Program PWSCF v.5.1.1 starts on 31Oct2015 at 20:17:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TaTl3Se4.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 68 46 13 2500 1392 207 Max 69 47 14 2505 1415 209 Sum 3305 2247 627 120167 67363 10005 bravais-lattice index = 14 lattice parameter (alat) = 12.8960 a.u. unit-cell volume = 1650.9927 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 76.00 number of Kohn-Sham states= 92 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 265.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.896020 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.333333 celldm(5)= -0.333333 celldm(6)= -0.333333 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.333333 0.942809 0.000000 ) a(3) = ( -0.333333 -0.471405 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.353553 0.612372 ) b(2) = ( 0.000000 1.060660 0.612372 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Tl read from file: /home/autes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 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 1281 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 Se read from file: /home/autes/Pseudo/Se_MT_PBE.UPF MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1211 points, 3 beta functions with: l(1) = 0 l(2) = 1 l(3) = 1 PseudoPot. # 3 for Ta read from file: /home/autes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf 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 1273 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 Tl 13.00 204.38330 Tl( 1.00) Se 6.00 78.96000 Se( 1.00) Ta 13.00 180.94790 Ta( 1.00) 2 Sym. Ops. (no 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 194 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 2) = ( 0.0125000 -0.0088388 0.0153093), wk = 0.0051546 k( 3) = ( 0.0250000 -0.0176777 0.0306186), wk = 0.0051546 k( 4) = ( 0.0375000 -0.0265165 0.0459279), wk = 0.0051546 k( 5) = ( 0.0500000 -0.0353553 0.0612372), wk = 0.0051546 k( 6) = ( 0.0625000 -0.0441942 0.0765466), wk = 0.0051546 k( 7) = ( 0.0750000 -0.0530330 0.0918559), wk = 0.0051546 k( 8) = ( 0.0875000 -0.0618718 0.1071652), wk = 0.0051546 k( 9) = ( 0.1000000 -0.0707107 0.1224745), wk = 0.0051546 k( 10) = ( 0.1125000 -0.0795495 0.1377838), wk = 0.0051546 k( 11) = ( 0.1250000 -0.0883883 0.1530931), wk = 0.0051546 k( 12) = ( 0.1375000 -0.0972272 0.1684024), wk = 0.0051546 k( 13) = ( 0.1500000 -0.1060660 0.1837117), wk = 0.0051546 k( 14) = ( 0.1625000 -0.1149049 0.1990210), wk = 0.0051546 k( 15) = ( 0.1750000 -0.1237437 0.2143304), wk = 0.0051546 k( 16) = ( 0.1875000 -0.1325825 0.2296397), wk = 0.0051546 k( 17) = ( 0.2000000 -0.1414214 0.2449490), wk = 0.0051546 k( 18) = ( 0.2125000 -0.1502602 0.2602583), wk = 0.0051546 k( 19) = ( 0.2250000 -0.1590990 0.2755676), wk = 0.0051546 k( 20) = ( 0.2375000 -0.1679379 0.2908769), wk = 0.0051546 k( 21) = ( 0.2500000 -0.1767767 0.3061862), wk = 0.0051546 k( 22) = ( 0.2625000 -0.1856155 0.3214955), wk = 0.0051546 k( 23) = ( 0.2750000 -0.1944544 0.3368048), wk = 0.0051546 k( 24) = ( 0.2875000 -0.2032932 0.3521142), wk = 0.0051546 k( 25) = ( 0.3000000 -0.2121320 0.3674235), wk = 0.0051546 k( 26) = ( 0.3125000 -0.2209709 0.3827328), wk = 0.0051546 k( 27) = ( 0.3250000 -0.2298097 0.3980421), wk = 0.0051546 k( 28) = ( 0.3375000 -0.2386485 0.4133514), wk = 0.0051546 k( 29) = ( 0.3500000 -0.2474874 0.4286607), wk = 0.0051546 k( 30) = ( 0.3625000 -0.2563262 0.4439700), wk = 0.0051546 k( 31) = ( 0.3750000 -0.2651650 0.4592793), wk = 0.0051546 k( 32) = ( 0.3875000 -0.2740039 0.4745886), wk = 0.0051546 k( 33) = ( 0.4000000 -0.2828427 0.4898979), wk = 0.0051546 k( 34) = ( 0.4125000 -0.2916815 0.5052073), wk = 0.0051546 k( 35) = ( 0.4250000 -0.3005204 0.5205166), wk = 0.0051546 k( 36) = ( 0.4375000 -0.3093592 0.5358259), wk = 0.0051546 k( 37) = ( 0.4500000 -0.3181981 0.5511352), wk = 0.0051546 k( 38) = ( 0.4625000 -0.3270369 0.5664445), wk = 0.0051546 k( 39) = ( 0.4750000 -0.3358757 0.5817538), wk = 0.0051546 k( 40) = ( 0.4875000 -0.3447146 0.5970631), wk = 0.0051546 k( 41) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051546 k( 42) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051546 k( 43) = ( 0.4827586 -0.3413619 0.6123724), wk = 0.0051546 k( 44) = ( 0.4655172 -0.3291704 0.6123724), wk = 0.0051546 k( 45) = ( 0.4482759 -0.3169789 0.6123724), wk = 0.0051546 k( 46) = ( 0.4310345 -0.3047874 0.6123724), wk = 0.0051546 k( 47) = ( 0.4137931 -0.2925959 0.6123724), wk = 0.0051546 k( 48) = ( 0.3965517 -0.2804044 0.6123724), wk = 0.0051546 k( 49) = ( 0.3793103 -0.2682129 0.6123724), wk = 0.0051546 k( 50) = ( 0.3620690 -0.2560214 0.6123724), wk = 0.0051546 k( 51) = ( 0.3448276 -0.2438299 0.6123724), wk = 0.0051546 k( 52) = ( 0.3275862 -0.2316384 0.6123724), wk = 0.0051546 k( 53) = ( 0.3103448 -0.2194469 0.6123724), wk = 0.0051546 k( 54) = ( 0.2931034 -0.2072554 0.6123724), wk = 0.0051546 k( 55) = ( 0.2758621 -0.1950639 0.6123724), wk = 0.0051546 k( 56) = ( 0.2586207 -0.1828724 0.6123724), wk = 0.0051546 k( 57) = ( 0.2413793 -0.1706809 0.6123724), wk = 0.0051546 k( 58) = ( 0.2241379 -0.1584895 0.6123724), wk = 0.0051546 k( 59) = ( 0.2068966 -0.1462980 0.6123724), wk = 0.0051546 k( 60) = ( 0.1896552 -0.1341065 0.6123724), wk = 0.0051546 k( 61) = ( 0.1724138 -0.1219150 0.6123724), wk = 0.0051546 k( 62) = ( 0.1551724 -0.1097235 0.6123724), wk = 0.0051546 k( 63) = ( 0.1379310 -0.0975320 0.6123724), wk = 0.0051546 k( 64) = ( 0.1206897 -0.0853405 0.6123724), wk = 0.0051546 k( 65) = ( 0.1034483 -0.0731490 0.6123724), wk = 0.0051546 k( 66) = ( 0.0862069 -0.0609575 0.6123724), wk = 0.0051546 k( 67) = ( 0.0689655 -0.0487660 0.6123724), wk = 0.0051546 k( 68) = ( 0.0517241 -0.0365745 0.6123724), wk = 0.0051546 k( 69) = ( 0.0344828 -0.0243830 0.6123724), wk = 0.0051546 k( 70) = ( 0.0172414 -0.0121915 0.6123724), wk = 0.0051546 k( 71) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051546 k( 72) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051546 k( 73) = ( 0.0000000 0.0000000 0.5912561), wk = 0.0051546 k( 74) = ( 0.0000000 0.0000000 0.5701399), wk = 0.0051546 k( 75) = ( 0.0000000 0.0000000 0.5490236), wk = 0.0051546 k( 76) = ( 0.0000000 0.0000000 0.5279073), wk = 0.0051546 k( 77) = ( 0.0000000 0.0000000 0.5067910), wk = 0.0051546 k( 78) = ( 0.0000000 0.0000000 0.4856747), wk = 0.0051546 k( 79) = ( 0.0000000 0.0000000 0.4645584), wk = 0.0051546 k( 80) = ( 0.0000000 0.0000000 0.4434421), wk = 0.0051546 k( 81) = ( 0.0000000 0.0000000 0.4223258), wk = 0.0051546 k( 82) = ( 0.0000000 0.0000000 0.4012095), wk = 0.0051546 k( 83) = ( 0.0000000 0.0000000 0.3800932), wk = 0.0051546 k( 84) = ( 0.0000000 0.0000000 0.3589769), wk = 0.0051546 k( 85) = ( 0.0000000 0.0000000 0.3378607), wk = 0.0051546 k( 86) = ( 0.0000000 0.0000000 0.3167444), wk = 0.0051546 k( 87) = ( 0.0000000 0.0000000 0.2956281), wk = 0.0051546 k( 88) = ( 0.0000000 0.0000000 0.2745118), wk = 0.0051546 k( 89) = ( 0.0000000 0.0000000 0.2533955), wk = 0.0051546 k( 90) = ( 0.0000000 0.0000000 0.2322792), wk = 0.0051546 k( 91) = ( 0.0000000 0.0000000 0.2111629), wk = 0.0051546 k( 92) = ( 0.0000000 0.0000000 0.1900466), wk = 0.0051546 k( 93) = ( 0.0000000 0.0000000 0.1689303), wk = 0.0051546 k( 94) = ( 0.0000000 0.0000000 0.1478140), wk = 0.0051546 k( 95) = ( 0.0000000 0.0000000 0.1266978), wk = 0.0051546 k( 96) = ( 0.0000000 0.0000000 0.1055815), wk = 0.0051546 k( 97) = ( 0.0000000 0.0000000 0.0844652), wk = 0.0051546 k( 98) = ( 0.0000000 0.0000000 0.0633489), wk = 0.0051546 k( 99) = ( 0.0000000 0.0000000 0.0422326), wk = 0.0051546 k( 100) = ( 0.0000000 0.0000000 0.0211163), wk = 0.0051546 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 103) = ( 0.0071429 0.0101015 0.0174964), wk = 0.0051546 k( 104) = ( 0.0142857 0.0202030 0.0349927), wk = 0.0051546 k( 105) = ( 0.0214286 0.0303046 0.0524891), wk = 0.0051546 k( 106) = ( 0.0285714 0.0404061 0.0699854), wk = 0.0051546 k( 107) = ( 0.0357143 0.0505076 0.0874818), wk = 0.0051546 k( 108) = ( 0.0428571 0.0606091 0.1049781), wk = 0.0051546 k( 109) = ( 0.0500000 0.0707107 0.1224745), wk = 0.0051546 k( 110) = ( 0.0571429 0.0808122 0.1399708), wk = 0.0051546 k( 111) = ( 0.0642857 0.0909137 0.1574672), wk = 0.0051546 k( 112) = ( 0.0714286 0.1010153 0.1749635), wk = 0.0051546 k( 113) = ( 0.0785714 0.1111168 0.1924599), wk = 0.0051546 k( 114) = ( 0.0857143 0.1212183 0.2099563), wk = 0.0051546 k( 115) = ( 0.0928571 0.1313198 0.2274526), wk = 0.0051546 k( 116) = ( 0.1000000 0.1414214 0.2449490), wk = 0.0051546 k( 117) = ( 0.1071429 0.1515229 0.2624453), wk = 0.0051546 k( 118) = ( 0.1142857 0.1616244 0.2799417), wk = 0.0051546 k( 119) = ( 0.1214286 0.1717259 0.2974380), wk = 0.0051546 k( 120) = ( 0.1285714 0.1818275 0.3149344), wk = 0.0051546 k( 121) = ( 0.1357143 0.1919290 0.3324308), wk = 0.0051546 k( 122) = ( 0.1428571 0.2020305 0.3499271), wk = 0.0051546 k( 123) = ( 0.1500000 0.2121320 0.3674235), wk = 0.0051546 k( 124) = ( 0.1571429 0.2222336 0.3849198), wk = 0.0051546 k( 125) = ( 0.1642857 0.2323351 0.4024162), wk = 0.0051546 k( 126) = ( 0.1714286 0.2424366 0.4199125), wk = 0.0051546 k( 127) = ( 0.1785714 0.2525381 0.4374089), wk = 0.0051546 k( 128) = ( 0.1857143 0.2626397 0.4549052), wk = 0.0051546 k( 129) = ( 0.1928571 0.2727412 0.4724016), wk = 0.0051546 k( 130) = ( 0.2000000 0.2828427 0.4898979), wk = 0.0051546 k( 131) = ( 0.2071429 0.2929442 0.5073943), wk = 0.0051546 k( 132) = ( 0.2142857 0.3030458 0.5248906), wk = 0.0051546 k( 133) = ( 0.2214286 0.3131473 0.5423870), wk = 0.0051546 k( 134) = ( 0.2285714 0.3232488 0.5598834), wk = 0.0051546 k( 135) = ( 0.2357143 0.3333503 0.5773797), wk = 0.0051546 k( 136) = ( 0.2428571 0.3434519 0.5948761), wk = 0.0051546 k( 137) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051546 k( 138) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051546 k( 139) = ( 0.2571429 0.3333503 0.6123724), wk = 0.0051546 k( 140) = ( 0.2642857 0.3131473 0.6123724), wk = 0.0051546 k( 141) = ( 0.2714286 0.2929442 0.6123724), wk = 0.0051546 k( 142) = ( 0.2785714 0.2727412 0.6123724), wk = 0.0051546 k( 143) = ( 0.2857143 0.2525381 0.6123724), wk = 0.0051546 k( 144) = ( 0.2928571 0.2323351 0.6123724), wk = 0.0051546 k( 145) = ( 0.3000000 0.2121320 0.6123724), wk = 0.0051546 k( 146) = ( 0.3071429 0.1919290 0.6123724), wk = 0.0051546 k( 147) = ( 0.3142857 0.1717259 0.6123724), wk = 0.0051546 k( 148) = ( 0.3214286 0.1515229 0.6123724), wk = 0.0051546 k( 149) = ( 0.3285714 0.1313198 0.6123724), wk = 0.0051546 k( 150) = ( 0.3357143 0.1111168 0.6123724), wk = 0.0051546 k( 151) = ( 0.3428571 0.0909137 0.6123724), wk = 0.0051546 k( 152) = ( 0.3500000 0.0707107 0.6123724), wk = 0.0051546 k( 153) = ( 0.3571429 0.0505076 0.6123724), wk = 0.0051546 k( 154) = ( 0.3642857 0.0303046 0.6123724), wk = 0.0051546 k( 155) = ( 0.3714286 0.0101015 0.6123724), wk = 0.0051546 k( 156) = ( 0.3785714 -0.0101015 0.6123724), wk = 0.0051546 k( 157) = ( 0.3857143 -0.0303046 0.6123724), wk = 0.0051546 k( 158) = ( 0.3928571 -0.0505076 0.6123724), wk = 0.0051546 k( 159) = ( 0.4000000 -0.0707107 0.6123724), wk = 0.0051546 k( 160) = ( 0.4071429 -0.0909137 0.6123724), wk = 0.0051546 k( 161) = ( 0.4142857 -0.1111168 0.6123724), wk = 0.0051546 k( 162) = ( 0.4214286 -0.1313198 0.6123724), wk = 0.0051546 k( 163) = ( 0.4285714 -0.1515229 0.6123724), wk = 0.0051546 k( 164) = ( 0.4357143 -0.1717259 0.6123724), wk = 0.0051546 k( 165) = ( 0.4428571 -0.1919290 0.6123724), wk = 0.0051546 k( 166) = ( 0.4500000 -0.2121320 0.6123724), wk = 0.0051546 k( 167) = ( 0.4571429 -0.2323351 0.6123724), wk = 0.0051546 k( 168) = ( 0.4642857 -0.2525381 0.6123724), wk = 0.0051546 k( 169) = ( 0.4714286 -0.2727412 0.6123724), wk = 0.0051546 k( 170) = ( 0.4785714 -0.2929442 0.6123724), wk = 0.0051546 k( 171) = ( 0.4857143 -0.3131473 0.6123724), wk = 0.0051546 k( 172) = ( 0.4928571 -0.3333503 0.6123724), wk = 0.0051546 k( 173) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0051546 k( 174) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0051546 k( 175) = ( 0.2375000 0.3358757 0.6123724), wk = 0.0051546 k( 176) = ( 0.2250000 0.3181981 0.6123724), wk = 0.0051546 k( 177) = ( 0.2125000 0.3005204 0.6123724), wk = 0.0051546 k( 178) = ( 0.2000000 0.2828427 0.6123724), wk = 0.0051546 k( 179) = ( 0.1875000 0.2651650 0.6123724), wk = 0.0051546 k( 180) = ( 0.1750000 0.2474874 0.6123724), wk = 0.0051546 k( 181) = ( 0.1625000 0.2298097 0.6123724), wk = 0.0051546 k( 182) = ( 0.1500000 0.2121320 0.6123724), wk = 0.0051546 k( 183) = ( 0.1375000 0.1944544 0.6123724), wk = 0.0051546 k( 184) = ( 0.1250000 0.1767767 0.6123724), wk = 0.0051546 k( 185) = ( 0.1125000 0.1590990 0.6123724), wk = 0.0051546 k( 186) = ( 0.1000000 0.1414214 0.6123724), wk = 0.0051546 k( 187) = ( 0.0875000 0.1237437 0.6123724), wk = 0.0051546 k( 188) = ( 0.0750000 0.1060660 0.6123724), wk = 0.0051546 k( 189) = ( 0.0625000 0.0883883 0.6123724), wk = 0.0051546 k( 190) = ( 0.0500000 0.0707107 0.6123724), wk = 0.0051546 k( 191) = ( 0.0375000 0.0530330 0.6123724), wk = 0.0051546 k( 192) = ( 0.0250000 0.0353553 0.6123724), wk = 0.0051546 k( 193) = ( 0.0125000 0.0176777 0.6123724), wk = 0.0051546 k( 194) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0051546 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 2) = ( 0.0125000 -0.0125000 0.0125000), wk = 0.0051546 k( 3) = ( 0.0250000 -0.0250000 0.0250000), wk = 0.0051546 k( 4) = ( 0.0375000 -0.0375000 0.0375000), wk = 0.0051546 k( 5) = ( 0.0500000 -0.0500000 0.0500000), wk = 0.0051546 k( 6) = ( 0.0625000 -0.0625000 0.0625000), wk = 0.0051546 k( 7) = ( 0.0750000 -0.0750000 0.0750000), wk = 0.0051546 k( 8) = ( 0.0875000 -0.0875000 0.0875000), wk = 0.0051546 k( 9) = ( 0.1000000 -0.1000000 0.1000000), wk = 0.0051546 k( 10) = ( 0.1125000 -0.1125000 0.1125000), wk = 0.0051546 k( 11) = ( 0.1250000 -0.1250000 0.1250000), wk = 0.0051546 k( 12) = ( 0.1375000 -0.1375000 0.1375000), wk = 0.0051546 k( 13) = ( 0.1500000 -0.1500000 0.1500000), wk = 0.0051546 k( 14) = ( 0.1625000 -0.1625000 0.1625000), wk = 0.0051546 k( 15) = ( 0.1750000 -0.1750000 0.1750000), wk = 0.0051546 k( 16) = ( 0.1875000 -0.1875000 0.1875000), wk = 0.0051546 k( 17) = ( 0.2000000 -0.2000000 0.2000000), wk = 0.0051546 k( 18) = ( 0.2125000 -0.2125000 0.2125000), wk = 0.0051546 k( 19) = ( 0.2250000 -0.2250000 0.2250000), wk = 0.0051546 k( 20) = ( 0.2375000 -0.2375000 0.2375000), wk = 0.0051546 k( 21) = ( 0.2500000 -0.2500000 0.2500000), wk = 0.0051546 k( 22) = ( 0.2625000 -0.2625000 0.2625000), wk = 0.0051546 k( 23) = ( 0.2750000 -0.2750000 0.2750000), wk = 0.0051546 k( 24) = ( 0.2875000 -0.2875000 0.2875000), wk = 0.0051546 k( 25) = ( 0.3000000 -0.3000000 0.3000000), wk = 0.0051546 k( 26) = ( 0.3125000 -0.3125000 0.3125000), wk = 0.0051546 k( 27) = ( 0.3250000 -0.3250000 0.3250000), wk = 0.0051546 k( 28) = ( 0.3375000 -0.3375000 0.3375000), wk = 0.0051546 k( 29) = ( 0.3500000 -0.3500000 0.3500000), wk = 0.0051546 k( 30) = ( 0.3625000 -0.3625000 0.3625000), wk = 0.0051546 k( 31) = ( 0.3750000 -0.3750000 0.3750000), wk = 0.0051546 k( 32) = ( 0.3875000 -0.3875000 0.3875000), wk = 0.0051546 k( 33) = ( 0.4000000 -0.4000000 0.4000000), wk = 0.0051546 k( 34) = ( 0.4125000 -0.4125000 0.4125000), wk = 0.0051546 k( 35) = ( 0.4250000 -0.4250000 0.4250000), wk = 0.0051546 k( 36) = ( 0.4375000 -0.4375000 0.4375000), wk = 0.0051546 k( 37) = ( 0.4500000 -0.4500000 0.4500000), wk = 0.0051546 k( 38) = ( 0.4625000 -0.4625000 0.4625000), wk = 0.0051546 k( 39) = ( 0.4750000 -0.4750000 0.4750000), wk = 