.1447 -1.1447 6.0497 6.0497 7.1499 7.1499 7.3407 7.3407 7.3811 7.3811 7.6773 7.6773 7.7332 7.7332 7.9647 7.9647 8.0257 8.0257 8.1858 8.1858 8.2194 8.2194 9.1445 9.1445 9.9491 9.9491 10.2479 10.2479 10.6381 10.6381 14.2592 14.2592 14.3224 14.3224 15.1660 15.1660 15.5255 15.5255 16.1689 16.1689 k = 0.5000 0.0350 0.5629 ( 2958 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5497 -9.5497 -9.5433 -9.5433 -1.9997 -1.9997 -1.9988 -1.9988 -1.1588 -1.1588 -1.1488 -1.1488 -1.1447 -1.1447 6.0486 6.0486 7.1538 7.1538 7.3426 7.3426 7.3820 7.3820 7.6743 7.6743 7.7361 7.7361 7.9636 7.9636 8.0235 8.0235 8.1819 8.1819 8.2190 8.2190 9.1240 9.1240 9.8489 9.8489 10.2802 10.2802 10.7491 10.7491 14.2402 14.2402 14.3297 14.3297 15.1937 15.1937 15.5333 15.5333 16.1733 16.1733 k = 0.5000 0.0437 0.5505 ( 2956 PWs) bands (ev): -29.9309 -29.9309 -10.9704 -10.9704 -9.5498 -9.5498 -9.5431 -9.5431 -1.9996 -1.9996 -1.9987 -1.9987 -1.1587 -1.1587 -1.1488 -1.1488 -1.1446 -1.1446 6.0474 6.0474 7.1587 7.1587 7.3449 7.3449 7.3832 7.3832 7.6708 7.6708 7.7394 7.7394 7.9622 7.9622 8.0207 8.0207 8.1770 8.1770 8.2183 8.2183 9.0995 9.0995 9.7497 9.7497 10.3205 10.3205 10.8615 10.8615 14.2169 14.2169 14.3412 14.3412 15.2239 15.2239 15.5454 15.5454 16.1788 16.1788 k = 0.5000 0.0525 0.5381 ( 2958 PWs) bands (ev): -29.9310 -29.9310 -10.9704 -10.9704 -9.5499 -9.5499 -9.5430 -9.5430 -1.9996 -1.9996 -1.9987 -1.9987 -1.1586 -1.1586 -1.1488 -1.1488 -1.1446 -1.1446 6.0459 6.0459 7.1646 7.1646 7.3476 7.3476 7.3847 7.3847 7.6669 7.6669 7.7430 7.7430 7.9605 7.9605 8.0172 8.0172 8.1714 8.1714 8.2173 8.2173 9.0719 9.0719 9.6523 9.6523 10.3676 10.3676 10.9744 10.9744 14.1915 14.1915 14.3561 14.3561 15.2534 15.2534 15.5637 15.5637 16.1852 16.1852 k = 0.5000 0.0612 0.5258 ( 2948 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5500 -9.5500 -9.5427 -9.5427 -1.9994 -1.9994 -1.9986 -1.9986 -1.1584 -1.1584 -1.1488 -1.1488 -1.1444 -1.1444 6.0443 6.0443 7.1713 7.1713 7.3507 7.3507 7.3864 7.3864 7.6628 7.6628 7.7467 7.7467 7.9586 7.9586 8.0133 8.0133 8.1650 8.1650 8.2159 8.2159 9.0423 9.0423 9.5572 9.5572 10.4208 10.4208 11.0870 11.0870 14.1658 14.1658 14.3739 14.3739 15.2792 15.2792 15.5898 15.5898 16.1925 16.1925 k = 0.5000 0.0700 0.5134 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5501 -9.5501 -9.5425 -9.5425 -1.9993 -1.9993 -1.9985 -1.9985 -1.1582 -1.1582 -1.1488 -1.1488 -1.1443 -1.1443 6.0426 6.0426 7.1789 7.1789 7.3539 7.3539 7.3884 7.3884 7.6586 7.6586 7.7504 7.7504 7.9564 7.9564 8.0087 8.0087 8.1579 8.1579 8.2141 8.2141 9.0113 9.0113 9.4648 9.4648 10.4792 10.4792 11.1986 11.1986 14.1412 14.1412 14.3943 14.3943 15.2993 15.2993 15.6248 15.6248 16.2003 16.2003 k = 0.5000 0.0787 0.5010 ( 2948 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5502 -9.5502 -9.5422 -9.5422 -1.9992 -1.9992 -1.9984 -1.9984 -1.1581 -1.1581 -1.1488 -1.1488 -1.1442 -1.1442 6.0408 6.0408 7.1871 7.1871 7.3572 7.3572 7.3907 7.3907 7.6543 7.6543 7.7538 7.7538 7.9542 7.9542 8.0036 8.0036 8.1502 8.1502 8.2119 8.2119 8.9796 8.9796 9.3753 9.3753 10.5422 10.5422 11.3086 11.3086 14.1191 14.1191 14.4170 14.4170 15.3131 15.3131 15.6681 15.6681 16.2083 16.2083 k = 0.5000 0.0875 0.4887 ( 2948 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5503 -9.5503 -9.5420 -9.5420 -1.9991 -1.9991 -1.9984 -1.9984 -1.1579 -1.1579 -1.1488 -1.1488 -1.1441 -1.1441 6.0391 6.0391 7.1958 7.1958 7.3606 7.3606 7.3931 7.3931 7.6500 7.6500 7.7570 7.7570 7.9518 7.9518 7.9980 7.9980 8.1420 8.1420 8.2093 8.2093 8.9477 8.9477 9.2889 9.2889 10.6094 10.6094 11.4163 11.4163 14.1004 14.1004 14.4416 14.4416 15.3213 15.3213 15.7184 15.7184 16.2161 16.2161 k = 0.5000 0.0962 0.4763 ( 2944 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5505 -9.5505 -9.5417 -9.5417 -1.9990 -1.9990 -1.9983 -1.9983 -1.1577 -1.1577 -1.1488 -1.1488 -1.1439 -1.1439 6.0375 6.0375 7.2050 7.2050 7.3641 7.3641 7.3959 7.3959 7.6460 7.6460 7.7596 7.7596 7.9493 7.9493 7.9921 7.9921 8.1334 8.1334 8.2062 8.2062 8.9161 8.9161 9.2059 9.2059 10.6804 10.6804 11.5209 11.5209 14.0862 14.0862 14.4678 14.4678 15.3250 15.3250 15.7739 15.7739 16.2228 16.2228 k = 0.5000 0.1050 0.4639 ( 2952 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5506 -9.5506 -9.5413 -9.5413 -1.9989 -1.9989 -1.9982 -1.9982 -1.1575 -1.1575 -1.1489 -1.1489 -1.1438 -1.1438 6.0360 6.0360 7.2144 7.2144 7.3674 7.3674 7.3987 7.3987 7.6422 7.6422 7.7615 7.7615 7.9467 7.9467 7.9858 7.9858 8.1243 8.1243 8.2027 8.2027 8.8848 8.8848 9.1267 9.1267 10.7547 10.7547 11.6216 11.6216 14.0773 14.0773 14.4954 14.4954 15.3255 15.3255 15.8327 15.8327 16.2274 16.2274 k = 0.5000 0.1137 0.4515 ( 2954 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5508 -9.5508 -9.5410 -9.5410 -1.9988 -1.9988 -1.9981 -1.9981 -1.1574 -1.1574 -1.1489 -1.1489 -1.1436 -1.1436 6.0347 6.0347 7.2238 7.2238 7.3707 7.3707 7.4018 7.4018 7.6390 7.6390 7.7626 7.7626 7.9439 7.9439 7.9794 7.9794 8.1151 8.1151 8.1989 8.1989 8.8537 8.8537 9.0518 9.0518 10.8323 10.8323 11.7177 11.7177 14.0747 14.0747 14.5238 14.5238 15.3236 15.3236 15.8934 15.8934 16.2279 16.2279 k = 0.5000 0.1225 0.4392 ( 2952 PWs) bands (ev): -29.9311 -29.9311 -10.9699 -10.9699 -9.5509 -9.5509 -9.5406 -9.5406 -1.9986 -1.9986 -1.9980 -1.9980 -1.1572 -1.1572 -1.1489 -1.1489 -1.1434 -1.1434 6.0336 6.0336 7.2330 7.2330 7.3738 7.3738 7.4051 7.4051 7.6364 7.6364 7.7627 7.7627 7.9410 7.9410 7.9731 7.9731 8.1059 8.1059 8.1948 8.1948 8.8222 8.8222 8.9820 8.9820 10.9127 10.9127 11.8083 11.8083 14.0791 14.0791 14.5526 14.5526 15.3201 15.3201 15.9545 15.9545 16.2211 16.2211 k = 0.5000 0.1312 0.4268 ( 2950 PWs) bands (ev): -29.9311 -29.9311 -10.9699 -10.9699 -9.5511 -9.5511 -9.5403 -9.5403 -1.9985 -1.9985 -1.9979 -1.9979 -1.1570 -1.1570 -1.1489 -1.1489 -1.1431 -1.1431 6.0327 6.0327 7.2417 7.2417 7.3767 7.3767 7.4087 7.4087 7.6346 7.6346 7.7617 7.7617 7.9375 7.9375 7.9672 7.9672 8.0967 8.0967 8.1904 8.1904 8.7891 8.7891 8.9188 8.9188 10.9958 10.9958 11.8926 11.8926 14.0911 14.0911 14.5814 14.5814 15.3155 15.3155 16.0145 16.0145 16.2020 16.2020 k = 0.5000 0.1400 0.4144 ( 2950 PWs) bands (ev): -29.9311 -29.9311 -10.9698 -10.9698 -9.5513 -9.5513 -9.5399 -9.5399 -1.9983 -1.9983 -1.9977 -1.9977 -1.1569 -1.1569 -1.1489 -1.1489 -1.1429 -1.1429 6.0321 6.0321 7.2496 7.2496 7.3793 7.3793 7.4128 7.4128 7.6337 7.6337 7.7594 7.7594 7.9332 7.9332 7.9622 7.9622 8.0878 8.0878 8.1858 8.1858 8.7520 8.7520 8.8648 8.8648 11.0814 11.0814 11.9699 11.9699 14.1112 14.1112 14.6094 14.6094 15.3102 15.3102 16.0692 16.0692 16.1669 16.1669 k = 0.5000 0.1487 0.4021 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5514 -9.5514 -9.5395 -9.5395 -1.9981 -1.9981 -1.9975 -1.9975 -1.1567 -1.1567 -1.1488 -1.1488 -1.1426 -1.1426 6.0319 6.0319 7.2564 7.2564 7.3812 7.3812 7.4179 7.4179 7.6340 7.6340 7.7558 7.7558 7.9278 7.9278 7.9585 7.9585 8.0794 8.0794 8.1810 8.1810 8.7088 8.7088 8.8221 8.8221 11.1693 11.1693 12.0397 12.0397 14.1396 14.1396 14.6359 14.6359 15.3046 15.3046 16.0756 16.0756 16.1538 16.1538 k = 0.5000 0.1575 0.3897 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5516 -9.5516 -9.5392 -9.5392 -1.9980 -1.9980 -1.9974 -1.9974 -1.1566 -1.1566 -1.1488 -1.1488 -1.1423 -1.1423 6.0319 6.0319 7.2618 7.2618 7.3822 7.3822 7.4244 7.4244 7.6353 7.6353 7.7510 7.7510 7.9210 7.9210 7.9560 7.9560 8.0715 8.0715 8.1761 8.1761 8.6604 8.6604 8.7897 8.7897 11.2592 11.2592 12.1017 12.1017 14.1762 14.1762 14.6599 14.6599 15.2990 15.2990 15.9998 15.9998 16.1992 16.1992 k = 0.5000 0.1662 0.3773 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9696 -10.9696 -9.5518 -9.5518 -9.5388 -9.5388 -1.9979 -1.9979 -1.9973 -1.9973 -1.1565 -1.1565 -1.1488 -1.1488 -1.1420 -1.1420 6.0321 6.0321 7.2656 7.2656 7.3823 7.3823 7.4324 7.4324 7.6377 7.6377 7.7450 7.7450 7.9131 7.9131 7.9546 7.9546 8.0645 8.0645 8.1712 8.1712 8.6097 8.6097 8.7647 8.7647 11.3508 11.3508 12.1559 12.1559 14.2207 14.2207 14.6802 14.6802 15.2935 15.2935 15.9034 15.9034 16.2490 16.2490 k = 0.5000 0.1750 0.3649 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9695 -10.9695 -9.5520 -9.5520 -9.5384 -9.5384 -1.9977 -1.9977 -1.9972 -1.9972 -1.1565 -1.1565 -1.1487 -1.1487 -1.1418 -1.1418 6.0326 6.0326 7.2678 7.2678 7.3814 7.3814 7.4422 7.4422 7.6411 7.6411 7.7383 7.7383 7.9043 7.9043 7.9540 7.9540 8.0585 8.0585 8.1664 8.1664 8.5592 8.5592 8.7446 8.7446 11.4438 11.4438 12.2023 12.2023 14.2724 14.2724 14.6952 14.6952 15.2885 15.2885 15.8014 15.8014 16.2956 16.2956 k = 0.5000 0.1837 0.3526 ( 2938 PWs) bands (ev): -29.9312 -29.9312 -10.9695 -10.9695 -9.5521 -9.5521 -9.5381 -9.5381 -1.9976 -1.9976 -1.9970 -1.9970 -1.1564 -1.1564 -1.1487 -1.1487 -1.1415 -1.1415 6.0334 6.0334 7.2683 7.2683 7.3797 7.3797 7.4535 7.4535 7.6452 7.6452 7.7310 7.7310 7.8948 7.8948 7.9537 7.9537 8.0536 8.0536 8.1616 8.1616 8.5103 8.5103 8.7279 8.7279 11.5379 11.5379 12.2415 12.2415 14.3301 14.3301 14.7029 14.7029 15.2841 15.2841 15.7009 15.7009 16.3371 16.3371 k = 0.5000 0.1925 0.3402 ( 2944 PWs) bands (ev): -29.9312 -29.9312 -10.9694 -10.9694 -9.5523 -9.5523 -9.5378 -9.5378 -1.9976 -1.9976 -1.9969 -1.9969 -1.1564 -1.1564 -1.1487 -1.1487 -1.1412 -1.1412 6.0344 6.0344 7.2674 7.2674 7.3774 7.3774 7.4662 7.4662 7.6497 7.6497 7.7237 7.7237 7.8846 7.8846 7.9534 7.9534 8.0500 8.0500 8.1569 8.1569 8.4636 8.4636 8.7137 8.7137 11.6324 11.6324 12.2741 12.2741 14.3923 14.3923 14.7008 14.7008 15.2805 15.2805 15.6073 15.6073 16.3724 16.3724 k = 0.5000 0.2012 0.3278 ( 2932 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5524 -9.5524 -9.5374 -9.5374 -1.9974 -1.9974 -1.9968 -1.9968 -1.1563 -1.1563 -1.1486 -1.1486 -1.1409 -1.1409 6.0355 6.0355 7.2652 7.2652 7.3747 7.3747 7.4801 7.4801 7.6541 7.6541 7.7172 7.7172 7.8740 7.8740 7.9530 7.9530 8.0479 8.0479 8.1526 8.1526 8.4196 8.4196 8.7017 8.7017 11.7269 11.7269 12.3007 12.3007 14.4576 14.4576 14.6865 14.6865 15.2780 15.2780 15.5252 15.5252 16.4009 16.4009 k = 0.5000 0.2099 0.3155 ( 2934 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5526 -9.5526 -9.5371 -9.5371 -1.9973 -1.9973 -1.9967 -1.9967 -1.1563 -1.1563 -1.1485 -1.1485 -1.1406 -1.1406 6.0368 6.0368 7.2620 7.2620 7.3719 7.3719 7.4947 7.4947 7.6574 7.6574 7.7122 7.7122 7.8630 7.8630 7.9521 7.9521 8.0473 8.0473 8.1484 8.1484 8.3783 8.3783 8.6914 8.6914 11.8205 11.8205 12.3223 12.3223 14.5237 14.5237 14.6578 14.6578 15.2768 15.2768 15.4581 15.4581 16.4230 16.4230 k = 0.5000 0.2187 0.3031 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5527 -9.5527 -9.5369 -9.5369 -1.9973 -1.9973 -1.9966 -1.9966 -1.1563 -1.1563 -1.1486 -1.1486 -1.1404 -1.1404 6.0381 6.0381 7.2582 7.2582 7.3689 7.3689 7.5098 7.5098 7.6587 7.6587 7.7099 7.7099 7.8516 7.8516 7.9508 7.9508 8.0483 8.0483 8.1445 8.1445 8.3400 8.3400 8.6826 8.6826 11.9122 11.9122 12.3396 12.3396 14.5865 14.5865 14.6170 14.6170 15.2769 15.2769 15.4078 15.4078 16.4392 16.4392 k = 0.5000 0.2274 0.2907 ( 2938 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5528 -9.5528 -9.5366 -9.5366 -1.9972 -1.9972 -1.9965 -1.9965 -1.1563 -1.1563 -1.1485 -1.1485 -1.1401 -1.1401 6.0395 6.0395 7.2539 7.2539 7.3661 7.3661 7.5252 7.5252 7.6576 7.6576 7.7108 7.7108 7.8400 7.8400 7.9490 7.9490 8.0507 8.0507 8.1409 8.1409 8.3048 8.3048 8.6753 8.6753 12.0007 12.0007 12.3536 12.3536 14.5566 14.5566 14.6533 14.6533 15.2787 15.2787 15.3735 15.3735 16.4508 16.4508 k = 0.5000 0.2362 0.2784 ( 2930 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5529 -9.5529 -9.5364 -9.5364 -1.9971 -1.9971 -1.9963 -1.9963 -1.1562 -1.1562 -1.1484 -1.1484 -1.1399 -1.1399 6.0408 6.0408 7.2496 7.2496 7.3634 7.3634 7.5404 7.5404 7.6544 7.6544 7.7143 7.7143 7.8284 7.8284 7.9468 7.9468 8.0547 8.0547 8.1375 8.1375 8.2727 8.2727 8.6692 8.6692 12.0842 12.0842 12.3651 12.3651 14.4928 14.4928 14.7102 14.7102 15.2822 15.2822 15.3526 15.3526 16.4587 16.4587 k = 0.5000 0.2449 0.2660 ( 2932 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5530 -9.5530 -9.5362 -9.5362 -1.9971 -1.9971 -1.9963 -1.9963 -1.1562 -1.1562 -1.1484 -1.1484 -1.1397 -1.1397 6.0420 6.0420 7.2455 7.2455 7.3609 7.3609 7.5551 7.5551 7.6502 7.6502 7.7193 7.7193 7.8170 7.8170 7.9443 7.9443 8.0600 8.0600 8.1344 8.1344 8.2439 8.2439 8.6641 8.6641 12.1604 12.1604 12.3752 12.3752 14.4258 14.4258 14.7606 14.7606 15.2871 15.2871 15.3416 15.3416 16.4637 16.4637 k = 0.5000 0.2537 0.2536 ( 2930 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5361 -9.5361 -1.9970 -1.9970 -1.9962 -1.9962 -1.1562 -1.1562 -1.1484 -1.1484 -1.1396 -1.1396 6.0431 6.0431 7.2418 7.2418 7.3588 7.3588 7.5687 7.5687 7.6459 7.6459 7.7249 7.7249 7.8063 7.8063 7.9418 7.9418 8.0665 8.0665 8.1314 8.1314 8.2187 8.2187 8.6601 8.6601 12.2262 12.2262 12.3851 12.3851 14.3614 14.3614 14.8028 14.8028 15.2928 15.2928 15.3376 15.3376 16.4665 16.4665 k = 0.5000 0.2624 0.2412 ( 2926 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5359 -9.5359 -1.9970 -1.9970 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1394 -1.1394 6.0439 6.0439 7.2387 7.2387 7.3571 7.3571 7.5807 7.5807 7.6420 7.6420 7.7303 7.7303 7.7965 7.7965 7.9394 7.9394 8.0740 8.0740 8.1282 8.1282 8.1974 8.1974 8.6571 8.6571 12.2776 12.2776 12.3967 12.3967 14.3046 14.3046 14.8358 14.8358 15.2983 15.2983 15.3379 15.3379 16.4678 16.4678 k = 0.5000 0.2712 0.2289 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0446 6.0446 7.2364 7.2364 7.3559 7.3559 7.5903 7.5903 7.6387 7.6387 7.7350 7.7350 7.7885 7.7885 7.9375 7.9375 8.0822 8.0822 8.1244 8.1244 8.1809 8.1809 8.6549 8.6549 12.3113 12.3113 12.4106 12.4106 14.2600 14.2600 14.8593 14.8593 15.3027 15.3027 15.3404 15.3404 16.4682 16.4682 k = 0.5000 0.2799 0.2165 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9690 -10.9690 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0450 6.0450 7.2349 7.2349 7.3551 7.3551 7.5967 7.5967 7.6365 7.6365 7.7382 7.7382 7.7830 7.7830 7.9362 7.9362 8.0897 8.0897 8.1201 8.1201 8.1704 8.1704 8.6537 8.6537 12.3284 12.3284 12.4233 12.4233 14.2316 14.2316 14.8732 14.8732 15.3054 15.3054 15.3430 15.3430 16.4682 16.4682 k = 0.5000 0.2887 0.2041 ( 2938 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1563 -1.1563 -1.1484 -1.1484 -1.1393 -1.1393 6.0451 6.0451 7.2344 7.2344 7.3548 7.3548 7.5990 7.5990 7.6356 7.6356 7.7393 7.7393 7.7810 7.7810 7.9357 7.9357 