0.0051546 k( 40) = ( 0.4875000 -0.4875000 0.4875000), wk = 0.0051546 k( 41) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051546 k( 42) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051546 k( 43) = ( 0.4827586 -0.4827586 0.5000000), wk = 0.0051546 k( 44) = ( 0.4655172 -0.4655172 0.5000000), wk = 0.0051546 k( 45) = ( 0.4482759 -0.4482759 0.5000000), wk = 0.0051546 k( 46) = ( 0.4310345 -0.4310345 0.5000000), wk = 0.0051546 k( 47) = ( 0.4137931 -0.4137931 0.5000000), wk = 0.0051546 k( 48) = ( 0.3965517 -0.3965517 0.5000000), wk = 0.0051546 k( 49) = ( 0.3793103 -0.3793103 0.5000000), wk = 0.0051546 k( 50) = ( 0.3620690 -0.3620690 0.5000000), wk = 0.0051546 k( 51) = ( 0.3448276 -0.3448276 0.5000000), wk = 0.0051546 k( 52) = ( 0.3275862 -0.3275862 0.5000000), wk = 0.0051546 k( 53) = ( 0.3103448 -0.3103448 0.5000000), wk = 0.0051546 k( 54) = ( 0.2931034 -0.2931034 0.5000000), wk = 0.0051546 k( 55) = ( 0.2758621 -0.2758621 0.5000000), wk = 0.0051546 k( 56) = ( 0.2586207 -0.2586207 0.5000000), wk = 0.0051546 k( 57) = ( 0.2413793 -0.2413793 0.5000000), wk = 0.0051546 k( 58) = ( 0.2241379 -0.2241379 0.5000000), wk = 0.0051546 k( 59) = ( 0.2068966 -0.2068966 0.5000000), wk = 0.0051546 k( 60) = ( 0.1896552 -0.1896552 0.5000000), wk = 0.0051546 k( 61) = ( 0.1724138 -0.1724138 0.5000000), wk = 0.0051546 k( 62) = ( 0.1551724 -0.1551724 0.5000000), wk = 0.0051546 k( 63) = ( 0.1379310 -0.1379310 0.5000000), wk = 0.0051546 k( 64) = ( 0.1206897 -0.1206897 0.5000000), wk = 0.0051546 k( 65) = ( 0.1034483 -0.1034483 0.5000000), wk = 0.0051546 k( 66) = ( 0.0862069 -0.0862069 0.5000000), wk = 0.0051546 k( 67) = ( 0.0689655 -0.0689655 0.5000000), wk = 0.0051546 k( 68) = ( 0.0517241 -0.0517241 0.5000000), wk = 0.0051546 k( 69) = ( 0.0344828 -0.0344828 0.5000000), wk = 0.0051546 k( 70) = ( 0.0172414 -0.0172414 0.5000000), wk = 0.0051546 k( 71) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051546 k( 72) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051546 k( 73) = ( 0.0000000 0.0000000 0.4827586), wk = 0.0051546 k( 74) = ( 0.0000000 0.0000000 0.4655172), wk = 0.0051546 k( 75) = ( 0.0000000 0.0000000 0.4482759), wk = 0.0051546 k( 76) = ( 0.0000000 0.0000000 0.4310345), wk = 0.0051546 k( 77) = ( 0.0000000 0.0000000 0.4137931), wk = 0.0051546 k( 78) = ( 0.0000000 0.0000000 0.3965517), wk = 0.0051546 k( 79) = ( 0.0000000 0.0000000 0.3793103), wk = 0.0051546 k( 80) = ( 0.0000000 0.0000000 0.3620690), wk = 0.0051546 k( 81) = ( 0.0000000 0.0000000 0.3448276), wk = 0.0051546 k( 82) = ( 0.0000000 0.0000000 0.3275862), wk = 0.0051546 k( 83) = ( 0.0000000 0.0000000 0.3103448), wk = 0.0051546 k( 84) = ( 0.0000000 0.0000000 0.2931034), wk = 0.0051546 k( 85) = ( 0.0000000 0.0000000 0.2758621), wk = 0.0051546 k( 86) = ( 0.0000000 0.0000000 0.2586207), wk = 0.0051546 k( 87) = ( 0.0000000 0.0000000 0.2413793), wk = 0.0051546 k( 88) = ( 0.0000000 0.0000000 0.2241379), wk = 0.0051546 k( 89) = ( 0.0000000 0.0000000 0.2068966), wk = 0.0051546 k( 90) = ( 0.0000000 0.0000000 0.1896552), wk = 0.0051546 k( 91) = ( 0.0000000 0.0000000 0.1724138), wk = 0.0051546 k( 92) = ( 0.0000000 0.0000000 0.1551724), wk = 0.0051546 k( 93) = ( 0.0000000 0.0000000 0.1379310), wk = 0.0051546 k( 94) = ( 0.0000000 0.0000000 0.1206897), wk = 0.0051546 k( 95) = ( 0.0000000 0.0000000 0.1034483), wk = 0.0051546 k( 96) = ( 0.0000000 0.0000000 0.0862069), wk = 0.0051546 k( 97) = ( 0.0000000 0.0000000 0.0689655), wk = 0.0051546 k( 98) = ( 0.0000000 0.0000000 0.0517241), wk = 0.0051546 k( 99) = ( 0.0000000 0.0000000 0.0344828), wk = 0.0051546 k( 100) = ( 0.0000000 0.0000000 0.0172414), wk = 0.0051546 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0051546 k( 103) = ( 0.0071429 0.0071429 0.0071429), wk = 0.0051546 k( 104) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0051546 k( 105) = ( 0.0214286 0.0214286 0.0214286), wk = 0.0051546 k( 106) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0051546 k( 107) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0051546 k( 108) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0051546 k( 109) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0051546 k( 110) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0051546 k( 111) = ( 0.0642857 0.0642857 0.0642857), wk = 0.0051546 k( 112) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0051546 k( 113) = ( 0.0785714 0.0785714 0.0785714), wk = 0.0051546 k( 114) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0051546 k( 115) = ( 0.0928571 0.0928571 0.0928571), wk = 0.0051546 k( 116) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0051546 k( 117) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0051546 k( 118) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0051546 k( 119) = ( 0.1214286 0.1214286 0.1214286), wk = 0.0051546 k( 120) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0051546 k( 121) = ( 0.1357143 0.1357143 0.1357143), wk = 0.0051546 k( 122) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0051546 k( 123) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0051546 k( 124) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0051546 k( 125) = ( 0.1642857 0.1642857 0.1642857), wk = 0.0051546 k( 126) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0051546 k( 127) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0051546 k( 128) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0051546 k( 129) = ( 0.1928571 0.1928571 0.1928571), wk = 0.0051546 k( 130) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0051546 k( 131) = ( 0.2071429 0.2071429 0.2071429), wk = 0.0051546 k( 132) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0051546 k( 133) = ( 0.2214286 0.2214286 0.2214286), wk = 0.0051546 k( 134) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0051546 k( 135) = ( 0.2357143 0.2357143 0.2357143), wk = 0.0051546 k( 136) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0051546 k( 137) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051546 k( 138) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051546 k( 139) = ( 0.2571429 0.2285714 0.2571429), wk = 0.0051546 k( 140) = ( 0.2642857 0.2071429 0.2642857), wk = 0.0051546 k( 141) = ( 0.2714286 0.1857143 0.2714286), wk = 0.0051546 k( 142) = ( 0.2785714 0.1642857 0.2785714), wk = 0.0051546 k( 143) = ( 0.2857143 0.1428571 0.2857143), wk = 0.0051546 k( 144) = ( 0.2928571 0.1214286 0.2928571), wk = 0.0051546 k( 145) = ( 0.3000000 0.1000000 0.3000000), wk = 0.0051546 k( 146) = ( 0.3071429 0.0785714 0.3071429), wk = 0.0051546 k( 147) = ( 0.3142857 0.0571429 0.3142857), wk = 0.0051546 k( 148) = ( 0.3214286 0.0357143 0.3214286), wk = 0.0051546 k( 149) = ( 0.3285714 0.0142857 0.3285714), wk = 0.0051546 k( 150) = ( 0.3357143 -0.0071429 0.3357143), wk = 0.0051546 k( 151) = ( 0.3428571 -0.0285714 0.3428571), wk = 0.0051546 k( 152) = ( 0.3500000 -0.0500000 0.3500000), wk = 0.0051546 k( 153) = ( 0.3571429 -0.0714286 0.3571429), wk = 0.0051546 k( 154) = ( 0.3642857 -0.0928571 0.3642857), wk = 0.0051546 k( 155) = ( 0.3714286 -0.1142857 0.3714286), wk = 0.0051546 k( 156) = ( 0.3785714 -0.1357143 0.3785714), wk = 0.0051546 k( 157) = ( 0.3857143 -0.1571429 0.3857143), wk = 0.0051546 k( 158) = ( 0.3928571 -0.1785714 0.3928571), wk = 0.0051546 k( 159) = ( 0.4000000 -0.2000000 0.4000000), wk = 0.0051546 k( 160) = ( 0.4071429 -0.2214286 0.4071429), wk = 0.0051546 k( 161) = ( 0.4142857 -0.2428571 0.4142857), wk = 0.0051546 k( 162) = ( 0.4214286 -0.2642857 0.4214286), wk = 0.0051546 k( 163) = ( 0.4285714 -0.2857143 0.4285714), wk = 0.0051546 k( 164) = ( 0.4357143 -0.3071429 0.4357143), wk = 0.0051546 k( 165) = ( 0.4428571 -0.3285714 0.4428571), wk = 0.0051546 k( 166) = ( 0.4500000 -0.3500000 0.4500000), wk = 0.0051546 k( 167) = ( 0.4571429 -0.3714286 0.4571429), wk = 0.0051546 k( 168) = ( 0.4642857 -0.3928571 0.4642857), wk = 0.0051546 k( 169) = ( 0.4714286 -0.4142857 0.4714286), wk = 0.0051546 k( 170) = ( 0.4785714 -0.4357143 0.4785714), wk = 0.0051546 k( 171) = ( 0.4857143 -0.4571429 0.4857143), wk = 0.0051546 k( 172) = ( 0.4928571 -0.4785714 0.4928571), wk = 0.0051546 k( 173) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0051546 k( 174) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0051546 k( 175) = ( 0.2375000 0.2375000 0.2625000), wk = 0.0051546 k( 176) = ( 0.2250000 0.2250000 0.2750000), wk = 0.0051546 k( 177) = ( 0.2125000 0.2125000 0.2875000), wk = 0.0051546 k( 178) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0051546 k( 179) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0051546 k( 180) = ( 0.1750000 0.1750000 0.3250000), wk = 0.0051546 k( 181) = ( 0.1625000 0.1625000 0.3375000), wk = 0.0051546 k( 182) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0051546 k( 183) = ( 0.1375000 0.1375000 0.3625000), wk = 0.0051546 k( 184) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0051546 k( 185) = ( 0.1125000 0.1125000 0.3875000), wk = 0.0051546 k( 186) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0051546 k( 187) = ( 0.0875000 0.0875000 0.4125000), wk = 0.0051546 k( 188) = ( 0.0750000 0.0750000 0.4250000), wk = 0.0051546 k( 189) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0051546 k( 190) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0051546 k( 191) = ( 0.0375000 0.0375000 0.4625000), wk = 0.0051546 k( 192) = ( 0.0250000 0.0250000 0.4750000), wk = 0.0051546 k( 193) = ( 0.0125000 0.0125000 0.4875000), wk = 0.0051546 k( 194) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0051546 Dense grid: 120167 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 67363 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.52 Mb ( 368, 92) NL pseudopotentials 0.46 Mb ( 184, 164) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2505) G-vector shells 0.00 Mb ( 504) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.07 Mb ( 368, 368) Each subspace H/S matrix 2.07 Mb ( 368, 368) Each matrix 0.46 Mb ( 164, 2, 92) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./TaTl3Se4.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.6 secs Computing kpt #: 2 total cpu time spent up to now is 54.6 secs Computing kpt #: 3 total cpu time spent up to now is 60.5 secs Computing kpt #: 4 total cpu time spent up to now is 66.4 secs Computing kpt #: 5 total cpu time spent up to now is 72.3 secs Computing kpt #: 6 total cpu time spent up to now is 77.7 secs Computing kpt #: 7 total cpu time spent up to now is 83.2 secs Computing kpt #: 8 total cpu time spent up to now is 89.0 secs Computing kpt #: 9 total cpu time spent up to now is 95.7 secs Computing kpt #: 10 total cpu time spent up to now is 101.8 secs Computing kpt #: 11 total cpu time spent up to now is 108.4 secs Computing kpt #: 12 total cpu time spent up to now is 114.6 secs Computing kpt #: 13 total cpu time spent up to now is 120.7 secs Computing kpt #: 14 total cpu time spent up to now is 126.9 secs Computing kpt #: 15 total cpu time spent up to now is 133.1 secs Computing kpt #: 16 total cpu time spent up to now is 139.3 secs Computing kpt #: 17 total cpu time spent up to now is 145.6 secs Computing kpt #: 18 total cpu time spent up to now is 151.8 secs Computing kpt #: 19 total cpu time spent up to now is 157.9 secs Computing kpt #: 20 total cpu time spent up to now is 164.0 secs Computing kpt #: 21 total cpu time spent up to now is 170.0 secs Computing kpt #: 22 total cpu time spent up to now is 176.1 secs Computing kpt #: 23 total cpu time spent up to now is 182.2 secs Computing kpt #: 24 total cpu time spent up to now is 188.3 secs Computing kpt #: 25 total cpu time spent up to now is 194.5 secs Computing kpt #: 26 total cpu time spent up to now is 200.6 secs Computing kpt #: 27 total cpu time spent up to now is 206.7 secs Computing kpt #: 28 total cpu time spent up to now is 212.6 secs Computing kpt #: 29 total cpu time spent up to now is 218.7 secs Computing kpt #: 30 total cpu time spent up to now is 224.6 secs Computing kpt #: 31 total cpu time spent up to now is 230.7 secs Computing kpt #: 32 total cpu time spent up to now is 236.8 secs Computing kpt #: 33 total cpu time spent up to now is 242.9 secs Computing kpt #: 34 total cpu time spent up to now is 248.5 secs Computing kpt #: 35 total cpu time spent up to now is 254.9 secs Computing kpt #: 36 total cpu time spent up to now is 260.4 secs Computing kpt #: 37 total cpu time spent up to now is 265.8 secs Computing kpt #: 38 total cpu time spent up to now is 271.3 secs Computing kpt #: 39 total cpu time spent up to now is 276.8 secs Computing kpt #: 40 total cpu time spent up to now is 282.4 secs Computing kpt #: 41 total cpu time spent up to now is 287.9 secs Computing kpt #: 42 total cpu time spent up to now is 293.3 secs Computing kpt #: 43 total cpu time spent up to now is 298.6 secs Computing kpt #: 44 total cpu time spent up to now is 304.1 secs Computing kpt #: 45 total cpu time spent up to now is 309.6 secs Computing kpt #: 46 total cpu time spent up to now is 315.2 secs Computing kpt #: 47 total cpu time spent up to now is 320.9 secs Computing kpt #: 48 total cpu time spent up to now is 328.4 secs Computing kpt #: 49 total cpu time spent up to now is 335.2 secs Computing kpt #: 50 total cpu time spent up to now is 341.3 secs Computing kpt #: 51 total cpu time spent up to now is 347.5 secs Computing kpt #: 52 total cpu time spent up to now is 353.6 secs Computing kpt #: 53 total cpu time spent up to now is 359.2 secs Computing kpt #: 54 total cpu time spent up to now is 365.3 secs Computing kpt #: 55 total cpu time spent up to now is 371.5 secs Computing kpt #: 56 total cpu time spent up to now is 377.7 secs Computing kpt #: 57 total cpu time spent up to now is 383.9 secs Computing kpt #: 58 total cpu time spent up to now is 390.6 secs Computing kpt #: 59 total cpu time spent up to now is 397.8 secs Computing kpt #: 60 total cpu time spent up to now is 403.9 secs Computing kpt #: 61 total cpu time spent up to now is 409.9 secs Computing kpt #: 62 total cpu time spent up to now is 417.9 secs Computing kpt #: 63 total cpu time spent up to now is 424.1 secs Computing kpt #: 64 total cpu time spent up to now is 430.4 secs Computing kpt #: 65 total cpu time spent up to now is 436.7 secs Computing kpt #: 66 total cpu time spent up to now is 443.2 secs Computing kpt #: 67 total cpu time spent up to now is 449.5 secs Computing kpt #: 68 total cpu time spent up to now is 456.1 secs Computing kpt #: 69 total cpu time spent up to now is 462.9 secs Computing kpt #: 70 total cpu time spent up to now is 471.8 secs Computing kpt #: 71 total cpu time spent up to now is 478.9 secs Computing kpt #: 72 total cpu time spent up to now is 485.4 secs Computing kpt #: 73 total cpu time spent up to now is 492.3 secs Computing kpt #: 74 total cpu time spent up to now is 498.9 secs Computing kpt #: 75 total cpu time spent up to now is 505.5 secs Computing kpt #: 76 total cpu time spent up to now is 512.0 secs Computing kpt #: 77 total cpu time spent up to now is 518.4 secs Computing kpt #: 78 total cpu time spent up to now is 524.9 secs Computing kpt #: 79 total cpu time spent up to now is 531.2 secs Computing kpt #: 80 total cpu time spent up to now is 538.2 secs Computing kpt #: 81 total cpu time spent up to now is 544.6 secs Computing kpt #: 82 total cpu time spent up to now is 551.0 secs Computing kpt #: 83 total cpu time spent up to now is 557.3 secs Computing kpt #: 84 total cpu time spent up to now is 563.6 secs Computing kpt #: 85 total cpu time spent up to now is 569.8 secs Computing kpt #: 86 total cpu time spent up to now is 576.1 secs Computing kpt #: 87 total cpu time spent up to now is 582.3 secs Computing kpt #: 88 total cpu time spent up to now is 588.6 secs Computing kpt #: 89 total cpu time spent up to now is 594.8 secs Computing kpt #: 90 total cpu time spent up to now is 601.0 secs Computing kpt #: 91 total cpu time spent up to now is 607.1 secs Computing kpt #: 92 total cpu time spent up to now is 612.7 secs Computing kpt #: 93 total cpu time spent up to now is 618.3 secs Computing kpt #: 94 total cpu time spent up to now is 623.8 secs Computing kpt #: 95 total cpu time spent up to now is 629.4 secs Computing kpt #: 96 total cpu time spent up to now is 635.5 secs Computing kpt #: 97 total cpu time spent up to now is 640.9 secs Computing kpt #: 98 total cpu time spent up to now is 646.9 secs Computing kpt #: 99 total cpu time spent up to now is 652.4 secs Computing kpt #: 100 total cpu time spent up to now is 657.8 secs Computing kpt #: 101 total cpu time spent up to now is 663.1 secs Computing kpt #: 102 total cpu time spent up to now is 668.4 secs Computing kpt #: 103 total cpu time spent up to now is 674.3 secs Computing kpt #: 104 total cpu time spent up to now is 679.7 secs Computing kpt #: 105 total cpu time spent up to now is 685.2 secs Computing kpt #: 106 total cpu time spent up to now is 691.6 secs Computing kpt #: 107 total cpu time spent up to now is 699.2 secs Computing kpt #: 108 total cpu time spent up to now is 704.6 secs Computing kpt #: 109 total cpu time spent up to now is 710.2 secs Computing kpt #: 110 total cpu time spent up to now is 715.7 secs Computing kpt #: 111 total cpu time spent up to now is 721.8 secs Computing kpt #: 112 total cpu time spent up to now is 727.9 secs Computing kpt #: 113 total cpu time spent up to now is 734.1 secs Computing kpt #: 114 total cpu time spent up to now is 740.2 secs Computing kpt #: 115 total cpu time spent up to now is 746.4 secs Computing kpt #: 116 total cpu time spent up to now is 752.5 secs Computing kpt #: 117 total cpu time spent up to now is 758.7 secs Computing kpt #: 118 total cpu time spent up to now is 764.9 secs Computing kpt #: 119 total cpu time spent up to now is 771.1 secs Computing kpt #: 120 total cpu time spent up to now is 777.3 secs Computing kpt #: 121 total cpu time spent up to now is 783.5 secs Computing kpt #: 122 total cpu time spent up to now is 789.7 secs Computing kpt #: 123 total cpu time spent up to now is 795.9 secs Computing kpt #: 124 total cpu time spent up to now is 802.1 secs Computing kpt #: 125 total cpu time spent up to now is 808.4 secs Computing kpt #: 126 total cpu time spent up to now is 814.7 secs Computing kpt #: 127 total cpu time spent up to now is 822.2 secs Computing kpt #: 128 total cpu time spent up to now is 829.1 secs Computing kpt #: 129 total cpu time spent up to now is 835.3 secs Computing kpt #: 130 total cpu time spent up to now is 841.6 secs Computing kpt #: 131 total cpu time spent up to now is 847.8 secs Computing kpt #: 132 total cpu time spent up to now is 854.2 secs Computing kpt #: 133 total cpu time spent up to now is 860.4 secs Computing kpt #: 134 total cpu time spent up to now is 866.6 secs Computing kpt #: 135 total cpu time spent up to now is 872.7 secs Computing kpt #: 136 total cpu time spent up to now is 879.0 secs Computing kpt #: 137 total cpu time spent up to now is 885.1 secs Computing kpt #: 138 total cpu time spent up to now is 891.7 secs Computing kpt #: 139 total cpu time spent up to now is 897.8 secs Computing kpt #: 140 total cpu time spent up to now is 904.0 secs Computing kpt #: 141 total cpu time spent up to now is 910.1 secs Computing kpt #: 142 total cpu time spent up to now is 916.3 secs Computing kpt #: 143 total cpu time spent up to now is 922.4 secs Computing kpt #: 144 total cpu time spent up to now is 928.6 secs Computing kpt #: 145 total cpu time spent up to now is 934.7 secs Computing kpt #: 146 total cpu time spent up to now is 940.8 secs Computing kpt #: 147 total cpu time spent up to now is 946.9 secs Computing kpt #: 148 total cpu time spent up to now is 953.2 secs Computing kpt #: 149 total cpu time spent up to now is 959.4 secs Computing kpt #: 150 total cpu time spent up to now is 965.5 secs Computing kpt #: 151 total cpu time spent up to now is 971.7 secs Computing kpt #: 152 total cpu time spent up to now is 977.8 secs Computing kpt #: 153 total cpu time spent up to now is 983.9 secs Computing kpt #: 154 total cpu time spent up to now is 990.0 secs Computing kpt #: 155 total cpu time spent up to now is 996.7 secs Computing kpt #: 156 total cpu time spent up to now is 1002.8 secs Computing kpt #: 157 total cpu time spent up to now is 1008.8 secs Computing kpt #: 158 total cpu time spent up to now is 1015.0 secs Computing kpt #: 159 total cpu time spent up to now is 1021.0 secs Computing kpt #: 160 total cpu time spent up to now is 1027.0 secs Computing kpt #: 161 total cpu time spent up to now is 1033.0 secs Computing kpt #: 162 total cpu time spent up to now is 1039.1 secs Computing kpt #: 163 total cpu time spent up to now is 1045.2 secs Computing kpt #: 164 total cpu time spent up to now is 1051.3 secs Computing kpt #: 165 total cpu time spent up to now is 1057.4 secs Computing kpt #: 166 total cpu time spent up to now is 1063.1 secs Computing kpt #: 167 total cpu time spent up to now is 1069.1 secs Computing kpt #: 168 total cpu time spent up to now is 1074.7 secs Computing kpt #: 169 total cpu time spent up to now is 1080.2 secs Computing kpt #: 170 total cpu time spent up to now is 1085.7 secs Computing kpt #: 171 total cpu time spent up to now is 1091.1 secs Computing kpt #: 172 total cpu time spent up to now is 1096.7 secs Computing kpt #: 173 total cpu time spent up to now is 1102.0 secs Computing kpt #: 174 total cpu time spent up to now is 1108.0 secs Computing kpt #: 175 total cpu time spent up to now is 1114.2 secs Computing kpt #: 176 total cpu time spent up to now is 1120.3 secs Computing kpt #: 177 total cpu time spent up to now is 1126.5 secs Computing kpt #: 178 total cpu time spent up to now is 1132.6 secs Computing kpt #: 179 total cpu time spent up to now is 1138.8 secs Computing kpt #: 180 total cpu time spent up to now is 1145.0 secs Computing kpt #: 181 total cpu time spent up to now is 1151.4 secs Computing kpt #: 182 total cpu time spent up to now is 1157.6 secs Computing kpt #: 183 total cpu time spent up to now is 1163.7 secs Computing kpt #: 184 total cpu time spent up to now is 1170.0 secs Computing kpt #: 185 total cpu time spent up to now is 1176.1 secs Computing kpt #: 186 total cpu time spent up to now is 1182.3 secs Computing kpt #: 187 total cpu time spent up to now is 1188.6 secs Computing kpt #: 188 total cpu time spent up to now is 1195.0 secs Computing kpt #: 189 total cpu time spent up to now is 1201.4 secs Computing kpt #: 190 total cpu time spent up to now is 1207.9 secs Computing kpt #: 191 total cpu time spent up to now is 1214.4 secs Computing kpt #: 192 total cpu time spent up to now is 1221.0 secs Computing kpt #: 193 total cpu time spent up to now is 1227.5 secs Computing kpt #: 194 total cpu time spent up to now is 1234.0 secs ethr = 1.32E-11, avg # of iterations = 21.4 total cpu time spent up to now is 1234.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3452 -6.3452 -5.8655 -5.8655 -5.7866 -5.7866 -5.7866 -5.7866 -5.5617 -5.5617 -5.5617 -5.5617 -5.4948 -5.4948 -5.2810 -5.2810 -5.2807 -5.2807 -5.2807 -5.2807 -3.4185 -3.4185 -3.4185 -3.4185 -3.3469 -3.3469 -3.3221 -3.3221 -3.3221 -3.3221 -3.3016 -3.3016 -3.2783 -3.2783 -3.2783 -3.2783 -3.2452 -3.2452 1.2089 1.2089 1.4416 1.4416 1.4416 1.4416 3.3090 3.3090 3.3582 3.3582 3.4383 3.4383 3.4383 3.4383 3.6994 3.6994 3.6994 3.6994 3.7758 3.7758 4.0386 4.0386 4.2242 4.2242 4.2242 4.2242 5.1367 5.1367 5.1367 5.1367 8.3368 8.3368 8.4366 8.4366 8.4366 8.4366 8.7947 8.7947 8.7947 8.7947 9.7063 9.7063 9.7063 9.7063 10.2983 10.2983 k = 0.0125-0.0088 0.0153 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3447 -6.3447 -5.8654 -5.8654 -5.7913 -5.7913 -5.7819 -5.7819 -5.5617 -5.5617 -5.5616 -5.5616 -5.4949 -5.4949 -5.2883 -5.2883 -5.2812 -5.2812 -5.2735 -5.2735 -3.4186 -3.4186 -3.4183 -3.4183 -3.3469 -3.3469 -3.3234 -3.3234 -3.3210 -3.3210 -3.3017 -3.3017 -3.2800 -3.2800 -3.2765 -3.2765 -3.2453 -3.2453 1.2067 1.2067 1.4372 1.4372 1.4427 1.4427 3.3044 3.3044 3.3582 3.3582 3.4339 3.4339 3.4398 3.4398 3.7031 3.7031 3.7076 3.7076 3.7804 3.7804 4.0398 4.0398 4.2220 4.2220 4.2277 4.2277 5.1314 5.1314 5.1430 5.1430 8.3371 8.3371 8.4265 8.4265 8.4474 8.4474 8.7871 8.7871 8.8013 8.8013 9.6838 9.6838 9.7243 9.7243 10.2942 10.2942 k = 0.0250-0.0177 0.0306 ( 8423 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3430 -6.3430 -5.8652 -5.8652 -5.7959 -5.7959 -5.7770 -5.7770 -5.5616 -5.5616 -5.5615 -5.5615 -5.4949 -5.4949 -5.2964 -5.2964 -5.2818 -5.2818 -5.2668 -5.2668 -3.4186 -3.4186 -3.4180 -3.4180 -3.3470 -3.3470 -3.3251 -3.3251 -3.3202 -3.3202 -3.3019 -3.3019 -3.2816 -3.2816 -3.2747 -3.2747 -3.2454 -3.2454 1.2002 1.2002 1.4249 1.4249 1.4452 1.4452 3.2927 3.2927 3.3554 3.3554 3.4224 3.4224 3.4452 3.4452 3.7183 3.7183 3.7266 3.7266 3.7937 3.7937 4.0432 4.0432 4.2210 4.2210 4.2327 4.2327 5.1272 5.1272 5.1503 5.1503 8.3376 8.3376 8.4178 8.4178 8.4581 8.4581 8.7787 8.7787 8.8070 8.8070 9.6556 9.6556 9.7390 9.7390 10.2826 10.2826 k = 0.0375-0.0265 0.0459 ( 8431 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3401 -6.3401 -5.8647 -5.8647 -5.8004 -5.8004 -5.7721 -5.7721 -5.5616 -5.5616 -5.5613 -5.5613 -5.4951 -5.4951 -5.3048 -5.3048 -5.2829 -5.2829 -5.2606 -5.2606 -3.4187 -3.4187 -3.4175 -3.4175 -3.3470 -3.3470 -3.3270 -3.3270 -3.3197 -3.3197 -3.3023 -3.3023 -3.2832 -3.2832 -3.2730 -3.2730 -3.2456 -3.2456 1.1894 1.1894 1.4049 1.4049 1.4496 1.4496 3.2770 3.2770 3.3463 3.3463 3.4058 3.4058 3.4562 3.4562 3.7427 3.7427 3.7551 3.7551 3.8152 3.8152 4.0490 4.0490 4.2214 4.2214 4.2393 4.2393 5.1241 5.1241 5.1587 5.1587 8.3375 8.3375 8.4117 8.4117 8.4682 8.4682 8.7698 8.7698 8.8120 8.8120 9.6211 9.6211 9.7507 9.7507 10.2647 10.2647 k = 0.0500-0.0354 0.0612 ( 8435 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3362 -6.3362 -5.8640 -5.8640 -5.8047 -5.8047 -5.7672 -5.7672 -5.5615 -5.5615 -5.5611 -5.5611 -5.4952 -5.4952 -5.3136 -5.3136 -5.2843 -5.2843 -5.2549 -5.2549 -3.4187 -3.4187 -3.4168 -3.4168 -3.3470 -3.3470 -3.3292 -3.3292 -3.3194 -3.3194 -3.3027 -3.3027 -3.2845 -3.2845 -3.2714 -3.2714 -3.2458 -3.2458 1.1742 1.1742 1.3777 1.3777 1.4560 1.4560 3.2589 3.2589 3.3316 3.3316 3.3863 3.3863 3.4722 3.4722 3.7731 3.7731 3.7922 3.7922 3.8437 3.8437 4.0573 4.0573 4.2229 4.2229 4.2477 4.2477 5.1222 5.1222 5.1680 5.1680 8.3354 8.3354 8.4094 8.4094 8.4770 8.4770 8.7613 8.7613 8.8162 8.8162 9.5800 9.5800 9.7589 9.7589 10.2429 10.2429 k = 0.0625-0.0442 0.0765 ( 8432 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3312 -6.3312 -5.8632 -5.8632 -5.8089 -5.8089 -5.7623 -5.7623 -5.5614 -5.5614 -5.5608 -5.5608 -5.4955 -5.4955 -5.3227 -5.3227 -5.2862 -5.2862 -5.2498 -5.2498 -3.4188 -3.4188 -3.4160 -3.4160 -3.3471 -3.3471 -3.3316 -3.3316 -3.3193 -3.3193 -3.3033 -3.3033 -3.2858 -3.2858 -3.2699 -3.2699 -3.2460 -3.2460 1.1549 1.1549 1.3443 1.3443 1.4648 1.4648 3.2390 3.2390 3.3131 3.3131 3.3656 3.3656 3.4914 3.4914 3.8066 3.8066 3.8371 3.8371 3.8786 3.8786 4.0681 4.0681 4.2258 4.2258 4.2582 4.2582 5.1216 5.1216 5.1785 5.1785 8.3303 8.3303 8.4118 8.4118 8.4840 8.4840 8.7541 8.7541 8.8195 8.8195 9.5331 9.5331 9.7616 9.7616 10.2206 10.2206 k = 0.0750-0.0530 0.0919 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3251 -6.3251 -5.8621 -5.8621 -5.8129 -5.8129 -5.7574 -5.7574 -5.5612 -5.5612 -5.5604 -5.5604 -5.4958 -5.4958 -5.3320 -5.3320 -5.2884 -5.2884 -5.2452 -5.2452 -3.4189 -3.4189 -3.4149 -3.4149 -3.3472 -3.3472 -3.3341 -3.3341 -3.3193 -3.3193 -3.3040 -3.3040 -3.2870 -3.2870 -3.2686 -3.2686 -3.2462 -3.2462 1.1315 1.1315 1.3054 1.3054 1.4759 1.4759 3.2175 3.2175 3.2929 3.2929 3.3446 3.3446 3.5127 3.5127 3.8415 3.8415 3.8875 3.8876 3.9200 3.9200 4.0817 4.0817 4.2300 4.2301 4.2711 4.2711 5.1223 5.1223 5.1900 5.1900 8.3224 8.3224 8.4179 8.4179 8.4886 8.4886 8.7494 8.7494 8.8216 8.8216 9.4816 9.4816 9.7558 9.7558 10.2020 10.2020 k = 0.0875-0.0619 0.1072 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3180 -6.3180 -5.8609 -5.8609 -5.8167 -5.8167 -5.7525 -5.7525 -5.5610 -5.5610 -5.5599 -5.5599 -5.4962 -5.4962 -5.3415 -5.3415 -5.2910 -5.2910 -5.2412 -5.2412 -3.4189 -3.4189 -3.4137 -3.4137 -3.3474 -3.3474 -3.3368 -3.3368 -3.3194 -3.3194 -3.3049 -3.3049 -3.2881 -3.2881 -3.2676 -3.2676 -3.2462 -3.2462 1.1044 1.1044 1.2621 1.2621 1.4894 1.4894 3.1942 3.1942 3.2722 3.2722 3.3241 3.3241 3.5350 3.5350 3.8766 3.8766 3.9389 3.9389 3.9700 3.9700 4.0983 4.0983 4.2360 4.2360 4.2869 4.2869 5.1245 5.1245 5.2026 5.2026 8.3123 8.3123 8.4258 8.4258 8.4914 8.4914 8.7479 8.7479 8.8221 8.8221 9.4270 9.4270 9.7387 9.7387 10.1908 10.1908 k = 0.1000-0.0707 0.1225 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3098 -6.3098 -5.8596 -5.8596 -5.8203 -5.8203 -5.7478 -5.7478 -5.5608 -5.5608 -5.5594 -5.5594 -5.4966 -5.4966 -5.3512 -5.3512 -5.2940 -5.2940 -5.2378 -5.2378 -3.4191 -3.4191 -3.4124 -3.4124 -3.3478 -3.3478 -3.3393 -3.3393 -3.3196 -3.3196 -3.3058 -3.3058 -3.2893 -3.2893 -3.2669 -3.2669 -3.2462 -3.2462 1.0740 1.0740 1.2151 1.2151 1.5054 1.5054 3.1690 3.1690 3.2521 3.2521 3.3044 3.3044 3.5575 3.5575 3.9109 3.9109 3.9874 3.9874 4.0293 4.0293 4.1187 4.1187 4.2440 4.2440 4.3062 4.3062 5.1282 5.1282 5.2165 5.2165 8.3009 8.3009 8.4320 8.4320 8.4948 8.4948 8.7499 8.7499 8.8204 8.8204 9.3713 9.3713 9.7087 9.7087 10.1896 10.1896 k = 0.1125-0.0795 0.1378 ( 8432 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3008 -6.3008 -5.8581 -5.8581 -5.8237 -5.8237 -5.7431 -5.7431 -5.5605 -5.5605 -5.5589 -5.5589 -5.4972 -5.4972 -5.3609 -5.3609 -5.2973 -5.2973 -5.2350 -5.2350 -3.4192 -3.4192 -3.4109 -3.4109 -3.3487 -3.3487 -3.3415 -3.3415 -3.3199 -3.3199 -3.3069 -3.3069 -3.2906 -3.2906 -3.2664 -3.2664 -3.2460 -3.2460 1.0408 1.0408 1.1654 1.1654 1.5236 1.5236 3.1418 3.1418 3.2335 3.2335 3.2859 3.2859 3.5795 3.5795 3.9437 3.9437 4.0334 4.0334 4.0922 4.0922 4.1453 4.1453 4.2551 4.2551 4.3299 4.3299 5.1335 5.1335 5.2317 5.2317 8.2885 8.2885 8.4322 8.4322 8.5023 8.5023 8.7540 8.7540 8.8165 8.8165 9.3169 9.3169 9.6665 9.6665 10.1981 10.1981 k = 0.1250-0.0884 0.1531 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2908 -6.2908 -5.8565 -5.8565 -5.8268 -5.8268 -5.7385 -5.7385 -5.5601 -5.5601 -5.5583 -5.5583 -5.4979 -5.4979 -5.3706 -5.3706 -5.3010 -5.3010 -5.2328 -5.2328 -3.4194 -3.4194 -3.4093 -3.4093 -3.3504 -3.3504 -3.3431 -3.3431 -3.3202 -3.3202 -3.3082 -3.3082 -3.2919 -3.2919 -3.2662 -3.2662 -3.2457 -3.2457 1.0051 1.0051 1.1135 1.1135 1.5441 1.5441 3.1130 3.1130 3.2167 3.2167 3.2686 3.2686 3.6002 3.6002 3.9745 3.9745 4.0770 4.0770 4.1429 4.1429 4.1900 4.1900 4.2708 4.2708 4.3588 4.3588 5.1405 5.1405 5.2483 5.2483 8.2758 8.2758 8.4250 8.4250 8.5156 8.5156 8.7560 8.7560 8.8122 8.8122 9.2665 9.2665 9.6144 9.6144 10.2145 10.2145 k = 0.1375-0.0972 0.1684 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2800 -6.2800 -5.8549 -5.8549 -5.8296 -5.8296 -5.7342 -5.7342 -5.5598 -5.5598 -5.5576 -5.5576 -5.4987 -5.4987 -5.3803 -5.3803 -5.3049 -5.3049 -5.2312 -5.2312 -3.4196 -3.4196 -3.4076 -3.4076 -3.3527 -3.3527 -3.3439 -3.3439 -3.3204 -3.3204 -3.3095 -3.3095 -3.2934 -3.2934 -3.2661 -3.2661 -3.2453 -3.2453 0.9674 0.9675 1.0603 1.0603 1.5667 1.5667 3.0828 3.0828 3.2019 3.2019 3.2527 3.2527 3.6191 3.6191 4.0030 4.0030 4.1167 4.1167 4.1749 4.1749 4.2542 4.2542 4.2954 4.2954 4.3940 4.3940 5.1491 5.1491 5.2662 5.2662 8.2627 8.2627 8.4125 8.4125 8.5329 8.5329 8.7475 8.7475 8.8133 8.8133 9.2229 9.2229 9.5553 9.5553 10.2358 10.2358 k = 0.1500-0.1061 0.1837 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2684 -6.2684 -5.8532 -5.8532 -5.8319 -5.8319 -5.7301 -5.7301 -5.5593 -5.5593 -5.5570 -5.5570 -5.4997 -5.4997 -5.3898 -5.3898 -5.3090 -5.3090 -5.2302 -5.2302 -3.4199 -3.4199 -3.4058 -3.4058 -3.3554 -3.3554 -3.3443 -3.3443 -3.3207 -3.3207 -3.3110 -3.3110 -3.2951 -3.2951 -3.2661 -3.2661 -3.2448 -3.2448 0.9281 0.9281 1.0062 1.0062 1.5912 1.5912 3.0518 3.0518 3.1891 3.1891 3.2381 3.2381 3.6353 3.6353 4.0296 4.0296 4.1509 4.1509 4.2008 4.2008 4.3101 4.3101 4.3428 4.3428 4.4368 4.4368 5.1594 5.1594 5.2856 5.2856 8.2497 8.2497 8.3970 8.3970 8.5514 8.5514 8.7240 8.7240 8.8225 8.8225 9.1884 9.1884 9.4921 9.4921 10.2588 10.2588 k = 0.1625-0.1149 0.1990 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2561 -6.2561 -5.8516 -5.8516 -5.8338 -5.8338 -5.7263 -5.7263 -5.5588 -5.5588 -5.5562 -5.5562 -5.5009 -5.5009 -5.3991 -5.3991 -5.3134 -5.3134 -5.2298 -5.2298 -3.4202 -3.4202 -3.4039 -3.4039 -3.3583 -3.3583 -3.3446 -3.3446 -3.3209 -3.3209 -3.3126 -3.3126 -3.2969 -3.2969 -3.2662 -3.2662 -3.2444 -3.2444 0.8875 0.8875 0.9518 0.9518 1.6174 1.6174 3.0207 3.0207 3.1783 3.1783 3.2250 3.2250 3.6484 3.6484 4.0545 4.0545 4.1792 4.1792 4.2236 4.2236 4.3546 4.3546 4.4103 4.4103 4.4886 4.4886 5.1713 5.1713 5.3062 5.3062 8.2369 8.2369 8.3801 8.3801 8.5679 8.5679 8.6900 8.6900 8.8359 8.8359 9.1642 9.1642 9.4273 9.4273 10.2794 10.2794 k = 0.1750-0.1237 0.2143 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2431 -6.2431 -5.8503 -5.8503 -5.8350 -5.8350 -5.7228 -5.7228 -5.5582 -5.5582 -5.5555 -5.5555 -5.5022 -5.5022 -5.4080 -5.4080 -5.3181 -5.3181 -5.2301 -5.2301 -3.4206 -3.4206 -3.4020 -3.4020 -3.3612 -3.3612 -3.3447 -3.3447 -3.3211 -3.3211 -3.3144 -3.3144 -3.2989 -3.2989 -3.2663 -3.2663 -3.2440 -3.2440 0.8460 0.8460 0.8975 0.8975 1.6452 1.6452 2.9899 2.9899 3.1694 3.1694 3.2133 3.2133 3.6580 3.6580 4.0782 4.0782 4.2024 4.2024 4.2447 4.2447 4.4034 4.4034 4.4773 4.4773 4.5504 4.5505 5.1848 5.1848 5.3280 5.3280 8.2244 8.2244 8.3627 8.3627 8.5727 8.5727 8.6573 8.6573 8.8498 8.8498 9.1501 9.1501 9.3635 9.3635 10.2911 10.2911 k = 0.1875-0.1326 0.2296 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2297 -6.2297 -5.8494 -5.8494 -5.8354 -5.8354 -5.7197 -5.7197 -5.5575 -5.5575 -5.5547 -5.5547 -5.5038 -5.5038 -5.4165 -5.4165 -5.3228 -5.3228 -5.2309 -5.2309 -3.4210 -3.4210 -3.4000 -3.4000 -3.3640 -3.3640 -3.3448 -3.3448 -3.3213 -3.3213 -3.3162 -3.3162 -3.3009 -3.3009 -3.2664 -3.2664 -3.2437 -3.2437 0.8039 0.8039 0.8436 0.8436 1.6743 1.6743 2.9601 2.9601 3.1622 3.1622 3.2029 3.2029 3.6635 3.6635 4.1010 4.1010 4.2217 4.2217 4.2657 4.2657 4.4570 4.4570 4.5409 4.5409 4.6206 4.6206 5.1999 5.1999 5.3506 5.3506 8.2123 8.2123 8.3451 8.3451 8.5464 8.5464 8.6477 8.6477 8.8616 8.8616 9.1446 9.1446 9.3036 9.3036 10.2837 10.2837 k = 0.2000-0.1414 0.2449 ( 8408 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2157 -6.2157 -5.8490 -5.8490 -5.8348 -5.8348 -5.7171 -5.7171 -5.5567 -5.5567 -5.5538 -5.5538 -5.5055 -5.5055 -5.4245 -5.4245 -5.3277 -5.3277 -5.2323 -5.2323 -3.4216 -3.4216 -3.3980 -3.3980 -3.3666 -3.3666 -3.3448 -3.3448 -3.3215 -3.3215 -3.3182 -3.3181 -3.3030 -3.3030 -3.2665 -3.2665 -3.2435 -3.2435 0.7613 0.7613 0.7905 0.7906 1.7043 1.7043 2.9318 2.9318 3.1567 3.1567 3.1939 3.1939 3.6648 3.6648 4.1232 4.1232 4.2381 4.2381 4.2873 4.2873 4.5140 4.5140 4.6029 4.6029 4.6950 4.6950 5.2166 5.2166 5.3738 5.3738 8.2004 8.2004 8.3271 8.3271 8.4970 8.4970 8.6556 8.6556 8.8688 8.8688 9.1462 9.1462 9.2511 9.2511 10.2469 10.2469 k = 0.2125-0.1503 0.2603 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2014 -6.2014 -5.8490 -5.8490 -5.8334 -5.8334 -5.7150 -5.7150 -5.5558 -5.5558 -5.5528 -5.5528 -5.5074 -5.5074 -5.4319 -5.4319 -5.3327 -5.3327 -5.2343 -5.2343 -3.4222 -3.4222 -3.3960 -3.3960 -3.3691 -3.3691 -3.3449 -3.3449 -3.3218 -3.3218 -3.3200 -3.3200 -3.3050 -3.3050 -3.2666 -3.2666 -3.2434 -3.2434 0.7186 0.7186 0.7386 0.7386 1.7351 1.7351 2.9058 2.9058 3.1528 3.1528 3.1863 3.1863 3.6618 3.6618 4.1451 4.1451 4.2529 4.2529 4.3098 4.3098 4.5733 4.5733 4.6649 4.6649 4.7701 4.7701 5.2348 5.2348 5.3971 5.3971 8.1883 8.1883 8.3069 8.3069 8.4437 8.4437 8.6647 8.6647 8.8692 8.8692 9.1529 9.1529 9.2106 9.2106 10.1814 10.1814 k = 0.2250-0.1591 0.2756 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1868 -6.1868 -5.8492 -5.8492 -5.8314 -5.8314 -5.7136 -5.7136 -5.5549 -5.5549 -5.5518 -5.5518 -5.5095 -5.5095 -5.4387 -5.4387 -5.3378 -5.3378 -5.2369 -5.2369 -3.4230 -3.4230 -3.3941 -3.3941 -3.3713 -3.3713 -3.3451 -3.3451 -3.3230 -3.3230 -3.3212 -3.3212 -3.3068 -3.3068 -3.2667 -3.2667 -3.2434 -3.2434 0.6760 0.6760 0.6880 0.6880 1.7661 1.7661 2.8825 2.8825 3.1504 3.1504 3.1799 3.1799 3.6546 3.6546 4.1666 4.1666 4.2669 4.2669 4.3331 4.3331 4.6340 4.6340 4.7276 4.7276 4.8439 4.8439 5.2547 5.2547 5.4200 5.4200 8.1746 8.1746 8.2809 8.2809 8.3977 8.3977 8.6680 8.6680 8.8623 8.8623 9.1604 9.1604 9.1883 9.1883 10.0975 10.0975 k = 0.2375-0.1679 0.2909 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1720 -6.1720 -5.8493 -5.8493 -5.8291 -5.8291 -5.7128 -5.7128 -5.5539 -5.5539 -5.5505 -5.5505 -5.5117 -5.5117 -5.4448 -5.4448 -5.3428 -5.3428 -5.2400 -5.2400 -3.4238 -3.4238 -3.3922 -3.3922 -3.3733 -3.3733 -3.3453 -3.3453 -3.3251 -3.3251 -3.3217 -3.3217 -3.3084 -3.3084 -3.2668 -3.2668 -3.2435 -3.2435 0.6333 0.6333 0.6392 0.6392 1.7970 1.7970 2.8625 2.8625 3.1493 3.1493 3.1747 3.1747 3.6434 3.6434 4.1879 4.1879 4.2807 4.2807 4.3570 4.3570 4.6954 4.6954 4.7907 4.7907 4.9150 4.9150 5.2765 5.2765 5.4421 5.4421 8.1554 8.1554 8.2479 8.2479 8.3668 8.3668 8.6607 8.6607 8.8511 8.8511 9.1612 9.1612 9.1912 9.1912 10.0042 10.0042 k = 0.2500-0.1768 0.3062 ( 8396 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1572 -6.1572 -5.8492 -5.8492 -5.8265 -5.8265 -5.7126 -5.7126 -5.5530 -5.5530 -5.5491 -5.5491 -5.5139 -5.5139 -5.4503 -5.4503 -5.3479 -5.3479 -5.2437 -5.2437 -3.4248 -3.4248 -3.3903 -3.3903 -3.3750 -3.3750 -3.3456 -3.3456 -3.3273 -3.3273 -3.3222 -3.3222 -3.3096 -3.3096 -3.2669 -3.2669 -3.2438 -3.2438 0.5892 0.5892 0.5940 0.5940 1.8273 1.8274 2.8465 2.8465 3.1494 3.1494 3.1707 3.1707 3.6286 3.6286 4.2089 4.2089 4.2946 4.2946 4.3813 4.3813 4.7572 4.7572 4.8539 4.8539 4.9825 4.9825 5.3002 5.3002 5.4628 5.4628 8.1230 8.1230 8.2174 8.2174 8.3504 8.3504 8.6399 8.6399 8.8408 8.8408 9.1642 9.1642 9.2068 9.2068 9.9075 9.9075 k = 0.2625-0.1856 0.3215 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1425 -6.1425 -5.8489 -5.8489 -5.8237 -5.8237 -5.7132 -5.7132 -5.5521 -5.5521 -5.5474 -5.5474 -5.5161 -5.5161 -5.4551 -5.4551 -5.3528 -5.3528 -5.2479 -5.2479 -3.4259 -3.4259 -3.3886 -3.3886 -3.3764 -3.3764 -3.3461 -3.3461 -3.3295 -3.3295 -3.3229 -3.3229 -3.3103 -3.3103 -3.2671 -3.2671 -3.2441 -3.2441 0.5441 0.5441 0.5523 0.5523 1.8566 1.8566 2.8350 2.8351 3.1505 3.1505 3.1680 3.1680 3.6104 3.6104 4.2295 4.2295 4.3088 4.3088 4.4058 4.4058 4.8188 4.8188 4.9166 4.9166 5.0456 5.0456 5.3261 5.3261 5.4817 5.4817 8.0748 8.0748 8.1981 8.1981 8.3435 8.3435 8.6063 8.6063 8.8343 8.8343 9.1741 9.1741 9.2253 9.2253 9.8115 9.8115 k = 0.2750-0.1945 0.3368 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1279 -6.1279 -5.8482 -5.8482 -5.8210 -5.8210 -5.7146 -5.7146 -5.5512 -5.5512 -5.5454 -5.5454 -5.5180 -5.5180 -5.4594 -5.4594 -5.3577 -5.3577 -5.2527 -5.2527 -3.4271 -3.4271 -3.3870 -3.3870 -3.3775 -3.3775 -3.3468 -3.3468 -3.3315 -3.3315 -3.3238 -3.3238 -3.3106 -3.3106 -3.2673 -3.2673 -3.2445 -3.2445 0.5004 0.5004 0.5120 0.5120 1.8844 1.8844 2.8286 2.8286 3.1523 3.1523 3.1666 3.1666 3.5895 3.5895 4.2493 4.2493 4.3237 4.3237 4.4303 4.4303 4.8797 4.8797 4.9781 4.9781 5.1040 5.1040 5.3542 5.3542 5.4985 5.4985 8.0180 8.0180 8.1864 8.1864 8.3424 8.3424 8.5642 8.5642 8.8306 8.8306 9.1889 9.1889 9.2445 9.2445 9.7193 9.7193 k = 0.2875-0.2033 0.3521 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1136 -6.1136 -5.8471 -5.8471 -5.8182 -5.8182 -5.7166 -5.7166 -5.5505 -5.5505 -5.5433 -5.5433 -5.5197 -5.5197 -5.4630 -5.4630 -5.3624 -5.3624 -5.2579 -5.2579 -3.4284 -3.4284 -3.3856 -3.3856 -3.3782 -3.3782 -3.3480 -3.3480 -3.3332 -3.3332 -3.3249 -3.3249 -3.3104 -3.3104 -3.2676 -3.2676 -3.2450 -3.2450 0.4585 0.4585 0.4729 0.4729 1.9101 1.9101 2.8276 2.8276 3.1543 3.1543 3.1667 3.1667 3.5662 3.5662 4.2683 4.2683 4.3394 4.3394 4.4542 4.4542 4.9396 4.9396 5.0376 5.0376 5.1579 5.1579 5.3843 5.3844 5.5129 5.5129 7.9590 7.9590 8.1779 8.1779 8.3449 8.3449 8.5186 8.5186 8.8276 8.8276 9.2063 9.2063 9.2630 9.2630 9.6336 9.6336 k = 0.3000-0.2121 0.3674 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0997 -6.0997 -5.8456 -5.8456 -5.8156 -5.8156 -5.7192 -5.7192 -5.5498 -5.5498 -5.5411 -5.5411 -5.5208 -5.5208 -5.4662 -5.4662 -5.3670 -5.3670 -5.2637 -5.2637 -3.4297 -3.4297 -3.3844 -3.3844 -3.3786 -3.3786 -3.3495 -3.3495 -3.3346 -3.3346 -3.3261 -3.3261 -3.3100 -3.3100 -3.2679 -3.2679 -3.2456 -3.2456 0.4187 0.4187 0.4350 0.4350 1.9335 1.9335 2.8324 2.8324 3.1560 3.1560 3.1688 3.1688 3.5411 3.5411 4.2862 4.2862 4.3558 4.3558 4.4774 4.4774 4.9980 4.9980 5.0938 5.0938 5.2081 5.2081 5.4160 5.4160 5.5249 5.5249 7.9007 7.9007 8.1703 8.1703 8.3481 8.3481 8.4747 8.4747 8.8234 8.8234 9.2242 9.2242 9.2797 9.2797 9.5569 9.5569 k = 0.3125-0.2210 0.3827 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.0864 -6.0864 -5.8436 -5.8436 -5.8130 -5.8130 -5.7224 -5.7224 -5.5491 -5.5491 -5.5391 -5.5391 -5.5212 -5.5212 -5.4688 -5.4688 -5.3713 -5.3713 -5.2699 -5.2699 -3.4312 -3.4312 -3.3835 -3.3835 -3.3787 -3.3787 -3.3513 -3.3513 -3.3356 -3.3356 -3.3273 -3.3273 -3.3092 -3.3092 -3.2683 -3.2683 -3.2463 -3.2463 0.3810 0.3810 0.3984 0.3984 1.9542 1.9542 2.8431 2.8432 3.1572 3.1572 3.1727 3.1727 3.5147 3.5147 4.3029 4.3029 4.3730 4.3730 4.4992 4.4992 5.0544 5.0544 5.1456 5.1456 5.2560 5.2560 5.4481 5.4481 5.5346 5.5346 7.8447 7.8447 8.1622 8.1622 8.3460 8.3460 8.4402 8.4402 8.8164 8.8164 9.2407 9.2407 9.2937 9.2937 9.4917 9.4917 k = 0.3250-0.2298 0.3980 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0736 -6.0736 -5.8413 -5.8413 -5.8107 -5.8107 -5.7260 -5.7260 -5.5485 -5.5485 -5.5376 -5.5376 -5.5206 -5.5206 -5.4708 -5.4708 -5.3754 -5.3754 -5.2765 -5.2765 -3.4327 -3.4327 -3.3828 -3.3828 -3.3784 -3.3784 -3.3534 -3.3534 -3.3362 -3.3362 -3.3285 -3.3285 -3.3082 -3.3082 -3.2688 -3.2688 -3.2470 -3.2470 0.3456 0.3456 0.3634 0.3634 1.9721 1.9721 2.8597 2.8597 3.1583 3.1583 3.1778 3.1778 3.4875 3.4875 4.3182 4.3182 4.3909 4.3909 4.5194 4.5194 5.1082 5.1082 5.1920 5.1920 5.3030 5.3030 5.4795 5.4795 5.5425 5.5425 7.7919 7.7919 8.1528 8.1528 8.3280 8.3280 8.4264 8.4264 8.8059 8.8059 9.2538 9.2538 9.3040 9.3040 9.4405 9.4405 k = 0.3375-0.2386 0.4134 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0615 -6.0615 -5.8386 -5.8386 -5.8086 -5.8086 -5.7299 -5.7299 -5.5479 -5.5479 -5.5368 -5.5368 -5.5189 -5.5189 -5.4723 -5.4723 -5.3793 -5.3793 -5.2836 -5.2836 -3.4342 -3.4342 -3.3823 -3.3823 -3.3778 -3.3778 -3.3557 -3.3557 -3.3367 -3.3367 -3.3298 -3.3298 -3.3071 -3.3071 -3.2693 -3.2693 -3.2477 -3.2477 0.3124 0.3125 0.3300 0.3300 1.9872 1.9872 2.8817 2.8817 3.1595 3.1595 3.1836 3.1836 3.4600 3.4600 4.3321 4.3321 4.4091 4.4091 4.5374 4.5374 5.1589 5.1589 5.2328 5.2328 5.3499 5.3499 5.5081 5.5081 5.5498 5.5498 7.7430 7.7430 8.1415 8.1415 8.2958 8.2958 8.4323 8.4323 8.7915 8.7915 9.2605 9.2605 9.3106 9.3106 9.4052 9.4052 k = 0.3500-0.2475 0.4287 ( 8420 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0503 -6.0503 -5.8355 -5.8355 -5.8068 -5.8068 -5.7340 -5.7340 -5.5474 -5.5474 -5.5367 -5.5367 -5.5163 -5.5163 -5.4731 -5.4731 -5.3829 -5.3829 -5.2911 -5.2911 -3.4357 -3.4357 -3.3818 -3.3818 -3.3771 -3.3771 -3.3579 -3.3579 -3.3370 -3.3370 -3.3310 -3.3310 -3.3058 -3.3058 -3.2699 -3.2699 -3.2484 -3.2484 0.2816 0.2816 0.2984 0.2984 1.9997 1.9997 2.9087 2.9087 3.1607 3.1607 3.1900 3.1900 3.4326 3.4326 4.3447 4.3447 4.4275 4.4275 4.5529 4.5529 5.2060 5.2060 5.2689 5.2689 5.3963 5.3963 5.5295 5.5295 5.5605 5.5605 7.6984 7.6984 8.1278 8.1278 8.2598 8.2598 8.4473 8.4473 8.7739 8.7739 9.2587 9.2587 9.3151 9.3151 9.3846 9.3846 k = 0.3625-0.2563 0.4440 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0398 -6.0398 -5.8321 -5.8321 -5.8053 -5.8053 -5.7382 -5.7382 -5.5469 -5.5469 -5.5370 -5.5370 -5.5131 -5.5131 -5.4731 -5.4731 -5.3862 -5.3862 -5.2989 -5.2989 -3.4372 -3.4372 -3.3814 -3.3814 -3.3763 -3.3763 -3.3602 -3.3602 -3.3373 -3.3373 -3.3321 -3.3321 -3.3044 -3.3044 -3.2706 -3.2706 -3.2491 -3.2491 0.2532 0.2532 0.2687 0.2687 2.0098 2.0098 2.9399 2.9399 3.1620 3.1620 3.1966 3.1966 3.4058 3.4058 4.3558 4.3558 4.4456 4.4456 4.5655 4.5655 5.2487 5.2487 5.3016 5.3016 5.4415 5.4416 5.5392 5.5392 5.5791 5.5791 7.6584 7.6584 8.1118 8.1118 8.2249 8.2249 8.4665 8.4665 8.7542 8.7542 9.2504 9.2504 9.3188 9.3188 9.3733 9.3733 k = 0.3750-0.2652 0.4593 ( 8412 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0302 -6.0302 -5.8286 -5.8286 -5.8041 -5.8041 -5.7422 -5.7422 -5.5465 -5.5465 -5.5376 -5.5376 -5.5098 -5.5098 -5.4720 -5.4720 -5.3893 -5.3893 -5.3072 -5.3072 -3.4386 -3.4386 -3.3809 -3.3809 -3.3756 -3.3756 -3.3623 -3.3623 -3.3376 -3.3376 -3.3332 -3.3332 -3.3028 -3.3028 -3.2714 -3.2714 -3.2499 -3.2499 0.2271 0.2271 0.2411 0.2411 2.0179 2.0179 2.9745 2.9745 3.1633 3.1633 3.2032 3.2032 3.3800 3.3800 4.3654 4.3654 4.4632 4.4632 4.5749 4.5749 5.2864 5.2864 5.3322 5.3322 5.4845 5.4845 5.5423 5.5423 5.6006 5.6006 7.6231 7.6231 8.0939 8.0939 8.1925 8.1925 8.4876 8.4876 8.7338 8.7338 9.2404 9.2404 9.3208 9.3208 9.3650 9.3650 k = 0.3875-0.2740 0.4746 ( 8420 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0216 -6.0216 -5.8251 -5.8251 -5.8031 -5.8031 -5.7461 -5.7461 -5.5461 -5.5461 -5.5384 -5.5384 -5.5067 -5.5067 -5.4697 -5.4697 -5.3920 -5.3920 -5.3157 -5.3157 -3.4400 -3.4400 -3.3805 -3.3805 -3.3749 -3.3749 -3.3643 -3.3643 -3.3378 -3.3378 -3.3342 -3.3342 -3.3012 -3.3012 -3.2723 -3.2723 -3.2505 -3.2505 0.2035 0.2035 0.2157 0.2157 2.0242 2.0243 3.0114 3.0114 3.1644 3.1644 3.2098 3.2098 3.3557 3.3557 4.3734 4.3734 4.4801 4.4801 4.5813 4.5813 5.3189 5.3189 5.3616 5.3616 5.5245 5.5245 5.5428 5.5428 5.6212 5.6212 7.5926 7.5926 8.0751 8.0751 8.1630 8.1630 8.5095 8.5095 8.7141 8.7141 9.2309 9.2309 9.3202 9.3202 9.3564 9.3564 k = 0.4000-0.2828 0.4899 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0138 -6.0138 -5.8219 -5.8219 -5.8021 -5.8021 -5.7498 -5.7498 -5.5457 -5.5457 -5.5392 -5.5392 -5.5040 -5.5040 -5.4660 -5.4660 -5.3945 -5.3945 -5.3245 -5.3245 -3.4413 -3.4413 -3.3800 -3.3800 -3.3742 -3.3742 -3.3660 -3.3660 -3.3381 -3.3381 -3.3351 -3.3351 -3.2995 -3.2995 -3.2733 -3.2733 -3.2512 -3.2512 0.1823 0.1823 0.1925 0.1925 2.0293 2.0293 3.0496 3.0496 3.1652 3.1652 3.2162 3.2162 3.3332 3.3332 4.3797 4.3797 4.4959 4.4959 4.5846 4.5847 5.3470 5.3470 5.3894 5.3894 5.5420 5.5420 5.5609 5.5609 5.6396 5.6396 7.5666 7.5666 8.0564 8.0564 8.1363 8.1363 8.5313 8.5313 8.6963 8.6963 9.2225 9.2225 9.3167 9.3167 9.3462 9.3462 k = 0.4125-0.2917 0.5052 ( 8396 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0069 -6.0069 -5.8194 -5.8194 -5.8007 -5.8007 -5.7532 -5.7532 -5.5454 -5.5454 -5.5401 -5.5401 -5.5019 -5.5019 -5.4611 -5.4611 -5.3967 -5.3967 -5.3336 -5.3336 -3.4425 -3.4425 -3.3795 -3.3795 -3.3737 -3.3737 -3.3675 -3.3675 -3.3384 -3.3384 -3.3360 -3.3360 -3.2977 -3.2977 -3.2744 -3.2744 -3.2517 -3.2517 0.1635 0.1635 0.1719 0.1719 2.0332 2.0332 3.0877 3.0877 3.1657 3.1657 3.2221 3.2221 3.3131 3.3131 4.3841 4.3841 4.5104 4.5104 4.5855 4.5855 5.3716 5.3716 5.4149 5.4149 5.5404 5.5404 5.5932 5.5932 5.6558 5.6558 7.5450 7.5450 8.0390 8.0390 8.1120 8.1120 8.5522 8.5522 8.6809 8.6810 9.2150 9.2150 9.3106 9.3106 9.3343 9.3343 k = 0.4250-0.3005 0.5205 ( 8400 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0010 -6.0010 -5.8179 -5.8179 -5.7985 -5.7985 -5.7565 -5.7565 -5.5451 -5.5451 -5.5410 -5.5410 -5.5003 -5.5003 -5.4549 -5.4549 -5.3986 -5.3986 -5.3429 -5.3429 -3.4436 -3.4436 -3.3790 -3.3790 -3.3735 -3.3735 -3.3685 -3.3685 -3.3387 -3.3387 -3.3369 -3.3369 -3.2959 -3.2959 -3.2756 -3.2756 -3.2522 -3.2522 0.1473 0.1473 0.1537 0.1537 2.0362 2.0362 3.1245 3.1245 3.1659 3.1659 3.2276 3.2276 3.2956 3.2956 4.3866 4.3866 4.5235 4.5235 4.5844 4.5844 5.3938 5.3938 5.4373 5.4373 5.5379 5.5379 5.6212 5.6212 5.6697 5.6697 7.5274 7.5274 8.0239 8.0239 8.0899 8.0899 8.5718 8.5718 8.6682 8.6682 9.2081 9.2081 9.3025 9.3025 9.3212 9.3212 k = 0.4375-0.3094 0.5358 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9959 -5.9959 -5.8174 -5.8174 -5.7955 -5.7955 -5.7596 -5.7596 -5.5449 -5.5449 -5.5419 -5.5419 -5.4992 -5.4992 -5.4478 -5.4478 -5.4002 -5.4002 -5.3524 -5.3524 -3.4445 -3.4445 -3.3786 -3.3786 -3.3736 -3.3736 -3.3690 -3.3690 -3.3389 -3.3389 -3.3376 -3.3376 -3.2941 -3.2941 -3.2769 -3.2769 -3.2526 -3.2526 0.1335 0.1335 0.1382 0.1382 2.0386 2.0386 3.1563 3.1563 3.1679 3.1679 3.2324 3.2324 3.2811 3.2811 4.3872 4.3872 4.5351 4.5351 4.5821 4.5821 5.4141 5.4141 5.4563 5.4563 5.5343 5.5343 5.6449 5.6450 5.6813 5.6813 7.5135 7.5135 8.0117 8.0117 8.0701 8.0701 8.5893 8.5893 8.6579 8.6579 9.2017 9.2017 9.2933 9.2933 9.3078 9.3078 k = 0.4500-0.3182 0.5511 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9918 -5.9918 -5.8176 -5.8176 -5.7919 -5.7919 -5.7627 -5.7627 -5.5447 -5.5447 -5.5427 -5.5427 -5.4983 -5.4983 -5.4400 -5.4400 -5.4016 -5.4016 -5.3619 -5.3619 -3.4453 -3.4453 -3.3782 -3.3782 -3.3741 -3.3741 -3.3691 -3.3691 -3.3392 -3.3392 -3.3383 -3.3383 -3.2922 -3.2922 -3.2783 -3.2783 -3.2530 -3.2530 0.1222 0.1222 0.1253 0.1253 2.0404 2.0404 3.1623 3.1623 3.1913 3.1913 3.2365 3.2365 3.2696 3.2696 4.3863 4.3863 4.5449 4.5449 4.5792 4.5792 5.4329 5.4329 5.4717 5.4717 5.5296 5.5296 5.6644 5.6644 5.6906 5.6906 7.5027 7.5027 8.0031 8.0031 8.0524 8.0524 8.6044 8.6044 8.6501 8.6501 9.1962 9.1962 9.2841 9.2841 9.2948 9.2948 k = 0.4625-0.3270 0.5664 ( 8448 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0495 -26.0495 -5.9886 -5.9886 -5.8181 -5.8181 -5.7881 -5.7881 -5.7659 -5.7659 -5.5446 -5.5446 -5.5433 -5.5433 -5.4977 -5.4977 -5.4316 -5.4316 -5.4027 -5.4027 -5.3715 -5.3715 -3.4459 -3.4459 -3.3778 -3.3778 -3.3748 -3.3748 -3.3689 -3.3689 -3.3394 -3.3394 -3.3389 -3.3389 -3.2904 -3.2904 -3.2798 -3.2798 -3.2532 -3.2532 0.1134 0.1134 0.1153 0.1153 2.0417 2.0417 3.1613 3.1613 3.2161 3.2161 3.2398 3.2398 3.2613 3.2613 4.3844 4.3844 4.5529 4.5529 4.5762 4.5762 5.4503 5.4503 5.4835 5.4835 5.5234 5.5234 5.6797 5.6797 5.6976 5.6976 7.4948 7.4948 7.9980 7.9980 8.0368 8.0368 8.6166 8.6166 8.6442 8.6442 9.1917 9.1917 9.2757 9.2757 9.2832 9.2832 k = 0.4750-0.3359 0.5818 ( 8464 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9863 -5.9863 -5.8187 -5.8187 -5.7841 -5.7841 -5.7692 -5.7692 -5.5445 -5.5445 -5.5438 -5.5438 -5.4972 -5.4972 -5.4230 -5.4230 -5.4037 -5.4037 -5.3808 -5.3808 -3.4464 -3.4464 -3.3774 -3.3774 -3.3754 -3.3754 -3.3687 -3.3687 -3.3395 -3.3395 -3.3393 -3.3393 -3.2885 -3.2885 -3.2815 -3.2815 -3.2534 -3.2534 0.1072 0.1072 0.1081 0.1081 2.0426 2.0426 3.1600 3.1600 3.2341 3.2341 3.2422 3.2422 3.2566 3.2566 4.3823 4.3823 4.5592 4.5592 4.5733 4.5733 5.4662 5.4662 5.4918 5.4918 5.5157 5.5157 5.6910 5.6910 5.7021 5.7021 7.4894 7.4894 7.9967 7.9967 8.0235 8.0235 8.6256 8.6256 8.6401 8.6401 9.1884 9.1884 9.2693 9.2693 9.2740 9.2740 k = 0.4875-0.3447 0.5971 ( 8456 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9849 -5.9849 -5.8191 -5.8191 -5.7801 -5.7801 -5.7727 -5.7727 -5.5444 -5.5444 -5.5441 -5.5441 -5.4970 -5.4970 -5.4146 -5.4146 -5.4048 -5.4048 -5.3890 -5.3890 -3.4467 -3.4467 -3.3770 -3.3770 -3.3760 -3.3760 -3.3685 -3.3685 -3.3396 -3.3396 -3.3396 -3.3396 -3.2867 -3.2867 -3.2831 -3.2831 -3.2535 -3.2535 0.1034 0.1034 0.1037 0.1037 2.0431 2.0431 3.1590 3.1590 3.2427 3.2427 3.2437 3.2437 3.2566 3.2566 4.3806 4.3806 4.5640 4.5640 4.5706 4.5706 5.4805 5.4805 5.4962 5.4962 5.5069 5.5069 5.6987 5.6987 5.7040 5.7040 7.4862 7.4862 7.9989 7.9989 8.0126 8.0126 8.6316 8.6316 8.6373 8.6373 9.1865 9.1865 9.2655 9.2655 9.2677 9.2677 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9844 -5.9844 -5.8193 -5.8193 -5.7763 -5.7763 -5.7763 -5.7763 -5.5443 -5.5443 -5.5443 -5.5443 -5.4969 -5.4969 -5.4078 -5.4078 -5.4078 -5.4078 -5.3931 -5.3931 -3.4468 -3.4468 -3.3765 -3.3765 -3.3765 -3.3765 -3.3684 -3.3684 -3.3397 -3.3397 -3.3397 -3.3397 -3.2849 -3.2849 -3.2849 -3.2849 -3.2535 -3.2535 0.1022 0.1022 0.1022 0.1022 2.0433 2.0433 3.1587 3.1587 3.2442 3.2442 3.2442 3.2442 3.2581 3.2581 4.3800 4.3800 4.5677 4.5677 4.5677 4.5677 5.4925 5.4925 5.4925 5.4925 5.5020 5.5020 5.7029 5.7029 5.7029 5.7029 7.4852 7.4852 8.0043 8.0043 8.0043 8.0043 8.6350 8.6350 8.6350 8.6350 9.1858 9.1858 9.2648 9.2648 9.2648 9.2648 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9844 -5.9844 -5.8193 -5.8193 -5.7763 -5.7763 -5.7763 -5.7763 -5.5443 -5.5443 -5.5443 -5.5443 -5.4969 -5.4969 -5.4078 -5.4078 -5.4078 -5.4078 -5.3931 -5.3931 -3.4468 -3.4468 -3.3765 -3.3765 -3.3765 -3.3765 -3.3684 -3.3684 -3.3397 -3.3397 -3.3397 -3.3397 -3.2849 -3.2849 -3.2849 -3.2849 -3.2535 -3.2535 0.1022 0.1022 0.1022 0.1022 2.0433 2.0433 3.1587 3.1587 3.2442 3.2442 3.2442 3.2442 3.2581 3.2581 4.3800 4.3800 4.5677 4.5677 4.5677 4.5677 5.4925 5.4925 5.4925 5.4925 5.5020 5.5020 5.7029 5.7029 5.7029 5.7029 7.4852 7.4852 8.0043 8.0043 8.0043 8.0043 8.6350 8.6350 8.6350 8.6350 9.1858 9.1858 9.2648 9.2648 9.2648 9.2648 k = 0.4828-0.3414 0.6124 ( 8456 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9848 -5.9848 -5.8191 -5.8191 -5.7814 -5.7777 -5.7750 -5.7715 -5.5444 -5.5443 -5.5442 -5.5441 -5.4970 -5.4970 -5.4148 -5.4123 -5.4097 -5.4012 -5.3897 -5.3890 -3.4467 -3.4467 -3.3771 -3.3767 -3.3763 -3.3758 -3.3685 -3.3685 -3.3397 -3.3397 -3.3395 -3.3395 -3.2873 -3.2855 -3.2843 -3.2825 -3.2535 -3.2535 0.1033 0.1035 0.1035 0.1037 2.0431 2.0431 3.1589 3.1591 3.2414 3.2428 3.2439 3.2445 3.2561 3.2575 4.3805 4.3806 4.5622 4.5670 4.5693 4.5709 5.4781 5.4852 5.4906 5.5028 5.5040 5.5068 5.6979 5.7005 5.7024 5.7049 7.4861 7.4862 7.9964 8.0032 8.0083 8.0147 8.6308 8.6339 8.6354 8.6379 9.1864 9.1865 9.2654 9.2657 9.2664 9.2684 k = 0.4655-0.3292 0.6124 ( 8460 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9862 -5.9861 -5.8188 -5.8186 -5.7868 -5.7789 -5.7738 -5.7670 -5.5445 -5.5442 -5.5441 -5.5437 -5.4973 -5.4972 -5.4227 -5.4183 -5.4150 -5.3947 -5.3833 -5.3809 -3.4464 -3.4464 -3.3776 -3.3768 -3.3763 -3.3749 -3.3687 -3.3686 -3.3397 -3.3397 -3.3392 -3.3391 -3.2897 -3.2863 -3.2838 -3.2802 -3.2534 -3.2534 0.1069 0.1073 0.1074 0.1078 2.0426 2.0426 3.1590 3.1604 3.2278 3.2350 3.2443 3.2455 3.2544 3.2606 4.3819 4.3823 4.5545 4.5673 4.5705 4.5732 5.4613 5.4735 5.4827 5.5065 5.5078 5.5165 5.6896 5.6954 5.6991 5.7041 7.4888 7.4895 7.9912 8.0048 8.0159 8.0272 8.6247 8.6327 8.6339 8.6403 9.1878 9.1889 9.2690 9.2698 9.2701 9.2765 k = 0.4483-0.3170 0.6124 ( 8442 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0495 -26.0495 -5.9883 -5.9882 -5.8184 -5.8179 -5.7924 -5.7800 -5.7729 -5.7628 -5.5446 -5.5441 -5.5440 -5.5432 -5.4979 -5.4975 -5.4308 -5.4240 -5.4209 -5.3882 -5.3760 -5.3720 -3.4460 -3.4460 -3.3780 -3.3768 -3.3763 -3.3739 -3.3690 -3.3688 -3.3398 -3.3397 -3.3387 -3.3384 -3.2921 -3.2870 -3.2833 -3.2780 -3.2533 -3.2532 0.1130 0.1136 0.1139 0.1145 2.0417 2.0417 3.1563 3.1621 3.2043 3.2192 3.2463 3.2472 3.2572 3.2675 4.3833 4.3845 4.5446 4.5686 4.5687 4.5777 5.4420 5.4585 5.4711 5.5081 5.5106 5.5249 5.6784 5.6880 5.6933 5.7011 7.4930 7.4952 7.9888 8.0090 8.0273 8.0413 8.6166 8.6297 8.6320 8.6427 9.1900 9.1936 9.2747 9.2748 9.2782 9.2888 k = 0.4310-0.3048 0.6124 ( 8426 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -5.9913 -5.9911 -5.8180 -5.8168 -5.7982 -5.7807 -5.7722 -5.7590 -5.5446 -5.5440 -5.5438 -5.5424 -5.4989 -5.4979 -5.4385 -5.4294 -5.4267 -5.3816 -5.3684 -5.3630 -3.4454 -3.4453 -3.3783 -3.3767 -3.3765 -3.3728 -3.3695 -3.3688 -3.3399 -3.3398 -3.3381 -3.3375 -3.2944 -3.2879 -3.2829 -3.2758 -3.2532 -3.2529 0.1215 0.1223 0.1230 0.1239 2.0402 2.0403 3.1443 3.1574 3.1799 3.2042 3.2497 3.2498 3.2629 3.2770 4.3836 4.3861 4.5324 4.5641 4.5712 4.5841 5.4198 5.4400 5.4556 5.5087 5.5109 5.5316 5.6645 5.6793 5.6857 5.6964 7.4988 7.5035 7.9886 8.0162 8.0426 8.0570 8.6063 8.6222 8.6319 8.6455 9.1927 9.2008 9.2801 9.2825 9.2892 9.3051 k = 0.4138-0.2926 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -5.9950 -5.9946 -5.8179 -5.8155 -5.8040 -5.7810 -5.7719 -5.7556 -5.5445 -5.5440 -5.5434 -5.5415 -5.5004 -5.4983 -5.4453 -5.4344 -5.4322 -5.3751 -5.3607 -5.3542 -3.4447 -3.4445 -3.3786 -3.3768 -3.3764 -3.3716 -3.3701 -3.3688 -3.3399 -3.3399 -3.3375 -3.3363 -3.2968 -3.2887 -3.2826 -3.2738 -3.2530 -3.2524 0.1325 0.1335 0.1346 0.1357 2.0381 2.0382 3.1165 3.1244 3.1778 3.1981 3.2534 3.2545 3.2712 3.2886 4.3821 4.3861 4.5180 4.5567 4.5751 4.5923 5.3948 5.4181 5.4358 5.5079 5.5082 5.5361 5.6489 5.6704 5.6764 5.6908 7.5060 7.5143 7.9899 8.0272 8.0598 8.0755 8.5939 8.6111 8.6328 8.6488 9.1956 9.2108 9.2855 9.2914 9.3029 9.3248 k = 0.3966-0.2804 0.6124 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9993 -5.9986 -5.8185 -5.8141 -5.8096 -5.7808 -5.7721 -5.7524 -5.5445 -5.5440 -5.5430 -5.5403 -5.5025 -5.4988 -5.4509 -5.4390 -5.4374 -5.3685 -5.3529 -5.3457 -3.4438 -3.4436 -3.3788 -3.3773 -3.3760 -3.3708 -3.3704 -3.3685 -3.3400 -3.3400 -3.3369 -3.3349 -3.2991 -3.2896 -3.2823 -3.2718 -3.2529 -3.2519 0.1459 0.1471 0.1487 0.1500 2.0352 2.0353 3.0767 3.0795 3.1831 3.1985 3.2584 3.2605 3.2824 3.3022 4.3781 4.3834 4.5017 4.5465 4.5805 4.6022 5.3668 5.3928 5.4112 5.5000 5.5061 5.5385 5.6324 5.6631 5.6660 5.6852 7.5148 7.5271 7.9921 8.0431 8.0752 8.1000 8.5794 8.5962 8.6351 8.6529 9.1984 9.2230 9.2904 9.3007 9.3188 9.3471 k = 0.3793-0.2682 0.6124 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0042 -6.0032 -5.8206 -5.8141 -5.8127 -5.7799 -5.7728 -5.7497 -5.5444 -5.5441 -5.5426 -5.5389 -5.5053 -5.4994 -5.4552 -5.4432 -5.4423 -5.3621 -5.3452 -5.3376 -3.4427 -3.4425 -3.3789 -3.3778 -3.3755 -3.3714 -3.3695 -3.3677 -3.3402 -3.3401 -3.3364 -3.3334 -3.3014 -3.2905 -3.2822 -3.2700 -3.2528 -3.2513 0.1616 0.1630 0.1651 0.1667 2.0311 2.0314 3.0296 3.0301 3.1899 3.2014 3.2648 3.2679 3.2963 3.3178 4.3710 4.3770 4.4834 4.5335 4.5874 4.6132 5.3362 5.3641 5.3818 5.4862 5.5022 5.5387 5.6159 5.6544 5.6589 5.6807 7.5250 7.5415 7.9947 8.0647 8.0874 8.1312 8.5629 8.5776 8.6392 8.6580 9.2008 9.2364 9.2948 9.3093 9.3367 9.3709 k = 0.3621-0.2560 0.6124 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0095 -6.0082 -5.8250 -5.8167 -5.8112 -5.7786 -5.7740 -5.7472 -5.5443 -5.5442 -5.5421 -5.5374 -5.5088 -5.5000 -5.4581 -5.4470 -5.4468 -5.3557 -5.3375 -5.3299 -3.4416 -3.4412 -3.3790 -3.3784 -3.3749 -3.3721 -3.3691 -3.3663 -3.3404 -3.3402 -3.3360 -3.3317 -3.3036 -3.2914 -3.2821 -3.2683 -3.2527 -3.2506 0.1797 0.1812 0.1838 0.1856 2.0255 2.0260 2.9769 2.9797 3.1971 3.2052 3.2730 3.2767 3.3130 3.3353 4.3608 4.3664 4.4635 4.5176 4.5955 4.6250 5.3030 5.3326 5.3475 5.4661 5.4959 5.5367 5.5996 5.6419 5.6585 5.6780 7.5367 7.5567 7.9975 8.0923 8.0967 8.1681 8.5446 8.5557 8.6456 8.6645 9.2026 9.2497 9.2991 9.3163 9.3562 9.3951 k = 0.3448-0.2438 0.6124 ( 8414 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0152 -6.0135 -5.8305 -5.8184 -5.8097 -5.7768 -5.7759 -5.7452 -5.5445 -5.5441 -5.5416 -5.5356 -5.5126 -5.5005 -5.4596 -5.4509 -5.4504 -5.3495 -5.3300 -5.3228 -3.4403 -3.4398 -3.3789 -3.3789 -3.3744 -3.3725 -3.3688 -3.3646 -3.3406 -3.3403 -3.3358 -3.3300 -3.3058 -3.2923 -3.2820 -3.2667 -3.2526 -3.2499 0.2000 0.2017 0.2046 0.2067 2.0180 2.0188 2.9230 2.9273 3.2043 3.2093 3.2833 3.2868 3.3323 3.3546 4.3473 4.3512 4.4420 4.4990 4.6046 4.6371 5.2672 5.2991 5.3087 5.4408 5.4871 5.5325 5.5836 5.6284 5.6618 5.6777 7.5494 7.5721 8.0003 8.1030 8.1261 8.2097 8.5251 8.5311 8.6546 8.6729 9.2038 9.2611 9.3039 9.3209 9.3767 9.4185 k = 0.3276-0.2316 0.6124 ( 8418 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0212 -6.0190 -5.8363 -5.8200 -5.8084 -5.7784 -5.7747 -5.7435 -5.5450 -5.5440 -5.5411 -5.5338 -5.5165 -5.5010 -5.4602 -5.4547 -5.4531 -5.3434 -5.3226 -5.3162 -3.4389 -3.4383 -3.3793 -3.3788 -3.3745 -3.3722 -3.3686 -3.3628 -3.3409 -3.3404 -3.3356 -3.3281 -3.3079 -3.2931 -3.2821 -3.2653 -3.2526 -3.2491 0.2225 0.2244 0.2273 0.2296 2.0080 2.0093 2.8693 2.8747 3.2110 3.2132 3.2959 3.2983 3.3541 3.3758 4.3303 4.3314 4.4193 4.4778 4.6143 4.6491 5.2284 5.2649 5.2657 5.4121 5.4758 5.5263 5.5675 5.6141 5.6681 5.6799 7.5630 7.5871 8.0030 8.1063 8.1655 8.2547 8.5046 8.5053 8.6666 8.6835 9.2044 9.2689 9.3098 9.3224 9.3980 9.4403 k = 0.3103-0.2194 0.6124 ( 8420 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0273 -6.0247 -5.8421 -5.8216 -5.8072 -5.7816 -5.7723 -5.7421 -5.5455 -5.5439 -5.5406 -5.5318 -5.5202 -5.5014 -5.4604 -5.4582 -5.4547 -5.3376 -5.3155 -5.3103 -3.4374 -3.4366 -3.3795 -3.3787 -3.3750 -3.3713 -3.3685 -3.3610 -3.3412 -3.3405 -3.3357 -3.3263 -3.3099 -3.2939 -3.2821 -3.2641 -3.2526 -3.2484 0.2472 0.2493 0.2517 0.2544 1.9949 1.9969 2.8173 2.8233 3.2170 3.2171 3.3109 3.3112 3.3781 3.3987 4.3071 4.3099 4.3953 4.4543 4.6242 4.6606 5.1860 5.2192 5.2318 5.3814 5.4621 5.5181 5.5509 5.5991 5.6766 5.6844 7.5771 7.6014 8.0053 8.1065 8.2090 8.3007 8.4777 8.4870 8.6821 8.6970 9.2049 9.2737 9.3158 9.3208 9.4196 9.4600 k = 0.2931-0.2073 0.6124 ( 8426 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0336 -6.0306 -5.8477 -5.8231 -5.8063 -5.7853 -5.7699 -5.7411 -5.5463 -5.5438 -5.5402 -5.5299 -5.5235 -5.5017 -5.4615 -5.4613 -5.4541 -5.3320 -5.3087 -5.3049 -3.4358 -3.4349 -3.3796 -3.3785 -3.3755 -3.3702 -3.3684 -3.3591 -3.3415 -3.3406 -3.3359 -3.3244 -3.3118 -3.2946 -3.2823 -3.2630 -3.2527 -3.2476 0.2740 0.2761 0.2778 0.2808 1.9780 1.9808 2.7682 2.7744 3.2205 3.2223 3.3255 3.3283 3.4042 3.4233 4.2787 4.2858 4.3702 4.4289 4.6340 4.6717 5.1399 5.1698 5.2010 5.3503 5.4461 5.5081 5.5335 5.5835 5.6866 5.6909 7.5913 7.6146 8.0071 8.1038 8.2534 8.3418 8.4535 8.4755 8.7012 8.7141 9.2052 9.2768 9.3163 9.3196 9.4411 9.4781 k = 0.2759-0.1951 0.6124 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0398 -6.0365 -5.8530 -5.8247 -5.8054 -5.7897 -5.7674 -5.7405 -5.5473 -5.5437 -5.5397 -5.5282 -5.5258 -5.5019 -5.4644 -5.4629 -5.4517 -5.3266 -5.3022 -5.3002 -3.4341 -3.4331 -3.3794 -3.3784 -3.3758 -3.3689 -3.3683 -3.3573 -3.3418 -3.3406 -3.3362 -3.3226 -3.3135 -3.2952 -3.2824 -3.2622 -3.2528 -3.2469 0.3027 0.3047 0.3053 0.3089 1.9567 1.9605 2.7234 2.7294 3.2237 3.2268 3.3411 3.3479 3.4323 3.4495 4.2468 4.2580 4.3437 4.4022 4.6435 4.6821 5.0908 5.1182 5.1729 5.3198 5.4282 5.4966 5.5150 5.5675 5.6976 5.6989 7.6051 7.6267 8.0081 8.0983 8.2903 8.3641 8.4393 8.4840 8.7244 8.7355 9.2058 9.2800 9.3101 9.3197 9.4624 9.4950 k = 0.2586-0.1829 0.6124 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0460 -6.0424 -5.8580 -5.8261 -5.8049 -5.7945 -5.7650 -5.7402 -5.5484 -5.5437 -5.5393 -5.5288 -5.5254 -5.5018 -5.4672 -5.4646 -5.4481 -5.3216 -5.2961 -5.2961 -3.4323 -3.4313 -3.3791 -3.3786 -3.3758 -3.3684 -3.3676 -3.3555 -3.3421 -3.3407 -3.3366 -3.3210 -3.3150 -3.2956 -3.2827 -3.2615 -3.2529 -3.2463 0.3326 0.3344 0.3345 0.3388 1.9302 1.9353 2.6837 2.6893 3.2266 3.2306 3.3579 3.3695 3.4620 3.4772 4.2119 4.2267 4.3159 4.3746 4.6524 4.6918 5.0395 5.0653 5.1478 5.2905 5.4085 5.4830 5.4960 5.5512 5.7082 5.7094 7.6181 7.6377 8.0082 8.0904 8.3041 8.3601 8.4496 8.5188 8.7518 8.7620 9.2064 9.2837 9.3037 9.3159 9.4833 9.5116 k = 0.2414-0.1707 0.6124 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0521 -6.0483 -5.8627 -5.8274 -5.8045 -5.7998 -5.7627 -5.7403 -5.5495 -5.5438 -5.5389 -5.5302 -5.5237 -5.5016 -5.4697 -5.4662 -5.4436 -5.3170 -5.2925 -5.2904 -3.4305 -3.4295 -3.3790 -3.3786 -3.3754 -3.3685 -3.3662 -3.3539 -3.3424 -3.3407 -3.3371 -3.3199 -3.3159 -3.2958 -3.2830 -3.2610 -3.2531 -3.2459 0.3623 0.3644 0.3667 0.3711 1.8984 1.9049 2.6500 2.6548 3.2290 3.2336 3.3759 3.3928 3.4934 3.5063 4.1749 4.1922 4.2865 4.3463 4.6604 4.7005 4.9871 5.0121 5.1256 5.2631 5.3872 5.4649 5.4790 5.5348 5.7183 5.7215 7.6300 7.6474 8.0074 8.0804 8.2920 8.3425 8.4859 8.5661 8.7836 8.7943 9.2066 9.2863 9.2993 9.3113 9.5035 9.5281 k = 0.2241-0.1585 0.6124 ( 8414 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0581 -6.0541 -5.8670 -5.8285 -5.8057 -5.8041 -5.7605 -5.7406 -5.5506 -5.5440 -5.5385 -5.5312 -5.5220 -5.5011 -5.4722 -5.4677 -5.4383 -5.3129 -5.2895 -5.2851 -3.4287 -3.4277 -3.3796 -3.3779 -3.3747 -3.3686 -3.3648 -3.3523 -3.3428 -3.3408 -3.3376 -3.3203 -3.3153 -3.2958 -3.2833 -3.2607 -3.2532 -3.2455 0.3921 0.3945 0.4011 0.4055 1.8613 1.8691 2.6225 2.6264 3.2310 3.2360 3.3951 3.4179 3.5261 3.5366 4.1364 4.1552 4.2557 4.3174 4.6670 4.7078 4.9349 4.9595 5.1063 5.2378 5.3644 5.4418 5.4650 5.5184 5.7290 5.7337 7.6405 7.6559 8.0055 8.0686 8.2678 8.3201 8.5330 8.6160 8.8192 8.8328 9.2059 9.2812 9.2994 9.3142 9.5230 9.5446 k = 0.2069-0.1463 0.6124 ( 8414 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0638 -6.0597 -5.8708 -5.8294 -5.8114 -5.8044 -5.7584 -5.7411 -5.5516 -5.5444 -5.5381 -5.5319 -5.5203 -5.5004 -5.4744 -5.4690 -5.4323 -5.3094 -5.2868 -5.2803 -3.4268 -3.4259 -3.3802 -3.3770 -3.3739 -3.3689 -3.3634 -3.3510 -3.3431 -3.3409 -3.3381 -3.3215 -3.3138 -3.2955 -3.2837 -3.2607 -3.2534 -3.2453 0.4220 0.4246 0.4371 0.4417 1.8192 1.8283 2.6011 2.6041 3.2325 3.2376 3.4154 3.4444 3.5599 3.5680 4.0972 4.1165 4.2234 4.2881 4.6713 4.7123 4.8849 4.9094 5.0898 5.2147 5.3404 5.4155 5.4523 5.5024 5.7400 5.7459 7.6493 7.6630 8.0026 8.0556 8.2400 8.2963 8.5820 8.6645 8.8574 8.8769 9.2048 9.2687 9.3054 9.3261 9.5418 9.5610 k = 0.1897-0.1341 0.6124 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0692 -6.0650 -5.8741 -5.8301 -5.8175 -5.8048 -5.7566 -5.7418 -5.5524 -5.5448 -5.5377 -5.5324 -5.5187 -5.4995 -5.4766 -5.4702 -5.4257 -5.3068 -5.2843 -5.2760 -3.4250 -3.4242 -3.3808 -3.3760 -3.3730 -3.3692 -3.3620 -3.3499 -3.3434 -3.3411 -3.3385 -3.3229 -3.3120 -3.2950 -3.2842 -3.2608 -3.2536 -3.2453 0.4517 0.4544 0.4747 0.4796 1.7727 1.7831 2.5854 2.5874 3.2334 3.2386 3.4367 3.4722 3.5947 3.6003 4.0581 4.0769 4.1897 4.2582 4.6712 4.7105 4.8413 4.8641 5.0759 5.1938 5.3154 5.3872 5.4404 5.4868 5.7510 5.7577 7.6564 7.6688 7.9987 8.0416 8.2119 8.2724 8.6298 8.7106 8.8954 8.9245 9.2048 9.2544 9.3175 9.3433 9.5597 9.5772 k = 0.1724-0.1219 0.6124 ( 8428 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0742 -6.0702 -5.8769 -5.8305 -5.8237 -5.8055 -5.7550 -5.7425 -5.5530 -5.5453 -5.5374 -5.5327 -5.5171 -5.4984 -5.4788 -5.4714 -5.4186 -5.3051 -5.2818 -5.2721 -3.4232 -3.4226 -3.3813 -3.3750 -3.3719 -3.3695 -3.3607 -3.3490 -3.3438 -3.3415 -3.3387 -3.3243 -3.3101 -3.2943 -3.2847 -3.2612 -3.2538 -3.2454 0.4808 0.4835 0.5136 0.5188 1.7229 1.7341 2.5745 2.5758 3.2338 3.2389 3.4590 3.5012 3.6301 3.6331 4.0199 4.0375 4.1549 4.2277 4.6633 4.6954 4.8120 4.8278 5.0643 5.1752 5.2898 5.3575 5.4291 5.4718 5.7619 5.7691 7.6618 7.6731 7.9938 8.0272 8.1853 8.2489 8.6756 8.7543 8.9299 8.9720 9.2084 9.2419 9.3349 9.3644 9.5768 9.5932 k = 0.1552-0.1097 0.6124 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0789 -6.0750 -5.8792 -5.8307 -5.8299 -5.8063 -5.7535 -5.7433 -5.5534 -5.5459 -5.5370 -5.5328 -5.5155 -5.4972 -5.4808 -5.4724 -5.4111 -5.3046 -5.2793 -5.2687 -3.4214 -3.4210 -3.3818 -3.3741 -3.3708 -3.3698 -3.3594 -3.3483 -3.3440 -3.3421 -3.3386 -3.3257 -3.3082 -3.2932 -3.2852 -3.2618 -3.2540 -3.2457 0.5090 0.5116 0.5537 0.5593 1.6706 1.6825 2.5677 2.5683 3.2336 3.2385 3.4823 3.5313 3.6658 3.6662 3.9834 3.9992 4.1193 4.1966 4.6437 4.6633 4.8012 4.8047 5.0550 5.1587 5.2640 5.3267 5.4186 5.4575 5.7725 5.7798 7.6656 7.6759 7.9878 8.0127 8.1611 8.2265 8.7198 8.7961 8.9579 9.0140 9.2176 9.2353 9.3562 9.3882 9.5931 9.6090 k = 0.1379-0.0975 0.6124 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0832 -6.0795 -5.8810 -5.8360 -5.8306 -5.8075 -5.7523 -5.7441 -5.5536 -5.5465 -5.5366 -5.5329 -5.5140 -5.4959 -5.4827 -5.4735 -5.4032 -5.3051 -5.2768 -5.2659 -3.4197 -3.4196 -3.3821 -3.3735 -3.3698 -3.3697 -3.3583 -3.3480 -3.3442 -3.3427 -3.3384 -3.3271 -3.3062 -3.2920 -3.2858 -3.2625 -3.2541 -3.2461 0.5357 0.5383 0.5947 0.6006 1.6169 1.6292 2.5642 2.5643 3.2329 3.2374 3.5066 3.5622 3.6990 3.7013 3.9492 3.9628 4.0833 4.1649 4.6127 4.6210 4.7952 4.8025 5.0476 5.1440 5.2385 5.2955 5.4091 5.4441 5.7825 5.7897 7.6679 7.6775 7.9809 7.9984 8.1402 8.2052 8.7631 8.8361 8.9782 9.0442 9.2320 9.2391 9.3802 9.4137 9.6086 9.6245 k = 0.1207-0.0853 0.6124 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0870 -6.0836 -5.8822 -5.8420 -5.8302 -5.8088 -5.7513 -5.7448 -5.5537 -5.5472 -5.5362 -5.5330 -5.5124 -5.4946 -5.4846 -5.4745 -5.3952 -5.3067 -5.2741 -5.2635 -3.4182 -3.4181 -3.3824 -3.3735 -3.3692 -3.3686 -3.3572 -3.3479 -3.3444 -3.3434 -3.3381 -3.3284 -3.3042 -3.2906 -3.2865 -3.2636 -3.2541 -3.2467 0.5607 0.5631 0.6362 0.6424 1.5628 1.5753 2.5629 2.5630 3.2317 3.2358 3.5319 3.5939 3.7306 3.7361 3.9183 3.9291 4.0476 4.1329 4.5749 4.5757 4.7950 4.8093 5.0419 5.1311 5.2138 5.2642 5.4006 5.4317 5.7919 5.7988 7.6691 7.6779 7.9731 7.9849 8.1228 8.1854 8.8055 8.8736 8.9931 9.0592 9.2492 9.2550 9.4052 9.4391 9.6233 9.6400 k = 0.1034-0.0731 0.6124 ( 8406 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0903 -6.0873 -5.8828 -5.8477 -5.8296 -5.8103 -5.7504 -5.7455 -5.5536 -5.5479 -5.5358 -5.5331 -5.5107 -5.4934 -5.4863 -5.4755 -5.3871 -5.3093 -5.2715 -5.2616 -3.4170 -3.4167 -3.3825 -3.3740 -3.3683 -3.3674 -3.3563 -3.3481 -3.3445 -3.3439 -3.3377 -3.3296 -3.3023 -3.2889 -3.2872 -3.2648 -3.2541 -3.2473 0.5834 0.5856 0.6777 0.6841 1.5095 1.5218 2.5633 2.5636 3.2301 3.2338 3.5582 3.6261 3.7597 3.7693 3.8914 3.8988 4.0131 4.1007 4.5311 4.5347 4.8001 4.8184 5.0378 5.1196 5.1906 5.2336 5.3933 5.4203 5.8004 5.8068 7.6693 7.6773 7.9648 7.9723 8.1093 8.1672 8.8468 8.9064 9.0072 9.0623 9.2654 9.2781 9.4299 9.4626 9.6372 9.6551 k = 0.0862-0.0610 0.6124 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0931 -6.0905 -5.8828 -5.8532 -5.8288 -5.8120 -5.7497 -5.7461 -5.5535 -5.5486 -5.5354 -5.5331 -5.5090 -5.4927 -5.4874 -5.4766 -5.3789 -5.3128 -5.2690 -5.2602 -3.4159 -3.4154 -3.3824 -3.3748 -3.3673 -3.3664 -3.3554 -3.3485 -3.3445 -3.3445 -3.3372 -3.3307 -3.3004 -3.2880 -3.2871 -3.2662 -3.2539 -3.2480 0.6036 0.6054 0.7185 0.7250 1.4583 1.4700 2.5648 2.5652 3.2283 3.2314 3.5855 3.6585 3.7836 3.7993 3.8696 3.8729 3.9819 4.0689 4.4890 4.4952 4.8081 4.8283 5.0353 5.1093 5.1695 5.2043 5.3873 5.4101 5.8080 5.8136 7.6690 7.6761 7.9564 7.9610 8.0996 8.1507 8.8859 8.9307 9.0262 9.0603 9.2773 9.3010 9.4529 9.4825 9.6503 9.6693 k = 0.0690-0.0488 0.6124 ( 8398 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0954 -6.0932 -5.8823 -5.8583 -5.8277 -5.8139 -5.7491 -5.7465 -5.5532 -5.5492 -5.5351 -5.5332 -5.5073 -5.4931 -5.4875 -5.4777 -5.3708 -5.3170 -5.2667 -5.2593 -3.4149 -3.4144 -3.3822 -3.3757 -3.3663 -3.3654 -3.3547 -3.3490 -3.3449 -3.3447 -3.3367 -3.3317 -3.2987 -3.2889 -3.2851 -3.2679 -3.2537 -3.2488 0.6207 0.6222 0.7575 0.7638 1.4107 1.4213 2.5669 2.5672 3.2265 3.2290 3.6138 3.6905 3.7969 3.8218 3.8543 3.8549 3.9575 4.0385 4.4511 4.4584 4.8175 4.8378 5.0345 5.0998 5.1514 5.1773 5.3827 5.4012 5.8145 5.8192 7.6685 7.6744 7.9486 7.9514 8.0933 8.1360 8.9202 8.9452 9.0523 9.0595 9.2833 9.3177 9.4734 9.4980 9.6623 9.6814 k = 0.0517-0.0366 0.6124 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0971 -6.0955 -5.8812 -5.8630 -5.8264 -5.8158 -5.7487 -5.7469 -5.5529 -5.5499 -5.5347 -5.5333 -5.5055 -5.4944 -5.4866 -5.4789 -5.3628 -5.3220 -5.2646 -5.2589 -3.4141 -3.4136 -3.3818 -3.3767 -3.3654 -3.3646 -3.3540 -3.3496 -3.3452 -3.3449 -3.3362 -3.3326 -3.2971 -3.2898 -3.2829 -3.2697 -3.2534 -3.2496 0.6344 0.6356 0.7931 0.7987 1.3689 1.3779 2.5690 2.5693 3.2248 3.2267 3.6428 3.7213 3.7954 3.8221 3.8462 3.8552 3.9453 4.0110 4.4189 4.4260 4.8274 4.8457 5.0358 5.0903 5.1368 5.1539 5.3796 5.3936 5.8198 5.8234 7.6680 7.6726 7.9419 7.9435 8.0902 8.1232 8.9457 8.9528 9.0652 9.0813 9.2838 9.3246 9.4906 9.5090 9.6730 9.6903 k = 0.0345-0.0244 0.6124 ( 8412 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0983 -6.0971 -5.8795 -5.8673 -5.8249 -5.8177 -5.7483 -5.7472 -5.5525 -5.5505 -5.5344 -5.5335 -5.5036 -5.4961 -5.4854 -5.4801 -5.3550 -5.3276 -5.2628 -5.2588 -3.4135 -3.4131 -3.3813 -3.3777 -3.3646 -3.3641 -3.3533 -3.3503 -3.3454 -3.3451 -3.3357 -3.3333 -3.2956 -3.2908 -3.2807 -3.2717 -3.2530 -3.2504 0.6445 0.6453 0.8227 0.8271 1.3355 1.3423 2.5708 2.5711 3.2235 3.2248 3.6725 3.7485 3.7828 3.8103 3.8397 3.8618 3.9465 3.9890 4.3944 4.4001 4.8368 4.8509 5.0397 5.0800 5.1264 5.1357 5.3780 5.3874 5.8238 5.8263 7.6677 7.6709 7.9368 7.9377 8.0899 8.1123 8.9573 8.9594 9.0803 9.1063 9.2821 9.3209 9.5041 9.5160 9.6822 9.6951 k = 0.0172-0.0122 0.6124 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0494 -26.0494 -6.0988 -6.0983 -5.8773 -5.8711 -5.8232 -5.8196 -5.7480 -5.7475 -5.5521 -5.5510 -5.5341 -5.5337 -5.5017 -5.4979 -5.4840 -5.4814 -5.3475 -5.3338 -5.2612 -5.2593 -3.4131 -3.4129 -3.3805 -3.3787 -3.3641 -3.3638 -3.3526 -3.3511 -3.3454 -3.3452 -3.3351 -3.3340 -3.2942 -3.2918 -3.2784 -3.2739 -3.2525 -3.2511 0.6507 0.6512 0.8433 0.8458 1.3142 1.3178 2.5721 2.5722 3.2228 3.2234 3.7023 3.7554 3.7769 3.7995 3.8391 3.8585 3.9545 3.9740 4.3793 4.3825 4.8448 4.8525 5.0467 5.0684 5.1205 5.1243 5.3780 5.3828 5.8266 5.8278 7.6678 7.6694 7.9337 7.9341 8.0921 8.1035 8.9606 8.9636 9.1002 9.1193 9.2844 9.3091 9.5134 9.5192 9.6893 9.6962 k = 0.0000 0.0000 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0988 -6.0988 -5.8745 -5.8745 -5.8215 -5.8215 -5.7477 -5.7477 -5.5516 -5.5516 -5.5339 -5.5339 -5.4998 -5.4998 -5.4827 -5.4827 -5.3404 -5.3404 -5.2601 -5.2601 -3.4129 -3.4129 -3.3797 -3.3797 -3.3638 -3.3638 -3.3519 -3.3519 -3.3454 -3.3454 -3.3346 -3.3346 -3.2930 -3.2930 -3.2761 -3.2761 -3.2518 -3.2518 0.6530 0.6530 0.8515 0.8515 1.3079 1.3079 2.5726 2.5726 3.2227 3.2227 3.7311 3.7311 3.7893 3.7893 3.8476 3.8476 3.9637 3.9637 4.3753 4.3753 4.8503 4.8503 5.0566 5.0566 5.1196 5.1196 5.3796 5.3796 5.8279 5.8279 7.6683 7.6683 7.9328 7.9328 8.0967 8.0967 8.9630 8.9630 9.1161 9.1161 9.2945 9.2945 9.5184 9.5184 9.6941 9.6941 k = 0.0000 0.0000 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0988 -6.0988 -5.8745 -5.8745 -5.8215 -5.8215 -5.7477 -5.7477 -5.5516 -5.5516 -5.5339 -5.5339 -5.4998 -5.4998 -5.4827 -5.4827 -5.3404 -5.3404 -5.2601 -5.2601 -3.4129 -3.4129 -3.3797 -3.3797 -3.3638 -3.3638 -3.3519 -3.3519 -3.3454 -3.3454 -3.3346 -3.3346 -3.2930 -3.2930 -3.2761 -3.2761 -3.2518 -3.2518 0.6530 0.6530 0.8515 0.8515 1.3079 1.3079 2.5726 2.5726 3.2227 3.2227 3.7311 3.7311 3.7893 3.7893 3.8476 3.8476 3.9637 3.9637 4.3753 4.3753 4.8503 4.8503 5.0566 5.0566 5.1196 5.1196 5.3796 5.3796 5.8279 5.8279 7.6683 7.6683 7.9328 7.9328 8.0967 8.0967 8.9630 8.9630 9.1161 9.1161 9.2945 9.2945 9.5184 9.5184 9.6941 9.6941 k = 0.0000 0.0000 0.5913 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1014 -6.0985 -5.8796 -5.8684 -5.8228 -5.8203 -5.7553 -5.7401 -5.5521 -5.5511 -5.5358 -5.5320 -5.5003 -5.5000 -5.4891 -5.4748 -5.3447 -5.3360 -5.2653 -5.2546 -3.4130 -3.4127 -3.3806 -3.3792 -3.3641 -3.3639 -3.3524 -3.3506 -3.3456 -3.3447 -3.3352 -3.3338 -3.2946 -3.2913 -3.2763 -3.2759 -3.2523 -3.2514 0.6542 0.6544 0.8525 0.8530 1.3075 1.3089 2.5742 2.5742 3.2211 3.2230 3.7314 3.7327 3.7762 3.7954 3.8355 3.8560 3.9671 3.9707 4.3738 4.3749 4.8451 4.8497 5.0119 5.0648 5.1037 5.1632 5.3757 5.3771 5.8137 5.8340 7.6499 7.6935 7.9261 7.9423 8.0906 8.1018 8.9578 8.9681 9.0845 9.1568 9.2897 9.3008 9.5051 9.5395 9.6855 9.6963 k = 0.0000 0.0000 0.5701 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1059 -6.1005 -5.8834 -5.8614 -5.8242 -5.8192 -5.7627 -5.7326 -5.5527 -5.5506 -5.5376 -5.5301 -5.5033 -5.5003 -5.4922 -5.4662 -5.3489 -5.3314 -5.2702 -5.2491 -3.4132 -3.4126 -3.3819 -3.3794 -3.3647 -3.3642 -3.3522 -3.3490 -3.3454 -3.3438 -3.3357 -3.3329 -3.2961 -3.2897 -3.2765 -3.2756 -3.2526 -3.2508 0.6580 0.6583 0.8558 0.8568 1.3080 1.3108 2.5791 2.5792 3.2183 3.2220 3.7339 3.7340 3.7605 3.7886 3.8266 3.8603 3.9794 3.9862 4.3706 4.3728 4.8338 4.8426 4.9638 5.0143 5.1389 5.2002 5.3649 5.3693 5.7917 5.8319 7.6389 7.7245 7.9225 7.9541 8.0838 8.1062 8.9541 8.9714 9.0601 9.2074 9.2859 9.3092 9.4993 9.5682 9.6704 9.6925 k = 0.0000 0.0000 0.5490 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1123 -6.1048 -5.8861 -5.8540 -5.8258 -5.8183 -5.7699 -5.7252 -5.5533 -5.5502 -5.5394 -5.5283 -5.5086 -5.5005 -5.4920 -5.4571 -5.3527 -5.3268 -5.2747 -5.2435 -3.4134 -3.4125 -3.3833 -3.3804 -3.3659 -3.3638 -3.3519 -3.3474 -3.3444 -3.3426 -3.3360 -3.3318 -3.2976 -3.2880 -3.2767 -3.2752 -3.2529 -3.2503 0.6643 0.6649 0.8615 0.8631 1.3091 1.3133 2.5872 2.5875 3.2144 3.2199 3.7239 3.7389 3.7542 3.7685 3.8242 3.8627 3.9972 4.0065 4.3657 4.3687 4.8152 4.8274 4.9152 4.9621 5.1708 5.2265 5.3470 5.3591 5.7623 5.8217 7.6360 7.7608 7.9223 7.9674 8.0777 8.1107 8.9532 8.9724 9.0407 9.2662 9.2830 9.3208 9.5005 9.6026 9.6489 9.6845 k = 0.0000 0.0000 0.5279 ( 8418 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1202 -6.1112 -5.8875 -5.8463 -5.8274 -5.8176 -5.7768 -5.7180 -5.5540 -5.5500 -5.5411 -5.5266 -5.5142 -5.5006 -5.4903 -5.4477 -5.3562 -5.3222 -5.2788 -5.2380 -3.4137 -3.4124 -3.3848 -3.3821 -3.3674 -3.3629 -3.3517 -3.3459 -3.3427 -3.3410 -3.3361 -3.3306 -3.2990 -3.2864 -3.2768 -3.2747 -3.2531 -3.2497 0.6732 0.6739 0.8696 0.8717 1.3110 1.3166 2.5985 2.5990 3.2099 3.2167 3.7015 3.7413 3.7467 3.7590 3.8240 3.8650 4.0182 4.0288 4.3590 4.3627 4.7869 4.8007 4.8694 4.9141 5.1970 5.2363 5.3224 5.3518 5.7263 5.8038 7.6415 7.8015 7.9255 7.9809 8.0742 8.1167 8.9543 8.9708 9.0254 9.2809 9.3208 9.3451 9.5086 9.6214 9.6327 9.6818 k = 0.0000 0.0000 0.5068 ( 8418 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1294 -6.1195 -5.8877 -5.8387 -5.8290 -5.8170 -5.7834 -5.7114 -5.5546 -5.5499 -5.5428 -5.5259 -5.5187 -5.5006 -5.4878 -5.4380 -5.3593 -5.3176 -5.2824 -5.2326 -3.4139 -3.4124 -3.3864 -3.3841 -3.3689 -3.3616 -3.3517 -3.3447 -3.3404 -3.3391 -3.3361 -3.3294 -3.3003 -3.2848 -3.2770 -3.2742 -3.2532 -3.2490 0.6846 0.6855 0.8800 0.8827 1.3136 1.3205 2.6129 2.6137 3.2049 3.2129 3.6756 3.7134 3.7543 3.7664 3.8242 3.8683 4.0404 4.0516 4.3505 4.3545 4.7466 4.7594 4.8296 4.8749 5.2167 5.2252 5.2918 5.3518 5.6845 5.7787 7.6557 7.8460 7.9320 7.9934 8.0759 8.1253 8.9535 8.9663 9.0164 9.2797 9.3426 9.4050 9.5255 9.5885 