8.0934 8.0934 8.1176 8.1176 8.1668 8.1668 8.6532 8.6532 12.3334 12.3334 12.4285 12.4285 14.2218 14.2218 14.8778 14.8778 15.3062 15.3062 15.3441 15.3441 16.4681 16.4681 k = 0.5000 0.2887 0.2041 ( 2938 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9970 -1.9970 -1.9961 -1.9961 -1.1563 -1.1563 -1.1484 -1.1484 -1.1393 -1.1393 6.0451 6.0451 7.2344 7.2344 7.3548 7.3548 7.5990 7.5990 7.6356 7.6356 7.7393 7.7393 7.7810 7.7810 7.9357 7.9357 8.0934 8.0934 8.1176 8.1176 8.1668 8.1668 8.6532 8.6532 12.3334 12.3334 12.4285 12.4285 14.2218 14.2218 14.8778 14.8778 15.3062 15.3062 15.3441 15.3441 16.4681 16.4681 k = 0.4955 0.2861 0.2187 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9690 -10.9690 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0450 6.0450 7.2350 7.2350 7.3551 7.3551 7.5966 7.5966 7.6365 7.6365 7.7381 7.7381 7.7831 7.7831 7.9362 7.9362 8.0896 8.0896 8.1202 8.1202 8.1706 8.1706 8.6537 8.6537 12.3282 12.3282 12.4231 12.4231 14.2320 14.2320 14.8730 14.8730 15.3053 15.3053 15.3430 15.3430 16.4682 16.4682 k = 0.4911 0.2835 0.2333 ( 2928 PWs) bands (ev): -29.9313 -29.9313 -10.9691 -10.9691 -9.5532 -9.5532 -9.5358 -9.5358 -1.9969 -1.9969 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1393 -1.1393 6.0446 6.0446 7.2365 7.2365 7.3559 7.3559 7.5900 7.5900 7.6388 7.6388 7.7348 7.7348 7.7888 7.7888 7.9375 7.9375 8.0818 8.0818 8.1246 8.1246 8.1815 8.1815 8.6550 8.6550 12.3103 12.3103 12.4100 12.4100 14.2616 14.2616 14.8585 14.8585 15.3024 15.3024 15.3404 15.3404 16.4682 16.4682 k = 0.4866 0.2809 0.2479 ( 2928 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5359 -9.5359 -1.9970 -1.9970 -1.9961 -1.9961 -1.1562 -1.1562 -1.1484 -1.1484 -1.1394 -1.1394 6.0439 6.0439 7.2389 7.2389 7.3572 7.3572 7.5800 7.5800 7.6422 7.6422 7.7300 7.7300 7.7971 7.7971 7.9396 7.9396 8.0735 8.0735 8.1284 8.1284 8.1986 8.1986 8.6572 8.6572 12.2747 12.2747 12.3961 12.3961 14.3076 14.3076 14.8344 14.8344 15.2970 15.2970 15.3387 15.3387 16.4677 16.4677 k = 0.4821 0.2784 0.2624 ( 2934 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5531 -9.5531 -9.5361 -9.5361 -1.9970 -1.9970 -1.9962 -1.9962 -1.1562 -1.1562 -1.1484 -1.1484 -1.1396 -1.1396 6.0430 6.0430 7.2421 7.2421 7.3590 7.3590 7.5676 7.5676 7.6463 7.6463 7.7243 7.7243 7.8072 7.8072 7.9420 7.9420 8.0658 8.0658 8.1318 8.1318 8.2205 8.2205 8.6604 8.6604 12.2205 12.2205 12.3851 12.3851 14.3654 14.3654 14.8013 14.8013 15.2878 15.2878 15.3415 15.3415 16.4663 16.4663 k = 0.4777 0.2758 0.2770 ( 2938 PWs) bands (ev): -29.9312 -29.9312 -10.9691 -10.9691 -9.5530 -9.5530 -9.5362 -9.5362 -1.9971 -1.9971 -1.9963 -1.9963 -1.1563 -1.1563 -1.1485 -1.1485 -1.1398 -1.1398 6.0419 6.0419 7.2460 7.2460 7.3611 7.3611 7.5536 7.5536 7.6508 7.6508 7.7182 7.7182 7.8185 7.8185 7.9446 7.9446 8.0591 8.0591 8.1351 8.1351 8.2465 8.2465 8.6646 8.6646 12.1512 12.1512 12.3764 12.3764 14.4277 14.4277 14.7630 14.7630 15.2747 15.2747 15.3519 15.3519 16.4632 16.4632 k = 0.4732 0.2732 0.2916 ( 2936 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5529 -9.5529 -9.5364 -9.5364 -1.9971 -1.9971 -1.9964 -1.9964 -1.1562 -1.1562 -1.1485 -1.1485 -1.1400 -1.1400 6.0406 6.0406 7.2503 7.2503 7.3636 7.3636 7.5387 7.5387 7.6551 7.6551 7.7125 7.7125 7.8306 7.8306 7.9471 7.9471 8.0536 8.0536 8.1389 8.1389 8.2760 8.2760 8.6698 8.6698 12.0706 12.0706 12.3686 12.3686 14.4801 14.4801 14.7302 14.7302 15.2582 15.2582 15.3716 15.3716 16.4579 16.4579 k = 0.4688 0.2706 0.3062 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9692 -10.9692 -9.5528 -9.5528 -9.5367 -9.5367 -1.9972 -1.9972 -1.9965 -1.9965 -1.1563 -1.1563 -1.1485 -1.1485 -1.1402 -1.1402 6.0392 6.0392 7.2550 7.2550 7.3662 7.3662 7.5233 7.5233 7.6585 7.6585 7.7079 7.7079 7.8431 7.8431 7.9494 7.9494 8.0493 8.0493 8.1431 8.1431 8.3088 8.3088 8.6763 8.6763 11.9819 11.9819 12.3609 12.3609 14.4941 14.4941 14.7284 14.7284 15.2396 15.2396 15.4023 15.4023 16.4498 16.4498 k = 0.4643 0.2681 0.3208 ( 2942 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5527 -9.5527 -9.5369 -9.5369 -1.9973 -1.9973 -1.9966 -1.9966 -1.1563 -1.1563 -1.1486 -1.1486 -1.1405 -1.1405 6.0378 6.0378 7.2597 7.2597 7.3688 7.3688 7.5078 7.5078 7.6596 7.6596 7.7057 7.7057 7.8559 7.8559 7.9513 7.9513 8.0463 8.0463 8.1480 8.1480 8.3446 8.3446 8.6840 8.6840 11.8873 11.8873 12.3528 12.3528 14.4556 14.4556 14.7695 14.7695 15.2195 15.2195 15.4453 15.4453 16.4385 16.4385 k = 0.4598 0.2655 0.3353 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9693 -10.9693 -9.5526 -9.5526 -9.5372 -9.5372 -1.9974 -1.9974 -1.9967 -1.9967 -1.1563 -1.1563 -1.1486 -1.1486 -1.1407 -1.1407 6.0364 6.0364 7.2644 7.2644 7.3712 7.3712 7.4928 7.4928 7.6579 7.6579 7.7065 7.7065 7.8688 7.8688 7.9528 7.9528 8.0447 8.0447 8.1538 8.1538 8.3833 8.3833 8.6932 8.6932 11.7883 11.7883 12.3441 12.3441 14.3867 14.3867 14.8295 14.8295 15.1988 15.1988 15.5019 15.5019 16.4236 16.4236 k = 0.4554 0.2629 0.3499 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9694 -10.9694 -9.5524 -9.5524 -9.5375 -9.5375 -1.9974 -1.9974 -1.9969 -1.9969 -1.1563 -1.1563 -1.1487 -1.1487 -1.1410 -1.1410 6.0351 6.0351 7.2688 7.2688 7.3733 7.3733 7.4787 7.4787 7.6535 7.6535 7.7099 7.7099 7.8814 7.8814 7.9539 7.9539 8.0446 8.0446 8.1603 8.1603 8.4248 8.4248 8.7040 8.7040 11.6861 11.6861 12.3347 12.3347 14.3039 14.3039 14.8908 14.8908 15.1782 15.1782 15.5727 15.5727 16.4052 16.4052 k = 0.4509 0.2603 0.3645 ( 2940 PWs) bands (ev): -29.9312 -29.9312 -10.9694 -10.9694 -9.5523 -9.5523 -9.5378 -9.5378 -1.9975 -1.9975 -1.9970 -1.9970 -1.1564 -1.1564 -1.1487 -1.1487 -1.1412 -1.1412 6.0339 6.0339 7.2726 7.2726 7.3746 7.3746 7.4658 7.4658 7.6476 7.6476 7.7147 7.7147 7.8934 7.8934 7.9548 7.9548 8.0461 8.0461 8.1677 8.1677 8.4688 8.4688 8.7166 8.7166 11.5816 11.5816 12.3245 12.3245 14.2138 14.2138 14.9470 14.9470 15.1582 15.1582 15.6567 15.6567 16.3833 16.3833 k = 0.4464 0.2577 0.3791 ( 2944 PWs) bands (ev): -29.9312 -29.9312 -10.9695 -10.9695 -9.5521 -9.5521 -9.5382 -9.5382 -1.9977 -1.9977 -1.9971 -1.9971 -1.1564 -1.1564 -1.1488 -1.1488 -1.1415 -1.1415 6.0328 6.0328 7.2756 7.2756 7.3750 7.3750 7.4547 7.4547 7.6409 7.6409 7.7200 7.7200 7.9040 7.9040 7.9557 7.9557 8.0493 8.0493 8.1759 8.1759 8.5152 8.5152 8.7315 8.7315 11.4755 11.4755 12.3135 12.3135 14.1198 14.1198 14.9961 14.9961 15.1399 15.1399 15.7517 15.7517 16.3584 16.3584 k = 0.4420 0.2552 0.3937 ( 2938 PWs) bands (ev): -29.9311 -29.9311 -10.9695 -10.9695 -9.5519 -9.5519 -9.5385 -9.5385 -1.9977 -1.9977 -1.9973 -1.9973 -1.1564 -1.1564 -1.1488 -1.1488 -1.1418 -1.1418 6.0318 6.0318 7.2777 7.2777 7.3743 7.3743 7.4457 7.4457 7.6340 7.6340 7.7254 7.7254 7.9126 7.9126 7.9571 7.9571 8.0545 8.0545 8.1850 8.1850 8.5636 8.5636 8.7491 8.7491 11.3683 11.3683 12.3017 12.3017 14.0238 14.0238 15.0374 15.0374 15.1248 15.1248 15.8540 15.8540 16.3315 16.3315 k = 0.4375 0.2526 0.4082 ( 2942 PWs) bands (ev): -29.9311 -29.9311 -10.9696 -10.9696 -9.5518 -9.5518 -9.5389 -9.5389 -1.9979 -1.9979 -1.9974 -1.9974 -1.1565 -1.1565 -1.1489 -1.1489 -1.1421 -1.1421 6.0310 6.0310 7.2785 7.2785 7.3724 7.3724 7.4391 7.4391 7.6272 7.6272 7.7305 7.7305 7.9183 7.9183 7.9595 7.9595 8.0615 8.0615 8.1948 8.1948 8.6132 8.6132 8.7701 8.7701 11.2604 11.2604 12.2892 12.2892 13.9273 13.9273 15.0663 15.0663 15.1189 15.1189 15.9586 15.9586 16.3047 16.3047 k = 0.4330 0.2500 0.4228 ( 2938 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5516 -9.5516 -9.5392 -9.5392 -1.9980 -1.9980 -1.9975 -1.9975 -1.1566 -1.1566 -1.1490 -1.1490 -1.1423 -1.1423 6.0305 6.0305 7.2778 7.2778 7.3698 7.3698 7.4347 7.4347 7.6206 7.6206 7.7352 7.7352 7.9210 7.9210 7.9628 7.9628 8.0704 8.0704 8.2053 8.2053 8.6629 8.6629 8.7959 8.7959 11.1521 11.1521 12.2759 12.2759 13.8314 13.8314 15.0719 15.0719 15.1347 15.1347 16.0555 16.0555 16.2844 16.2844 k = 0.4286 0.2474 0.4374 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9697 -10.9697 -9.5515 -9.5515 -9.5396 -9.5396 -1.9981 -1.9981 -1.9977 -1.9977 -1.1567 -1.1567 -1.1491 -1.1491 -1.1425 -1.1425 6.0301 6.0301 7.2756 7.2756 7.3670 7.3670 7.4320 7.4320 7.6143 7.6143 7.7396 7.7396 7.9212 7.9212 7.9665 7.9665 8.0808 8.0808 8.2164 8.2164 8.7102 8.7102 8.8286 8.8286 11.0439 11.0439 12.2618 12.2618 13.7369 13.7369 15.0650 15.0650 15.1626 15.1626 16.1181 16.1181 16.2784 16.2784 k = 0.4241 0.2449 0.4520 ( 2940 PWs) bands (ev): -29.9311 -29.9311 -10.9698 -10.9698 -9.5513 -9.5513 -9.5399 -9.5399 -1.9982 -1.9982 -1.9979 -1.9979 -1.1568 -1.1568 -1.1492 -1.1492 -1.1427 -1.1427 6.0298 6.0298 7.2718 7.2718 7.3646 7.3646 7.4304 7.4304 7.6083 7.6083 7.7438 7.7438 7.9195 7.9195 7.9701 7.9701 8.0923 8.0923 8.2280 8.2280 8.7528 8.7528 8.8707 8.8707 10.9360 10.9360 12.2472 12.2472 13.6447 13.6447 15.0569 15.0569 15.1922 15.1922 16.1221 16.1221 16.2425 16.2425 k = 0.4196 0.2423 0.4666 ( 2942 PWs) bands (ev): -29.9311 -29.9311 -10.9699 -10.9699 -9.5512 -9.5512 -9.5402 -9.5402 -1.9983 -1.9983 -1.9980 -1.9980 -1.1569 -1.1569 -1.1493 -1.1493 -1.1429 -1.1429 6.0297 6.0297 7.2667 7.2667 7.3629 7.3629 7.4294 7.4294 7.6026 7.6026 7.7479 7.7479 7.9167 7.9167 7.9731 7.9731 8.1045 8.1045 8.2399 8.2399 8.7898 8.7898 8.9228 8.9228 10.8290 10.8290 12.2319 12.2319 13.5553 13.5553 15.0505 15.0505 15.2214 15.2214 16.0953 16.0953 16.1951 16.1951 k = 0.4152 0.2397 0.4811 ( 2934 PWs) bands (ev): -29.9310 -29.9310 -10.9699 -10.9699 -9.5511 -9.5511 -9.5405 -9.5405 -1.9984 -1.9984 -1.9981 -1.9981 -1.1570 -1.1570 -1.1494 -1.1494 -1.1430 -1.1430 6.0298 6.0298 7.2608 7.2608 7.3618 7.3618 7.4288 7.4288 