9.6298 9.7120 k = 0.0000 0.0000 0.4857 ( 8416 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1397 -6.1295 -5.8870 -5.8329 -5.8291 -5.8166 -5.7895 -5.7053 -5.5551 -5.5499 -5.5444 -5.5283 -5.5197 -5.5005 -5.4846 -5.4281 -5.3618 -5.3131 -5.2855 -5.2275 -3.4142 -3.4124 -3.3881 -3.3864 -3.3701 -3.3601 -3.3518 -3.3436 -3.3383 -3.3369 -3.3355 -3.3280 -3.3015 -3.2832 -3.2772 -3.2736 -3.2533 -3.2484 0.6985 0.6994 0.8926 0.8960 1.3169 1.3250 2.6304 2.6315 3.1997 3.2086 3.6484 3.6837 3.7628 3.7736 3.8251 3.8735 4.0629 4.0738 4.3402 4.3441 4.6964 4.7055 4.7946 4.8431 5.1965 5.2249 5.2606 5.3565 5.6378 5.7473 7.6785 7.8934 7.9420 8.0040 8.0846 8.1375 8.9447 8.9590 9.0180 9.2791 9.3594 9.4606 9.5516 9.5571 9.6077 9.7606 k = 0.0000 0.0000 0.4646 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1509 -6.1407 -5.8856 -5.8336 -5.8230 -5.8165 -5.7951 -5.7000 -5.5557 -5.5501 -5.5459 -5.5324 -5.5184 -5.5003 -5.4807 -5.4181 -5.3638 -5.3086 -5.2881 -5.2227 -3.4144 -3.4124 -3.3898 -3.3888 -3.3710 -3.3585 -3.3519 -3.3426 -3.3373 -3.3347 -3.3337 -3.3266 -3.3025 -3.2817 -3.2774 -3.2729 -3.2533 -3.2478 0.7147 0.7158 0.9075 0.9115 1.3209 1.3301 2.6507 2.6523 3.1948 3.2043 3.6208 3.6536 3.7699 3.7791 3.8281 3.8812 4.0847 4.0949 4.3280 4.3313 4.6409 4.6444 4.7607 4.8142 5.1559 5.1984 5.2523 5.3604 5.5877 5.7106 7.7092 7.9415 7.9569 8.0135 8.1004 8.1542 8.9271 8.9487 9.0295 9.2786 9.3756 9.4856 9.5238 9.5799 9.6058 9.8133 k = 0.0000 0.0000 0.4434 ( 8418 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1627 -6.1530 -5.8836 -5.8355 -5.8168 -5.8162 -5.8000 -5.6956 -5.5562 -5.5505 -5.5474 -5.5367 -5.5166 -5.5001 -5.4761 -5.4081 -5.3650 -5.3042 -5.2902 -5.2184 -3.4147 -3.4125 -3.3916 -3.3913 -3.3715 -3.3569 -3.3519 -3.3417 -3.3369 -3.3325 -3.3310 -3.3251 -3.3033 -3.2803 -3.2776 -3.2722 -3.2532 -3.2472 0.7333 0.7344 0.9246 0.9291 1.3254 1.3358 2.6738 2.6761 3.1904 3.2002 3.5934 3.6235 3.7735 3.7821 3.8346 3.8918 4.1054 4.1144 4.3138 4.3159 4.5801 4.5833 4.7257 4.7850 5.1071 5.1505 5.2544 5.3611 5.5354 5.6698 7.7471 7.9683 7.9975 8.0241 8.1219 8.1757 8.9037 8.9356 9.0467 9.2773 9.3889 9.4554 9.5378 9.5497 9.6582 9.8665 k = 0.0000 0.0000 0.4223 ( 8414 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1750 -6.1660 -5.8811 -5.8375 -5.8178 -5.8098 -5.8039 -5.6923 -5.5568 -5.5510 -5.5488 -5.5406 -5.5146 -5.4998 -5.4708 -5.3981 -5.3655 -5.2999 -5.2917 -5.2144 -3.4150 -3.4126 -3.3937 -3.3934 -3.3716 -3.3553 -3.3518 -3.3408 -3.3367 -3.3303 -3.3282 -3.3237 -3.3039 -3.2789 -3.2779 -3.2714 -3.2530 -3.2466 0.7540 0.7551 0.9437 0.9489 1.3305 1.3419 2.6996 2.7026 3.1868 3.1968 3.5666 3.5938 3.7729 3.7821 3.8452 3.9051 4.1244 4.1320 4.2975 4.2977 4.5145 4.5255 4.6886 4.7542 5.0519 5.0950 5.2539 5.3577 5.4826 5.6263 7.7910 7.9875 8.0376 8.0491 8.1477 8.2025 8.8765 8.9196 9.0669 9.2736 9.3821 9.4288 9.5198 9.5607 9.7016 9.9181 k = 0.0000 0.0000 0.4012 ( 8406 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1876 -6.1795 -5.8784 -5.8395 -5.8198 -5.8064 -5.8040 -5.6901 -5.5572 -5.5516 -5.5501 -5.5441 -5.5126 -5.4995 -5.4649 -5.3883 -5.3652 -5.2957 -5.2928 -5.2111 -3.4153 -3.4128 -3.3960 -3.3953 -3.3712 -3.3539 -3.3516 -3.3398 -3.3365 -3.3282 -3.3253 -3.3222 -3.3042 -3.2781 -3.2776 -3.2705 -3.2528 -3.2461 0.7768 0.7779 0.9648 0.9707 1.3361 1.3484 2.7277 2.7317 3.1842 3.1941 3.5405 3.5647 3.7685 3.7794 3.8587 3.9204 4.1410 4.1474 4.2769 4.2792 4.4489 4.4689 4.6492 4.7211 4.9914 5.0337 5.2500 5.3505 5.4309 5.5814 7.8391 8.0087 8.0548 8.1004 8.1774 8.2348 8.8467 8.9011 9.0886 9.2652 9.3378 9.4342 9.4931 9.5846 9.7355 9.9663 k = 0.0000 0.0000 0.3801 ( 8406 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2004 -6.1932 -5.8755 -5.8416 -5.8226 -5.8077 -5.7988 -5.6891 -5.5577 -5.5523 -5.5513 -5.5471 -5.5106 -5.4992 -5.4583 -5.3787 -5.3641 -5.2934 -5.2918 -5.2083 -3.4156 -3.4130 -3.3983 -3.3972 -3.3704 -3.3525 -3.3514 -3.3388 -3.3363 -3.3262 -3.3226 -3.3207 -3.3043 -3.2784 -3.2764 -3.2695 -3.2525 -3.2457 0.8015 0.8025 0.9879 0.9945 1.3421 1.3553 2.7581 2.7633 3.1829 3.1926 3.5154 3.5364 3.7611 3.7740 3.8740 3.9371 4.1541 4.1602 4.2539 4.2588 4.3841 4.4144 4.6076 4.6857 4.9263 4.9675 5.2428 5.3399 5.3817 5.5365 7.8895 8.0320 8.0763 8.1495 8.2109 8.2728 8.8149 8.8801 9.1107 9.2502 9.2834 9.4458 9.4723 9.6092 9.7640 10.0098 k = 0.0000 0.0000 0.3590 ( 8402 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2132 -6.2069 -5.8725 -5.8437 -5.8257 -5.8081 -5.7942 -5.6893 -5.5581 -5.5532 -5.5525 -5.5497 -5.5086 -5.4988 -5.4510 -5.3693 -5.3623 -5.2935 -5.2880 -5.2062 -3.4159 -3.4133 -3.4005 -3.3991 -3.3692 -3.3514 -3.3510 -3.3377 -3.3360 -3.3243 -3.3200 -3.3192 -3.3042 -3.2787 -3.2754 -3.2685 -3.2522 -3.2454 0.8279 0.8288 1.0128 1.0200 1.3486 1.3624 2.7905 2.7971 3.1831 3.1924 3.4916 3.5092 3.7513 3.7662 3.8899 3.9544 4.1608 4.1701 4.2312 4.2364 4.3206 4.3629 4.5644 4.6481 4.8574 4.8968 5.2330 5.3266 5.3366 5.4929 7.9401 8.0572 8.1019 8.1955 8.2483 8.3157 8.7818 8.8571 9.1316 9.2263 9.2289 9.4578 9.4591 9.6344 9.7906 10.0473 k = 0.0000 0.0000 0.3379 ( 8412 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2259 -6.2205 -5.8695 -5.8458 -5.8289 -5.8080 -5.7902 -5.6908 -5.5586 -5.5541 -5.5536 -5.5518 -5.5067 -5.4985 -5.4431 -5.3602 -5.3596 -5.2933 -5.2845 -5.2048 -3.4162 -3.4136 -3.4026 -3.4009 -3.3676 -3.3506 -3.3503 -3.3365 -3.3358 -3.3227 -3.3177 -3.3175 -3.3038 -3.2790 -3.2745 -3.2675 -3.2518 -3.2452 0.8557 0.8565 1.0393 1.0472 1.3553 1.3697 2.8247 2.8329 3.1850 3.1938 3.4693 3.4832 3.7392 3.7560 3.9055 3.9718 4.1537 4.1762 4.2125 4.2159 4.2590 4.3150 4.5198 4.6087 4.7854 4.8226 5.2208 5.2967 5.3113 5.4515 7.9885 8.0837 8.1315 8.2383 8.2900 8.3620 8.7480 8.8324 9.1448 9.1686 9.2085 9.4531 9.4697 9.6596 9.8172 10.0782 k = 0.0000 0.0000 0.3167 ( 8404 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2384 -6.2339 -5.8666 -5.8478 -5.8317 -5.8076 -5.7868 -5.6933 -5.5589 -5.5551 -5.5546 -5.5535 -5.5049 -5.4981 -5.4347 -5.3562 -5.3516 -5.2927 -5.2812 -5.2041 -3.4165 -3.4139 -3.4046 -3.4028 -3.3655 -3.3501 -3.3495 -3.3355 -3.3352 -3.3213 -3.3161 -3.3154 -3.3030 -3.2793 -3.2738 -3.2664 -3.2514 -3.2451 0.8846 0.8853 1.0674 1.0759 1.3622 1.3770 2.8604 2.8705 3.1887 3.1967 3.4486 3.4588 3.7250 3.7434 3.9199 3.9887 4.1295 4.1728 4.1911 4.2013 4.2121 4.2712 4.4744 4.5681 4.7113 4.7460 5.2068 5.2627 5.2947 5.4130 8.0331 8.1110 8.1645 8.2785 8.3357 8.4095 8.7142 8.8063 9.1114 9.1323 9.2097 9.4528 9.4822 9.6843 9.8445 10.1030 k = 0.0000 0.0000 0.2956 ( 8409 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2506 -6.2469 -5.8639 -5.8498 -5.8341 -5.8070 -5.7840 -5.6968 -5.5593 -5.5561 -5.5555 -5.5548 -5.5033 -5.4978 -5.4258 -5.3522 -5.3433 -5.2918 -5.2783 -5.2042 -3.4168 -3.4143 -3.4065 -3.4045 -3.3632 -3.3496 -3.3488 -3.3351 -3.3339 -3.3201 -3.3144 -3.3134 -3.3021 -3.2796 -3.2733 -3.2654 -3.2509 -3.2451 0.9145 0.9151 1.0969 1.1060 1.3694 1.3844 2.8972 2.9097 3.1944 3.2014 3.4298 3.4360 3.7085 3.7284 3.9316 4.0047 4.0969 4.1389 4.1534 4.1874 4.2090 4.2343 4.4284 4.5266 4.6363 4.6683 5.1910 5.2350 5.2774 5.3780 8.0731 8.1385 8.1994 8.3165 8.3844 8.4555 8.6815 8.7791 9.0561 9.0991 9.2302 9.4566 9.4959 9.7080 9.8730 10.1225 k = 0.0000 0.0000 0.2745 ( 8417 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2624 -6.2593 -5.8617 -5.8517 -5.8357 -5.8063 -5.7818 -5.7012 -5.5596 -5.5570 -5.5564 -5.5559 -5.5018 -5.4975 -5.4164 -5.3476 -5.3355 -5.2907 -5.2756 -5.2050 -3.4171 -3.4147 -3.4082 -3.4062 -3.3605 -3.3490 -3.3483 -3.3347 -3.3325 -3.3191 -3.3128 -3.3117 -3.3009 -3.2799 -3.2730 -3.2645 -3.2504 -3.2453 0.9449 0.9454 1.1276 1.1371 1.3766 1.3917 2.9350 2.9500 3.2021 3.2079 3.4130 3.4152 3.6900 3.7110 3.9385 4.0192 4.0635 4.0860 4.1222 4.1831 4.1836 4.2224 4.3819 4.4846 4.5622 4.5918 5.1745 5.2134 5.2600 5.3464 8.1091 8.1659 8.2348 8.3526 8.4334 8.4982 8.6517 8.7511 9.0039 9.0604 9.2571 9.4633 9.5115 9.7299 9.9031 10.1381 k = 0.0000 0.0000 0.2534 ( 8425 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2736 -6.2712 -5.8600 -5.8536 -5.8363 -5.8053 -5.7801 -5.7064 -5.5600 -5.5579 -5.5572 -5.5568 -5.5005 -5.4971 -5.4066 -5.3426 -5.3282 -5.2894 -5.2733 -5.2066 -3.4174 -3.4151 -3.4098 -3.4078 -3.3576 -3.3485 -3.3479 -3.3341 -3.3312 -3.3183 -3.3112 -3.3102 -3.2995 -3.2802 -3.2728 -3.2636 -3.2499 -3.2455 0.9755 0.9758 1.1592 1.1692 1.3838 1.3987 2.9732 2.9913 3.2118 3.2161 3.3966 3.3984 3.6694 3.6910 3.9364 4.0279 4.0348 4.0389 4.0898 4.1487 4.1751 4.2213 4.3336 4.4419 4.4917 4.5195 5.1584 5.1964 5.2431 5.3182 8.1417 8.1925 8.2691 8.3864 8.4771 8.5360 8.6290 8.7224 8.9562 9.0212 9.2872 9.4725 9.5293 9.7495 9.9349 10.1511 k = 0.0000 0.0000 0.2323 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.2843 -6.2824 -5.8592 -5.8553 -5.8358 -5.8043 -5.7789 -5.7121 -5.5602 -5.5587 -5.5580 -5.5576 -5.4994 -5.4968 -5.3964 -5.3372 -5.3214 -5.2881 -5.2714 -5.2090 -3.4176 -3.4155 -3.4113 -3.4094 -3.3545 -3.3480 -3.3476 -3.3334 -3.3298 -3.3177 -3.3097 -3.3089 -3.2980 -3.2804 -3.2727 -3.2630 -3.2494 -3.2457 1.0059 1.0061 1.1915 1.2017 1.3909 1.4055 3.0115 3.0330 3.2238 3.2261 3.3806 3.3863 3.6469 3.6687 3.9215 3.9853 4.0137 4.0434 4.0564 4.1170 4.1609 4.2198 4.2815 4.3974 4.4285 4.4562 5.1443 5.1826 5.2270 5.2931 8.1718 8.2179 8.3011 8.4172 8.5030 8.5674 8.6242 8.6938 8.9144 8.9836 9.3200 9.4842 9.5494 9.7664 9.9688 10.1627 k = 0.0000 0.0000 0.2112 ( 8429 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.2943 -6.2929 -5.8592 -5.8570 -5.8341 -5.8030 -5.7781 -5.7183 -5.5605 -5.5593 -5.5586 -5.5583 -5.4984 -5.4965 -5.3860 -5.3316 -5.3151 -5.2866 -5.2699 -5.2121 -3.4178 -3.4159 -3.4126 -3.4108 -3.3513 -3.3474 -3.3474 -3.3325 -3.3284 -3.3173 -3.3083 -3.3077 -3.2965 -3.2806 -3.2728 -3.2627 -3.2488 -3.2460 1.0356 1.0358 1.2240 1.2343 1.3979 1.4120 3.0495 3.0747 3.2375 3.2378 3.3677 3.3767 3.6229 3.6443 3.8963 3.9404 3.9944 4.0203 4.0525 4.0930 4.1379 4.2161 4.2243 4.3518 4.3764 4.4061 5.1328 5.1712 5.2122 5.2707 8.2000 8.2418 8.3296 8.4439 8.5013 8.5905 8.6457 8.6674 8.8797 8.9486 9.3550 9.4985 9.5715 9.7801 10.0048 10.1737 k = 0.0000 0.0000 0.1900 ( 8423 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3035 -6.3025 -5.8597 -5.8585 -5.8314 -5.8017 -5.7777 -5.7249 -5.5607 -5.5598 -5.5592 -5.5590 -5.4976 -5.4962 -5.3754 -5.3259 -5.3093 -5.2852 -5.2688 -5.2160 -3.4180 -3.4163 -3.4138 -3.4121 -3.3487 -3.3472 -3.3463 -3.3315 -3.3272 -3.3169 -3.3070 -3.3066 -3.2949 -3.2808 -3.2731 -3.2628 -3.2483 -3.2462 1.0643 1.0644 1.2564 1.2666 1.4046 1.4180 3.0868 3.1158 3.2500 3.2539 3.3584 3.3699 3.5977 3.6180 3.8669 3.8989 3.9687 3.9846 4.0573 4.0791 4.1035 4.1589 4.2141 4.3118 4.3362 4.3672 5.1241 5.1616 5.1987 5.2507 8.2267 8.2636 8.3540 8.4651 8.4842 8.5973 8.6527 8.6802 8.8526 8.9171 9.3918 9.5158 9.5947 9.7904 10.0426 10.1848 k = 0.0000 0.0000 0.1689 ( 8425 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3120 -6.3112 -5.8605 -5.8599 -5.8280 -5.8003 -5.7777 -5.7317 -5.5609 -5.5602 -5.5597 -5.5595 -5.4969 -5.4960 -5.3647 -5.3201 -5.3041 -5.2838 -5.2681 -5.2207 -3.4182 -3.4166 -3.4149 -3.4133 -3.3477 -3.3471 -3.3436 -3.3304 -3.3259 -3.3168 -3.3059 -3.3056 -3.2933 -3.2808 -3.2734 -3.2632 -3.2477 -3.2463 1.0915 1.0915 1.2881 1.2981 1.4110 1.4235 3.1228 3.1557 3.2631 3.2717 3.3536 3.3661 3.5719 3.5904 3.8371 3.8611 3.9363 3.9486 4.0487 4.0681 4.0721 4.0924 4.2105 4.2830 4.3058 4.3355 5.1179 5.1537 5.1867 5.2327 8.2520 8.2831 8.3736 8.4637 8.4797 8.5797 8.6600 8.7151 8.8325 8.8896 9.4298 9.5362 9.6182 9.7970 10.0819 10.1967 k = 0.0000 0.0000 0.1478 ( 8431 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3196 -6.3191 -5.8615 -5.8612 -5.8241 -5.7987 -5.7781 -5.7387 -5.5611 -5.5606 -5.5602 -5.5600 -5.4964 -5.4957 -5.3538 -5.3144 -5.2994 -5.2826 -5.2680 -5.2260 -3.4184 -3.4170 -3.4158 -3.4144 -3.3474 -3.3471 -3.3403 -3.3292 -3.3248 -3.3168 -3.3049 -3.3047 -3.2918 -3.2808 -3.2739 -3.2641 -3.2472 -3.2463 1.1168 1.1168 1.3186 1.3281 1.4169 1.4284 3.1572 3.1932 3.2762 3.2908 3.3543 3.3654 3.5462 3.5622 3.8090 3.8269 3.9002 3.9126 3.9990 4.0250 4.0637 4.0688 4.2079 4.2644 4.2828 4.3087 5.1142 5.1472 5.1761 5.2164 8.2758 8.2999 8.3877 8.4450 8.4875 8.5530 8.6767 8.7455 8.8182 8.8662 9.4682 9.5597 9.6409 9.7998 10.1218 10.2097 k = 0.0000 0.0000 0.1267 ( 8441 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3262 -6.3259 -5.8625 -5.8623 -5.8197 -5.7971 -5.7787 -5.7458 -5.5613 -5.5609 -5.5606 -5.5605 -5.4959 -5.4955 -5.3429 -5.3087 -5.2953 -5.2815 -5.2683 -5.2321 -3.4185 -3.4173 -3.4166 -3.4153 -3.3472 -3.3470 -3.3370 -3.3280 -3.3239 -3.3169 -3.3040 -3.3039 -3.2902 -3.2808 -3.2744 -3.2654 -3.2467 -3.2462 1.1397 1.1397 1.3471 1.3559 1.4224 1.4326 3.1895 3.2265 3.2896 3.3104 3.3611 3.3684 3.5212 3.5341 3.7832 3.7966 3.8630 3.8771 3.9437 3.9619 4.0612 4.0643 4.2067 4.2526 4.2651 4.2860 5.1126 5.1422 5.1670 5.2015 8.2977 8.3137 8.3945 8.4321 8.4890 8.5260 8.6959 8.7699 8.8082 8.8469 9.5063 9.5854 9.6617 9.7986 10.1613 10.2240 k = 0.0000 0.0000 0.1056 ( 8431 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3320 -6.3318 -5.8633 -5.8633 -5.8149 -5.7954 -5.7796 -5.7529 -5.5614 -5.5611 -5.5609 -5.5608 -5.4955 -5.4953 -5.3321 -5.3033 -5.2916 -5.2806 -5.2691 -5.2388 -3.4186 -3.4176 -3.4173 -3.4162 -3.3471 -3.3470 -3.3339 -3.3267 -3.3230 -3.3172 -3.3033 -3.3032 -3.2885 -3.2806 -3.2750 -3.2671 -3.2463 -3.2460 1.1599 1.1599 1.3731 1.3810 1.4274 1.4361 3.2195 3.2531 3.3050 3.3287 3.3734 3.3755 3.4979 3.5071 3.7603 3.7701 3.8257 3.8418 3.8913 3.9046 4.0572 4.0591 4.2073 4.2449 4.2513 4.2672 5.1129 5.1386 5.1592 5.1880 8.3167 8.3242 8.3937 8.4278 8.4851 8.5022 8.7157 8.7878 8.8014 8.8315 9.5436 9.6121 9.6796 9.7933 10.1988 10.2395 k = 0.0000 0.0000 0.0845 ( 8443 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3367 -6.3366 -5.8641 -5.8641 -5.8098 -5.7937 -5.7807 -5.7599 -5.5615 -5.5613 -5.5612 -5.5611 -5.4953 -5.4952 -5.3214 -5.2981 -5.2885 -5.2800 -5.2705 -5.2461 -3.4186 -3.4179 -3.4178 -3.4169 -3.3470 -3.3470 -3.3309 -3.3255 -3.3224 -3.3178 -3.3027 -3.3027 -3.2867 -3.2803 -3.2756 -3.2691 -3.2459 -3.2458 1.1770 1.1770 1.3958 1.4025 1.4317 1.4389 3.2467 3.2718 3.3233 3.3436 3.3874 3.3895 3.4770 3.4825 3.7404 3.7473 3.7890 3.8056 3.8471 3.8562 4.0522 4.0532 4.2094 4.2394 4.2407 4.2520 5.1149 5.1361 5.1526 5.1757 8.3305 8.3313 8.3920 8.4286 8.4749 8.4851 8.7351 8.7967 8.7995 8.8194 9.5796 9.6381 9.6941 9.7840 10.2325 10.2556 k = 0.0000 0.0000 0.0633 ( 8431 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3404 -6.3404 -5.8647 -5.8647 -5.8045 -5.7919 -5.7820 -5.7668 -5.5616 -5.5615 -5.5614 -5.5614 -5.4951 -5.4950 -5.3108 -5.2932 -5.2859 -5.2797 -5.2723 -5.2540 -3.4187 -3.4181 -3.4181 -3.4175 -3.3470 -3.3470 -3.3283 -3.3244 -3.3220 -3.3185 -3.3022 -3.3022 -3.2848 -3.2799 -3.2763 -3.2712 -3.2456 -3.2456 1.1907 1.1907 1.4146 1.4198 1.4353 1.4408 3.2707 3.2852 3.3408 3.3536 3.4031 3.4071 3.4598 3.4619 3.7235 3.7284 3.7541 3.7685 3.8147 3.8193 4.0471 4.0476 4.2126 4.2328 4.2352 4.2403 5.1185 5.1347 5.1471 5.1644 8.3354 8.3369 8.3969 8.4302 8.4608 8.4739 8.7533 8.7939 8.8053 8.8101 9.6143 9.6617 9.7044 9.7704 10.2607 10.2713 k = 0.0000 0.0000 0.0422 ( 8411 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3431 -6.3431 -5.8652 -5.8652 -5.7988 -5.7901 -5.7834 -5.7736 -5.5617 -5.5616 -5.5616 -5.5615 -5.4949 -5.4949 -5.3005 -5.2886 -5.2838 -5.2797 -5.2746 -5.2624 -3.4187 -3.4184 -3.4183 -3.4179 -3.3470 -3.3469 -3.3259 -3.3234 -3.3217 -3.3194 -3.3019 -3.3019 -3.2828 -3.2794 -3.2770 -3.2736 -3.2454 -3.2454 1.2007 1.2007 1.4287 1.4323 1.4383 1.4420 3.2904 3.2962 3.3530 3.3583 3.4194 3.4234 3.4473 3.4474 