7.5974 7.5974 7.7519 7.7519 7.9131 7.9131 7.9755 7.9755 8.1168 8.1168 8.2521 8.2521 8.8224 8.8224 8.9832 8.9832 10.7233 10.7233 12.2160 12.2160 13.4693 13.4693 15.0464 15.0464 15.2499 15.2499 16.0588 16.0588 16.1452 16.1452 k = 0.4107 0.2371 0.4957 ( 2936 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5510 -9.5510 -9.5408 -9.5408 -1.9986 -1.9986 -1.9983 -1.9983 -1.1572 -1.1572 -1.1496 -1.1496 -1.1431 -1.1431 6.0299 6.0299 7.2543 7.2543 7.3612 7.3612 7.4281 7.4281 7.5924 7.5924 7.7561 7.7561 7.9090 7.9090 7.9773 7.9773 8.1289 8.1289 8.2645 8.2645 8.8522 8.8522 9.0495 9.0495 10.6196 10.6196 12.1997 12.1997 13.3870 13.3870 15.0450 15.0450 15.2775 15.2775 16.0188 16.0188 16.0940 16.0940 k = 0.4062 0.2345 0.5103 ( 2938 PWs) bands (ev): -29.9310 -29.9310 -10.9700 -10.9700 -9.5509 -9.5509 -9.5410 -9.5410 -1.9987 -1.9987 -1.9984 -1.9984 -1.1573 -1.1573 -1.1498 -1.1498 -1.1432 -1.1432 6.0300 6.0300 7.2478 7.2478 7.3609 7.3609 7.4274 7.4274 7.5877 7.5877 7.7604 7.7604 7.9045 7.9045 7.9785 7.9785 8.1405 8.1405 8.2769 8.2769 8.8802 8.8802 9.1202 9.1202 10.5187 10.5187 12.1831 12.1831 13.3088 13.3088 15.0464 15.0464 15.3041 15.3041 15.9778 15.9778 16.0420 16.0420 k = 0.4018 0.2320 0.5249 ( 2938 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5508 -9.5508 -9.5412 -9.5412 -1.9989 -1.9989 -1.9985 -1.9985 -1.1575 -1.1575 -1.1499 -1.1499 -1.1432 -1.1432 6.0301 6.0301 7.2415 7.2415 7.3606 7.3606 7.4265 7.4265 7.5833 7.5833 7.7651 7.7651 7.8998 7.8998 7.9791 7.9791 8.1513 8.1513 8.2895 8.2895 8.9063 8.9063 9.1941 9.1941 10.4219 10.4219 12.1661 12.1661 13.2349 13.2349 15.0508 15.0508 15.3294 15.3294 15.9371 15.9371 15.9898 15.9898 k = 0.3973 0.2294 0.5395 ( 2937 PWs) bands (ev): -29.9310 -29.9310 -10.9701 -10.9701 -9.5508 -9.5508 -9.5414 -9.5414 -1.9991 -1.9991 -1.9985 -1.9985 -1.1577 -1.1577 -1.1501 -1.1501 -1.1432 -1.1432 6.0301 6.0301 7.2356 7.2356 7.3601 7.3601 7.4254 7.4254 7.5792 7.5792 7.7700 7.7700 7.8950 7.8950 7.9793 7.9793 8.1612 8.1612 8.3021 8.3021 8.9299 8.9299 9.2704 9.2704 10.3305 10.3305 12.1489 12.1489 13.1654 13.1654 15.0581 15.0581 15.3529 15.3529 15.8977 15.8977 15.9380 15.9380 k = 0.3929 0.2268 0.5541 ( 2933 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5508 -9.5508 -9.5415 -9.5415 -1.9993 -1.9993 -1.9986 -1.9986 -1.1579 -1.1579 -1.1502 -1.1502 -1.1432 -1.1432 6.0300 6.0300 7.2304 7.2304 7.3593 7.3593 7.4240 7.4240 7.5756 7.5756 7.7753 7.7753 7.8902 7.8902 7.9789 7.9789 8.1702 8.1702 8.3147 8.3147 8.9498 8.9498 9.3480 9.3480 10.2466 10.2466 12.1316 12.1316 13.1005 13.1005 15.0684 15.0684 15.3739 15.3739 15.8595 15.8595 15.8883 15.8883 k = 0.3884 0.2242 0.5686 ( 2939 PWs) bands (ev): -29.9310 -29.9310 -10.9702 -10.9702 -9.5508 -9.5508 -9.5416 -9.5416 -1.9995 -1.9995 -1.9986 -1.9986 -1.1581 -1.1581 -1.1504 -1.1504 -1.1433 -1.1433 6.0297 6.0297 7.2260 7.2260 7.3578 7.3578 7.4222 7.4222 7.5725 7.5725 7.7807 7.7807 7.8854 7.8854 7.9780 7.9780 8.1782 8.1782 8.3274 8.3274 8.9644 8.9644 9.4259 9.4259 10.1728 10.1728 12.1142 12.1142 13.0401 13.0401 15.0815 15.0815 15.3913 15.3913 15.8189 15.8189 15.8462 15.8462 k = 0.3839 0.2217 0.5832 ( 2937 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5509 -9.5509 -9.5416 -9.5416 -1.9997 -1.9997 -1.9987 -1.9987 -1.1583 -1.1583 -1.1505 -1.1505 -1.1433 -1.1433 6.0291 6.0291 7.2224 7.2224 7.3555 7.3555 7.4199 7.4199 7.5701 7.5701 7.7863 7.7863 7.8810 7.8810 7.9766 7.9766 8.1854 8.1854 8.3401 8.3401 8.9719 8.9719 9.5027 9.5027 10.1125 10.1125 12.0969 12.0969 12.9843 12.9843 15.0973 15.0973 15.4040 15.4040 15.7724 15.7724 15.8173 15.8173 k = 0.3795 0.2191 0.5978 ( 2946 PWs) bands (ev): -29.9310 -29.9310 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0000 -2.0000 -1.9987 -1.9987 -1.1586 -1.1586 -1.1507 -1.1507 -1.1433 -1.1433 6.0282 6.0282 7.2196 7.2196 7.3524 7.3524 7.4170 7.4170 7.5686 7.5686 7.7917 7.7917 7.8769 7.8769 7.9747 7.9747 8.1917 8.1917 8.3528 8.3528 8.9700 8.9700 9.5764 9.5764 10.0699 10.0699 12.0797 12.0797 12.9329 12.9329 15.1157 15.1157 15.4108 15.4108 15.7240 15.7240 15.7996 15.7996 k = 0.3750 0.2165 0.6124 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.6250-0.0722 0.4082 ( 2932 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5510 -9.5510 -9.5415 -9.5415 -2.0001 -2.0001 -1.9986 -1.9986 -1.1588 -1.1588 -1.1507 -1.1507 -1.1432 -1.1432 6.0270 6.0270 7.2176 7.2176 7.3484 7.3484 7.4135 7.4135 7.5682 7.5682 7.7969 7.7969 7.8737 7.8737 7.9722 7.9722 8.1974 8.1974 8.3655 8.3655 8.9571 8.9571 9.6440 9.6440 10.0498 10.0498 12.0627 12.0627 12.8858 12.8858 15.1362 15.1362 15.4109 15.4109 15.6765 15.6765 15.7920 15.7920 k = 0.6176-0.0849 0.4082 ( 2944 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5512 -9.5512 -9.5413 -9.5413 -2.0005 -2.0005 -1.9987 -1.9987 -1.1592 -1.1592 -1.1509 -1.1509 -1.1433 -1.1433 6.0241 6.0241 7.2149 7.2149 7.3408 7.3408 7.4067 7.4067 7.5696 7.5696 7.8048 7.8048 7.8692 7.8692 7.9672 7.9672 8.2059 8.2059 8.3860 8.3860 8.9223 8.9223 9.7543 9.7543 10.0379 10.0379 12.0357 12.0357 12.8131 12.8131 15.1704 15.1704 15.4065 15.4065 15.6015 15.6015 15.7838 15.7838 k = 0.6103-0.0976 0.4082 ( 2940 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5514 -9.5514 -9.5411 -9.5411 -2.0008 -2.0008 -1.9986 -1.9986 -1.1596 -1.1596 -1.1510 -1.1510 -1.1432 -1.1432 6.0206 6.0206 7.2125 7.2125 7.3332 7.3332 7.3995 7.3995 7.5734 7.5734 7.8129 7.8129 7.8649 7.8649 7.9619 7.9619 8.2141 8.2141 8.4059 8.4059 8.8828 8.8828 9.8718 9.8718 10.0275 10.0275 12.0102 12.0102 12.7432 12.7432 15.2022 15.2022 15.4032 15.4032 15.5308 15.5308 15.7675 15.7675 k = 0.6029-0.1104 0.4082 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5515 -9.5515 -9.5409 -9.5409 -2.0012 -2.0012 -1.9987 -1.9987 -1.1600 -1.1600 -1.1512 -1.1512 -1.1432 -1.1432 6.0167 6.0167 7.2105 7.2105 7.3257 7.3257 7.3918 7.3918 7.5794 7.5794 7.8210 7.8210 7.8609 7.8609 7.9562 7.9562 8.2220 8.2220 8.4247 8.4247 8.8417 8.8417 9.9845 9.9845 10.0276 10.0276 11.9862 11.9862 12.6757 12.6757 15.2314 15.2314 15.3982 15.3982 15.4674 15.4674 15.7423 15.7423 k = 0.5956-0.1231 0.4082 ( 2938 PWs) bands (ev): -29.9309 -29.9309 -10.9703 -10.9703 -9.5517 -9.5517 -9.5407 -9.5407 -2.0015 -2.0015 -1.9986 -1.9986 -1.1604 -1.1604 -1.1513 -1.1513 -1.1432 -1.1432 6.0124 6.0124 7.2087 7.2087 7.3186 7.3186 7.3840 7.3840 7.5874 7.5874 7.8289 7.8289 7.8573 7.8573 7.9504 7.9504 8.2295 8.2295 8.4416 8.4416 8.8009 8.8009 10.0006 10.0006 10.1282 10.1282 11.9637 11.9637 12.6103 12.6103 15.2579 15.2579 15.3750 15.3750 15.4279 15.4279 15.7079 15.7079 k = 0.5882-0.1358 0.4082 ( 2934 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5519 -9.5519 -9.5404 -9.5404 -2.0018 -2.0018 -1.9986 -1.9986 -1.1608 -1.1608 -1.1514 -1.1514 -1.1431 -1.1431 6.0079 6.0079 7.2072 7.2072 7.3120 7.3120 7.3762 7.3762 7.5972 7.5972 7.8362 7.8362 7.8543 7.8543 7.9444 7.9444 8.2367 8.2367 8.4556 8.4556 8.7621 8.7621 9.9929 9.9929 10.2552 10.2552 11.9428 11.9428 12.5467 12.5467 15.2803 15.2803 15.3256 15.3256 15.4214 15.4214 15.6645 15.6645 k = 0.5809-0.1486 0.4082 ( 2934 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5520 -9.5520 -9.5402 -9.5402 -2.0022 -2.0022 -1.9986 -1.9986 -1.1612 -1.1612 -1.1516 -1.1516 -1.1431 -1.1431 6.0032 6.0032 7.2058 7.2058 7.3061 7.3061 7.3684 7.3684 7.6085 7.6085 7.8419 7.8419 7.8529 7.8529 7.9386 7.9386 8.2435 8.2435 8.4652 8.4652 8.7271 8.7271 9.9848 9.9848 10.3841 10.3841 11.9234 11.9234 12.4844 12.4844 15.2653 15.2653 15.3074 15.3074 15.4237 15.4237 15.6133 15.6133 k = 0.5735-0.1613 0.4082 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5522 -9.5522 -9.5400 -9.5400 -2.0025 -2.0025 -1.9987 -1.9987 -1.1616 -1.1616 -1.1517 -1.1517 -1.1431 -1.1431 5.9986 5.9986 7.2046 7.2046 7.3010 7.3010 7.3608 7.3608 7.6212 7.6212 7.8433 7.8433 7.8552 7.8552 7.9331 7.9331 8.2497 8.2497 8.4686 8.4686 8.6982 8.6982 9.9771 9.9771 10.5133 10.5133 11.9056 11.9056 12.4230 12.4230 15.2154 15.2154 15.3238 15.3238 15.4285 15.4285 15.5561 15.5561 k = 0.5662-0.1741 0.4082 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5524 -9.5524 -9.5398 -9.5398 -2.0028 -2.0028 -1.9987 -1.9987 -1.1620 -1.1620 -1.1519 -1.1519 -1.1431 -1.1431 5.9940 5.9940 7.2035 7.2035 7.2968 7.2968 7.3534 7.3534 7.6352 7.6352 7.8419 7.8419 7.8597 7.8597 7.9285 7.9285 8.2555 8.2555 8.4641 8.4641 8.6774 8.6774 9.9701 9.9701 10.6417 10.6417 11.8893 11.8893 12.3618 12.3618 15.1679 15.1679 15.3382 15.3382 15.4336 15.4336 15.4965 15.4965 k = 0.5588-0.1868 0.4082 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5525 -9.5525 -9.5395 -9.5395 -2.0031 -2.0031 -1.9987 -1.9987 -1.1623 -1.1623 -1.1520 -1.1520 -1.1430 -1.1430 5.9897 5.9897 7.2025 7.2025 7.2936 7.2936 7.3462 7.3462 7.6501 7.6501 7.8399 7.8399 7.8633 7.8633 7.9253 7.9253 8.2607 8.2607 8.4512 8.4512 8.6655 8.6655 9.9638 9.9638 10.7687 10.7687 11.8747 11.8747 12.3005 12.3005 15.1245 15.1245 15.3465 15.3465 15.4247 15.4247 15.4534 15.4534 k = 0.5515-0.1995 0.4082 ( 2942 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5526 -9.5526 -9.5393 -9.5393 -2.0033 -2.0033 -1.9987 -1.9987 -1.1626 -1.1626 -1.1521 -1.1521 -1.1430 -1.1430 5.9857 5.9857 7.2015 7.2015 7.2912 7.2912 7.3393 7.3393 7.6658 7.6658 7.8379 7.8379 7.8646 7.8646 7.9242 7.9242 8.2655 8.2655 8.4314 8.4314 8.6611 8.6611 9.9582 9.9582 10.8932 10.8932 11.8616 11.8616 12.2385 12.2385 15.0858 15.0858 15.3319 15.3319 15.3928 15.3928 15.4545 15.4545 k = 0.5441-0.2123 0.4082 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9702 -10.9702 -9.5528 -9.5528 -9.5392 -9.5392 -2.0036 -2.0036 -1.9987 -1.9987 -1.1629 -1.1629 -1.1522 -1.1522 -1.1430 -1.1430 5.9820 5.9820 7.2006 7.2006 7.2898 7.2898 7.3327 7.3327 7.6818 7.6818 7.8361 7.8361 7.8631 7.8631 7.9256 7.9256 8.2698 8.2698 8.4077 8.4077 8.6618 8.6618 9.9533 9.9533 11.0146 11.0146 11.8501 11.8501 12.1752 12.1752 15.0518 15.0518 15.2834 15.2834 15.3897 15.3897 15.4611 15.4611 k = 0.5368-0.2250 0.4082 ( 2936 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5529 -9.5529 -9.5390 -9.5390 -2.0037 -2.0037 -1.9987 -1.9987 -1.1631 -1.1631 -1.1522 -1.1522 -1.1429 -1.1429 5.9788 5.9788 7.1998 7.1998 7.2893 7.2893 7.3266 7.3266 7.6979 7.6979 7.8345 7.8345 7.8591 7.8591 7.9291 7.9291 8.2737 8.2737 8.3829 8.3829 8.6650 8.6650 9.9491 9.9491 11.1319 11.1319 11.8401 11.8401 12.1103 12.1103 15.0228 15.0228 15.2295 15.2295 15.3947 15.3947 15.4678 15.4678 k = 0.5294-0.2377 0.4082 ( 2944 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5530 -9.5530 -9.5389 -9.5389 -2.0039 -2.0039 -1.9987 -1.9987 -1.1634 -1.1634 -1.1523 -1.1523 -1.1429 -1.1429 5.9761 5.9761 7.1990 7.1990 7.2895 7.2895 7.3208 7.3208 7.7134 7.7134 7.8332 7.8332 7.8533 7.8533 7.9337 7.9337 8.2772 8.2772 8.3590 8.3590 8.6691 8.6691 9.9457 9.9457 11.2439 11.2439 11.8314 11.8314 12.0438 12.0438 14.9989 14.9989 15.1805 15.1805 15.4000 15.4000 15.4738 15.4738 k = 0.5221-0.2505 0.4082 ( 2946 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5530 -9.5530 -9.5388 -9.5388 -2.0040 -2.0040 -1.9987 -1.9987 -1.1635 -1.1635 -1.1524 -1.1524 -1.1429 -1.1429 5.9740 5.9740 7.1984 7.1984 7.2905 7.2905 7.3156 7.3156 7.7278 7.7278 7.8321 7.8321 7.8466 7.8466 7.9385 7.9385 8.2807 8.2807 8.3378 8.3378 8.6731 8.6731 9.9431 9.9431 11.3489 11.3489 11.8234 11.8234 11.9769 11.9769 14.9802 14.9802 15.1398 15.1398 15.4044 15.4044 15.4787 15.4787 k = 0.5147-0.2632 0.4082 ( 2948 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5387 -9.5387 -2.0041 -2.0041 -1.9987 -1.9987 -1.1637 -1.1637 -1.1525 -1.1525 -1.1429 -1.1429 5.9724 5.9724 7.1980 7.1980 7.2920 7.2920 7.3110 7.3110 7.7399 7.7399 7.8311 7.8311 7.8402 7.8402 7.9427 7.9427 8.2843 8.2843 8.3204 8.3204 8.6763 8.6763 9.9412 9.9412 11.4435 11.4435 11.8142 11.8142 11.9139 11.9139 14.9668 14.9668 15.1095 15.1095 15.4077 15.4077 15.4824 15.4824 k = 0.5074-0.2759 0.4082 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0042 -2.0042 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1429 -1.1429 5.9714 5.9714 7.1977 7.1977 7.2936 7.2936 7.3076 7.3076 7.7484 7.7484 7.8300 7.8300 7.8356 7.8356 7.9456 7.9456 8.2885 8.2885 8.3073 8.3073 8.6784 8.6784 9.9401 9.9401 11.5190 11.5190 11.7983 11.7983 11.8680 11.8680 14.9587 14.9587 15.0907 15.0907 15.4096 15.4096 15.4846 15.4846 k = 0.5000-0.2887 0.4082 ( 2954 PWs) bands (ev): -29.9309 -29.9309 -10.9701 -10.9701 -9.5531 -9.5531 -9.5386 -9.5386 -2.0043 -2.0043 -1.9988 -1.9988 -1.1638 -1.1638 -1.1525 -1.1525 -1.1429 -1.1429 5.9711 5.9711 7.1976 7.1976 7.2944 7.2944 7.3062 7.3062 7.7516 7.7516 7.8293 7.8293 7.8342 7.8342 7.9466 7.9466 8.2919 8.2919 8.3009 8.3009 8.6791 8.6791 9.9397 9.9397 11.5517 11.5517 11.7845 11.7845 11.8537 11.8537 14.9560 14.9560 15.0844 15.0844 15.4103 15.4103 15.4854 15.4854 Writing output data file YInAg2.save init_run : 0.22s CPU 0.35s WALL ( 1 calls) electrons : 128.68s CPU 130.75s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.00s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 128.67s CPU 130.74s 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 : 0.06s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.04s WALL ( 308 calls) cegterg : 115.88s CPU 117.51s WALL ( 327 calls) Called by sum_band: Called by *egterg: h_psi : 66.94s CPU 68.08s WALL ( 5870 calls) s_psi : 4.45s CPU 4.43s WALL ( 5870 calls) g_psi : 0.17s CPU 0.14s WALL ( 5235 calls) cdiaghg : 44.34s CPU 44.92s WALL ( 5543 calls) cegterg:over : 3.97s CPU 4.13s WALL ( 5235 calls) cegterg:upda : 2.96s CPU 3.03s WALL ( 5235 calls) cegterg:last : 1.96s CPU 1.96s WALL ( 943 calls) cdiaghg:chol : 2.55s CPU 2.47s WALL ( 5543 calls) cdiaghg:inve : 1.55s CPU 1.70s WALL ( 5543 calls) cdiaghg:para : 2.64s CPU 2.73s WALL ( 11086 calls) Called by h_psi: h_psi:vloc : 57.92s CPU 58.88s WALL ( 5870 calls) h_psi:vnl : 8.90s CPU 9.05s WALL ( 5870 calls) add_vuspsi : 5.02s CPU 4.91s WALL ( 5870 calls) General routines calbec : 3.85s CPU 4.13s WALL ( 5870 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 54.33s CPU 55.28s WALL ( 719996 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.16s CPU 0.15s WALL ( 616 calls) Parallel routines fft_scatter : 19.43s CPU 19.98s WALL ( 720019 calls) PWSCF : 2m23.16s CPU 2m34.56s WALL This run was terminated on: 16:40:38 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=