3.7103 3.7135 3.7242 3.7349 3.7929 3.7943 4.0427 4.0428 4.2163 4.2274 4.2315 4.2320 5.1234 5.1344 5.1427 5.1542 8.3369 8.3378 8.4082 8.4318 8.4493 8.4626 8.7696 8.7926 8.8030 8.8062 9.6473 9.6815 9.7101 9.7528 10.2816 10.2850 k = 0.0000 0.0000 0.0211 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3447 -6.3447 -5.8654 -5.8654 -5.7928 -5.7884 -5.7850 -5.7802 -5.5617 -5.5616 -5.5616 -5.5616 -5.4949 -5.4948 -5.2904 -5.2845 -5.2821 -5.2801 -5.2774 -5.2713 -3.4186 -3.4185 -3.4184 -3.4182 -3.3469 -3.3469 -3.3238 -3.3226 -3.3218 -3.3206 -3.3017 -3.3017 -3.2806 -3.2789 -3.2776 -3.2759 -3.2453 -3.2453 1.2068 1.2068 1.4378 1.4397 1.4404 1.4423 3.3041 3.3051 3.3578 3.3587 3.4324 3.4349 3.4399 3.4406 3.7019 3.7035 3.7045 3.7104 3.7801 3.7803 4.0397 4.0397 4.2203 4.2245 4.2266 4.2279 5.1295 5.1351 5.1392 5.1449 8.3370 8.3371 8.4223 8.4337 8.4415 8.4502 8.7836 8.7929 8.7980 8.8024 9.6781 9.6965 9.7108 9.7313 10.2942 10.2947 k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3452 -6.3452 -5.8655 -5.8655 -5.7866 -5.7866 -5.7866 -5.7866 -5.5617 -5.5617 -5.5617 -5.5617 -5.4948 -5.4948 -5.2810 -5.2810 -5.2807 -5.2807 -5.2807 -5.2807 -3.4185 -3.4185 -3.4185 -3.4185 -3.3469 -3.3469 -3.3221 -3.3221 -3.3221 -3.3221 -3.3016 -3.3016 -3.2783 -3.2783 -3.2783 -3.2783 -3.2452 -3.2452 1.2089 1.2089 1.4416 1.4416 1.4416 1.4416 3.3090 3.3090 3.3582 3.3582 3.4383 3.4383 3.4383 3.4383 3.6994 3.6994 3.6994 3.6994 3.7758 3.7758 4.0386 4.0386 4.2242 4.2242 4.2242 4.2242 5.1367 5.1367 5.1367 5.1367 8.3368 8.3368 8.4366 8.4366 8.4366 8.4366 8.7947 8.7947 8.7947 8.7947 9.7063 9.7063 9.7063 9.7063 10.2983 10.2983 k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3452 -6.3452 -5.8655 -5.8655 -5.7866 -5.7866 -5.7866 -5.7866 -5.5617 -5.5617 -5.5617 -5.5617 -5.4948 -5.4948 -5.2810 -5.2810 -5.2807 -5.2807 -5.2807 -5.2807 -3.4185 -3.4185 -3.4185 -3.4185 -3.3469 -3.3469 -3.3221 -3.3221 -3.3221 -3.3221 -3.3016 -3.3016 -3.2783 -3.2783 -3.2783 -3.2783 -3.2452 -3.2452 1.2089 1.2089 1.4416 1.4416 1.4416 1.4416 3.3090 3.3090 3.3582 3.3582 3.4383 3.4383 3.4383 3.4383 3.6994 3.6994 3.6994 3.6994 3.7758 3.7758 4.0386 4.0386 4.2242 4.2242 4.2242 4.2242 5.1367 5.1367 5.1367 5.1367 8.3368 8.3368 8.4366 8.4366 8.4366 8.4366 8.7947 8.7947 8.7947 8.7947 9.7063 9.7063 9.7063 9.7063 10.2983 10.2983 k = 0.0071 0.0101 0.0175 ( 8391 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0494 -26.0494 -26.0494 -26.0494 -6.3447 -6.3447 -5.8654 -5.8654 -5.7931 -5.7867 -5.7867 -5.7799 -5.5617 -5.5616 -5.5616 -5.5616 -5.4949 -5.4949 -5.2908 -5.2830 -5.2830 -5.2791 -5.2791 -5.2708 -3.4186 -3.4184 -3.4184 -3.4182 -3.3469 -3.3469 -3.3239 -3.3222 -3.3222 -3.3205 -3.3017 -3.3017 -3.2807 -3.2783 -3.2783 -3.2758 -3.2453 -3.2453 1.2068 1.2068 1.4385 1.4400 1.4400 1.4415 3.3045 3.3045 3.3582 3.3582 3.4319 3.4347 3.4405 3.4405 3.7023 3.7023 3.7049 3.7111 3.7803 3.7803 4.0397 4.0397 4.2200 4.2257 4.2257 4.2280 5.1291 5.1372 5.1372 5.1453 8.3370 8.3370 8.4213 8.4378 8.4378 8.4508 8.7829 8.7957 8.7957 8.8026 9.6769 9.7035 9.7035 9.7326 10.2943 10.2943 k = 0.0143 0.0202 0.0350 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3430 -6.3430 -5.8652 -5.8652 -5.7993 -5.7868 -5.7868 -5.7729 -5.5617 -5.5615 -5.5615 -5.5615 -5.4949 -5.4949 -5.3014 -5.2856 -5.2856 -5.2778 -5.2778 -5.2615 -3.4186 -3.4183 -3.4183 -3.4179 -3.3470 -3.3470 -3.3261 -3.3226 -3.3226 -3.3193 -3.3019 -3.3019 -3.2830 -3.2782 -3.2782 -3.2733 -3.2454 -3.2454 1.2005 1.2005 1.4321 1.4350 1.4350 1.4382 3.2928 3.2928 3.3555 3.3555 3.4181 3.4225 3.4487 3.4487 3.7102 3.7102 3.7266 3.7377 3.7943 3.7943 4.0428 4.0428 4.2154 4.2304 4.2304 4.2314 5.1227 5.1386 5.1386 5.1550 8.3373 8.3373 8.4051 8.4416 8.4416 8.4639 8.7678 8.7987 8.7987 8.8059 9.6459 9.6950 9.6950 9.7548 10.2829 10.2829 k = 0.0214 0.0303 0.0525 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3402 -6.3402 -5.8647 -5.8647 -5.8052 -5.7871 -5.7871 -5.7658 -5.5616 -5.5614 -5.5614 -5.5614 -5.4951 -5.4951 -5.3122 -5.2887 -5.2887 -5.2771 -5.2771 -5.2527 -3.4186 -3.4181 -3.4181 -3.4175 -3.3470 -3.3470 -3.3285 -3.3232 -3.3232 -3.3183 -3.3022 -3.3022 -3.2851 -3.2781 -3.2781 -3.2709 -3.2456 -3.2456 1.1904 1.1904 1.4228 1.4269 1.4269 1.4318 3.2769 3.2769 3.3470 3.3470 3.4003 3.4050 3.4644 3.4644 3.7210 3.7210 3.7606 3.7750 3.8181 3.8181 4.0472 4.0472 4.2105 4.2344 4.2385 4.2385 5.1175 5.1410 5.1410 5.1658 8.3363 8.3363 8.3881 8.4491 8.4491 8.4754 8.7500 8.8038 8.8038 8.8039 9.6149 9.6812 9.6812 9.7723 10.2652 10.2652 k = 0.0286 0.0404 0.0700 ( 8445 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3364 -6.3364 -5.8641 -5.8641 -5.8108 -5.7874 -5.7874 -5.7585 -5.5615 -5.5613 -5.5612 -5.5612 -5.4952 -5.4952 -5.3231 -5.2921 -5.2921 -5.2767 -5.2767 -5.2444 -3.4184 -3.4178 -3.4178 -3.4170 -3.3470 -3.3470 -3.3313 -3.3240 -3.3240 -3.3175 -3.3027 -3.3027 -3.2870 -3.2781 -3.2781 -3.2685 -3.2459 -3.2459 1.1766 1.1766 1.4107 1.4159 1.4159 1.4223 3.2580 3.2580 3.3334 3.3334 3.3813 3.3855 3.4872 3.4872 3.7335 3.7335 3.8036 3.8199 3.8514 3.8514 4.0521 4.0521 4.2053 4.2370 4.2505 4.2505 5.1138 5.1446 5.1446 5.1776 8.3325 8.3325 8.3701 8.4612 8.4612 8.4850 8.7299 8.7958 8.8112 8.8112 9.5855 9.6624 9.6624 9.7847 10.2427 10.2427 k = 0.0357 0.0505 0.0875 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3315 -6.3315 -5.8633 -5.8633 -5.8160 -5.7878 -5.7878 -5.7511 -5.5614 -5.5610 -5.5609 -5.5609 -5.4954 -5.4954 -5.3341 -5.2960 -5.2960 -5.2768 -5.2768 -5.2367 -3.4181 -3.4175 -3.4175 -3.4164 -3.3470 -3.3470 -3.3343 -3.3250 -3.3250 -3.3169 -3.3033 -3.3033 -3.2887 -3.2780 -3.2780 -3.2663 -3.2462 -3.2462 1.1596 1.1596 1.3960 1.4022 1.4022 1.4102 3.2364 3.2364 3.3172 3.3172 3.3628 3.3660 3.5155 3.5155 3.7475 3.7475 3.8529 3.8699 3.8926 3.8926 4.0566 4.0566 4.1999 4.2395 4.2667 4.2667 5.1117 5.1493 5.1493 5.1905 8.3250 8.3250 8.3511 8.4780 8.4780 8.4923 8.7081 8.7810 8.8212 8.8212 9.5595 9.6392 9.6392 9.7922 10.2172 10.2172 k = 0.0429 0.0606 0.1050 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3255 -6.3255 -5.8623 -5.8623 -5.8209 -5.7883 -5.7883 -5.7438 -5.5612 -5.5608 -5.5606 -5.5606 -5.4957 -5.4957 -5.3452 -5.3002 -5.3002 -5.2774 -5.2774 -5.2296 -3.4178 -3.4170 -3.4170 -3.4157 -3.3471 -3.3471 -3.3375 -3.3261 -3.3261 -3.3164 -3.3041 -3.3041 -3.2902 -3.2780 -3.2780 -3.2644 -3.2466 -3.2466 1.1398 1.1398 1.3792 1.3861 1.3861 1.3956 3.2119 3.2119 3.3009 3.3009 3.3457 3.3476 3.5479 3.5479 3.7633 3.7633 3.9068 3.9232 3.9399 3.9399 4.0603 4.0603 4.1945 4.2422 4.2874 4.2874 5.1114 5.1553 5.1553 5.2045 8.3134 8.3134 8.3309 8.4964 8.4986 8.4986 8.6853 8.7594 8.8344 8.8344 9.5381 9.6123 9.6123 9.7951 10.1900 10.1900 k = 0.0500 0.0707 0.1225 ( 8409 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3186 -6.3186 -5.8612 -5.8612 -5.8254 -5.7889 -5.7889 -5.7365 -5.5610 -5.5604 -5.5601 -5.5601 -5.4961 -5.4961 -5.3562 -5.3047 -5.3047 -5.2784 -5.2784 -5.2233 -3.4173 -3.4165 -3.4165 -3.4149 -3.3472 -3.3472 -3.3408 -3.3273 -3.3273 -3.3161 -3.3049 -3.3049 -3.2915 -3.2780 -3.2780 -3.2627 -3.2470 -3.2470 1.1179 1.1179 1.3605 1.3680 1.3680 1.3789 3.1846 3.1846 3.2858 3.2858 3.3304 3.3308 3.5830 3.5830 3.7810 3.7810 3.9635 3.9777 3.9916 3.9916 4.0631 4.0631 4.1896 4.2458 4.3127 4.3127 5.1131 5.1628 5.1628 5.2199 8.2978 8.2978 8.3092 8.4962 8.5213 8.5213 8.6626 8.7312 8.8513 8.8513 9.5223 9.5827 9.5827 9.7943 10.1624 10.1624 k = 0.0571 0.0808 0.1400 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0495 -26.0495 -26.0495 -26.0495 -6.3107 -6.3107 -5.8600 -5.8600 -5.8296 -5.7896 -5.7896 -5.7295 -5.5608 -5.5601 -5.5596 -5.5596 -5.4965 -5.4965 -5.3669 -5.3096 -5.3096 -5.2798 -5.2798 -5.2176 -3.4168 -3.4159 -3.4159 -3.4140 -3.3473 -3.3473 -3.3442 -3.3285 -3.3285 -3.3159 -3.3059 -3.3059 -3.2927 -3.2782 -3.2782 -3.2612 -3.2475 -3.2475 1.0942 1.0942 1.3404 1.3483 1.3483 1.3604 3.1549 3.1549 3.2729 3.2729 3.3160 3.3170 3.6196 3.6196 3.8009 3.8009 4.0209 4.0309 4.0414 4.0414 4.0698 4.0698 4.1862 4.2519 4.3428 4.3428 5.1171 5.1718 5.1718 5.2366 8.2784 8.2784 8.2855 8.4900 8.5443 8.5443 8.6416 8.6975 8.8728 8.8728 9.5123 9.5516 9.5516 9.7906 10.1349 10.1349 k = 0.0643 0.0909 0.1575 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.3018 -6.3018 -5.8587 -5.8587 -5.8334 -5.7905 -5.7905 -5.7227 -5.5606 -5.5596 -5.5591 -5.5591 -5.4969 -5.4969 -5.3774 -5.3148 -5.3148 -5.2816 -5.2816 -5.2127 -3.4161 -3.4152 -3.4152 -3.4131 -3.3476 -3.3476 -3.3475 -3.3298 -3.3298 -3.3158 -3.3070 -3.3070 -3.2937 -3.2785 -3.2785 -3.2601 -3.2479 -3.2479 1.0692 1.0693 1.3192 1.3273 1.3273 1.3406 3.1233 3.1233 3.2623 3.2623 3.3032 3.3056 3.6564 3.6564 3.8228 3.8228 4.0562 4.0562 4.0746 4.0787 4.1127 4.1127 4.1883 4.2638 4.3777 4.3777 5.1234 5.1826 5.1826 5.2549 8.2555 8.2555 8.2594 8.4762 8.5656 8.5656 8.6241 8.6599 8.8998 8.8998 9.5078 9.5201 9.5201 9.7848 10.1082 10.1082 k = 0.0714 0.1010 0.1750 ( 8409 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2922 -6.2922 -5.8573 -5.8573 -5.8368 -5.7914 -5.7914 -5.7164 -5.5603 -5.5590 -5.5585 -5.5585 -5.4975 -5.4975 -5.3873 -5.3202 -5.3202 -5.2838 -5.2838 -5.2086 -3.4154 -3.4144 -3.4144 -3.4121 -3.3508 -3.3479 -3.3479 -3.3309 -3.3309 -3.3158 -3.3083 -3.3083 -3.2946 -3.2789 -3.2789 -3.2593 -3.2483 -3.2483 1.0436 1.0436 1.2972 1.3053 1.3053 1.3197 3.0907 3.0907 3.2539 3.2539 3.2922 3.2960 3.6924 3.6924 3.8466 3.8466 4.0554 4.0554 4.1121 4.1152 4.1716 4.1716 4.2071 4.2866 4.4174 4.4174 5.1323 5.1951 5.1951 5.2746 8.2292 8.2292 8.2303 8.4541 8.5836 8.5836 8.6110 8.6205 8.9326 8.9326 9.4892 9.4892 9.5084 9.7778 10.0825 10.0825 k = 0.0786 0.1111 0.1925 ( 8403 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2817 -6.2817 -5.8559 -5.8559 -5.8399 -5.7924 -5.7924 -5.7107 -5.5600 -5.5583 -5.5578 -5.5578 -5.4981 -5.4981 -5.3967 -5.3258 -5.3258 -5.2862 -5.2862 -5.2053 -3.4146 -3.4135 -3.4135 -3.4110 -3.3539 -3.3483 -3.3483 -3.3320 -3.3320 -3.3159 -3.3096 -3.3096 -3.2955 -3.2796 -3.2796 -3.2588 -3.2488 -3.2488 1.0176 1.0176 1.2747 1.2828 1.2828 1.2981 3.0576 3.0576 3.2475 3.2475 3.2831 3.2882 3.7267 3.7267 3.8717 3.8717 4.0526 4.0526 4.1239 4.1363 4.2324 4.2324 4.2515 4.3234 4.4620 4.4620 5.1438 5.2094 5.2094 5.2960 8.1977 8.2001 8.2001 8.4245 8.5813 8.5973 8.5973 8.6019 8.9710 8.9710 9.4600 9.4600 9.5133 9.7703 10.0578 10.0578 k = 0.0857 0.1212 0.2100 ( 8403 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2705 -6.2705 -5.8545 -5.8545 -5.8427 -5.7934 -5.7934 -5.7058 -5.5596 -5.5575 -5.5570 -5.5570 -5.4988 -5.4988 -5.4053 -5.3317 -5.3317 -5.2890 -5.2890 -5.2028 -3.4137 -3.4126 -3.4126 -3.4099 -3.3568 -3.3489 -3.3489 -3.3330 -3.3330 -3.3160 -3.3110 -3.3110 -3.2962 -3.2803 -3.2803 -3.2587 -3.2492 -3.2492 0.9917 0.9918 1.2522 1.2600 1.2600 1.2761 3.0249 3.0249 3.2429 3.2429 3.2756 3.2821 3.7586 3.7586 3.8975 3.8975 4.0492 4.0492 4.1221 4.1442 4.2933 4.2934 4.3090 4.3715 4.5115 4.5115 5.1579 5.2256 5.2256 5.3188 8.1616 8.1685 8.1685 8.3895 8.5442 8.5956 8.6065 8.6065 9.0136 9.0136 9.4332 9.4332 9.5216 9.7627 10.0343 10.0343 k = 0.0929 0.1313 0.2275 ( 8403 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2587 -6.2587 -5.8531 -5.8531 -5.8451 -5.7946 -5.7946 -5.7018 -5.5593 -5.5566 -5.5561 -5.5561 -5.4996 -5.4996 -5.4129 -5.3377 -5.3377 -5.2919 -5.2919 -5.2011 -3.4127 -3.4115 -3.4115 -3.4088 -3.3593 -3.3495 -3.3495 -3.3339 -3.3339 -3.3163 -3.3125 -3.3125 -3.2969 -3.2812 -3.2812 -3.2588 -3.2495 -3.2495 0.9663 0.9664 1.2297 1.2372 1.2372 1.2540 2.9928 2.9928 3.2398 3.2398 3.2696 3.2774 3.7877 3.7877 3.9229 3.9229 4.0463 4.0463 4.1153 4.1438 4.3536 4.3536 4.3699 4.4254 4.5657 4.5657 5.1746 5.2434 5.2434 5.3429 8.1223 8.1351 8.1351 8.3509 8.5104 8.5908 8.6117 8.6117 9.0586 9.0586 9.4093 9.4093 9.5326 9.7554 10.0118 10.0118 k = 0.1000 0.1414 0.2449 ( 8394 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0494 -26.0494 -6.2463 -6.2463 -5.8517 -5.8517 -5.8471 -5.7958 -5.7958 -5.6989 -5.5588 -5.5556 -5.5552 -5.5552 -5.5005 -5.5005 -5.4194 -5.3438 -5.3438 -5.2950 -5.2950 -5.2003 -3.4116 -3.4104 -3.4104 -3.4075 -3.3616 -3.3503 -3.3503 -3.3346 -3.3346 -3.3166 -3.3141 -3.3141 -3.2976 -3.2822 -3.2822 -3.2593 -3.2499 -3.2499 0.9417 0.9418 1.2077 1.2147 1.2147 1.2321 2.9618 2.9619 3.2381 3.2381 3.2650 3.2739 3.8136 3.8136 3.9459 3.9459 4.0458 4.0458 4.1063 4.1383 4.4124 4.4124 4.4310 4.4812 4.6243 4.6243 5.1935 5.2625 5.2625 5.3679 8.0809 8.1009 8.1009 8.3106 8.4807 8.5869 8.6135 8.6135 9.1032 9.1032 9.3889 9.3889 9.5455 9.7484 9.9903 9.9903 k = 0.1071 0.1515 0.2624 ( 8406 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2334 -6.2334 -5.8505 -5.8505 -5.8489 -5.7970 -5.7970 -5.6973 -5.5584 -5.5544 -5.5541 -5.5541 -5.5015 -5.5015 -5.4247 -5.3500 -5.3500 -5.2983 -5.2983 -5.2003 -3.4105 -3.4092 -3.4092 -3.4064 -3.3634 -3.3513 -3.3513 -3.3352 -3.3352 -3.3170 -3.3157 -3.3157 -3.2983 -3.2834 -3.2834 -3.2601 -3.2503 -3.2503 0.9182 0.9182 1.1862 1.1926 1.1926 1.2106 2.9324 2.9324 3.2375 3.2375 3.2616 3.2717 3.8359 3.8359 3.9634 3.9634 4.0511 4.0511 4.0961 4.1295 4.4690 4.4690 4.4908 4.5368 4.6866 4.6866 5.2142 5.2826 5.2826 5.3933 8.0390 8.0669 8.0669 8.2701 8.4552 8.5835 8.6127 8.6127 9.1440 9.1440 9.3727 9.3727 9.5598 9.7416 9.9699 9.9699 k = 0.1143 0.1616 0.2799 ( 8400 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0494 -26.0494 -6.2202 -6.2202 -5.8503 -5.8494 -5.8494 -5.7982 -5.7982 -5.6969 -5.5579 -5.5532 -5.5530 -5.5530 -5.5026 -5.5026 -5.4285 -5.3563 -5.3563 -5.3016 -5.3016 -5.2011 -3.4093 -3.4079 -3.4079 -3.4052 -3.3648 -3.3522 -3.3522 -3.3357 -3.3357 -3.3174 -3.3174 -3.3174 -3.2989 -3.2846 -3.2846 -3.2611 -3.2507 -3.2507 0.8960 0.8960 1.1654 1.1712 1.1712 1.1896 2.9047 2.9047 3.2379 3.2379 3.2593 3.2704 3.8545 3.8545 3.9720 3.9720 4.0660 4.0660 4.0851 4.1185 4.5232 4.5232 4.5486 4.5909 4.7519 4.7519 5.2360 5.3029 5.3029 5.4185 7.9987 8.0343 8.0343 8.2308 8.4335 8.5804 8.6099 8.6099 9.1766 9.1766 9.3620 9.3620 9.5748 9.7346 9.9507 9.9507 k = 0.1214 0.1717 0.2974 ( 8409 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.2067 -6.2067 -5.8515 -5.8485 -5.8485 -5.7994 -5.7994 -5.6980 -5.5574 -5.5521 -5.5518 -5.5518 -5.5037 -5.5037 -5.4308 -5.3627 -5.3627 -5.3050 -5.3050 -5.2027 -3.4081 -3.4065 -3.4065 -3.4040 -3.3658 -3.3533 -3.3533 -3.3361 -3.3361 -3.3191 -3.3191 -3.3179 -3.2996 -3.2859 -3.2859 -3.2625 -3.2511 -3.2511 0.8754 0.8754 1.1456 1.1507 1.1507 1.1694 2.8790 2.8790 3.2392 3.2392 3.2579 3.2701 3.8690 3.8690 3.9726 3.9726 4.0734 4.0901 4.0901 4.1058 4.5744 4.5745 4.6039 4.6429 4.8192 4.8192 5.2581 5.3229 5.3229 5.4424 7.9619 8.0046 8.0046 8.1942 8.4151 8.5778 8.6059 8.6059 9.1966 9.1966 9.3581 9.3581 9.5902 9.7271 9.9329 9.9329 k = 0.1286 0.1818 0.3149 ( 8409 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1931 -6.1931 -5.8523 -5.8477 -5.8477 -5.8006 -5.8006 -5.7005 -5.5569 -5.5509 -5.5506 -5.5506 -5.5050 -5.5050 -5.4315 -5.3690 -5.3690 -5.3083 -5.3083 -5.2051 -3.4068 -3.4050 -3.4050 -3.4028 -3.3662 -3.3544 -3.3544 -3.3366 -3.3366 -3.3208 -3.3208 -3.3185 -3.3002 -3.2872 -3.2872 -3.2640 -3.2515 -3.2515 0.8565 0.8565 1.1267 1.1310 1.1311 1.1499 2.8555 2.8555 3.2411 3.2411 3.2572 3.2704 3.8795 3.8795 3.9686 3.9686 4.0613 4.0919 4.1203 4.1203 4.6227 4.6227 4.6563 4.6924 4.8875 4.8875 5.2795 5.3415 5.3416 5.4639 7.9309 7.9791 7.9791 8.1615 8.3997 8.5758 8.6011 8.6011 9.2017 9.2017 9.3602 9.3602 9.6055 9.7188 9.9169 9.9169 k = 0.1357 0.1919 0.3324 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1794 -6.1794 -5.8529 -5.8472 -5.8472 -5.8016 -5.8016 -5.7043 -5.5564 -5.5499 -5.5492 -5.5492 -5.5062 -5.5062 -5.4307 -5.3753 -5.3753 -5.3116 -5.3116 -5.2083 -3.4054 -3.4035 -3.4035 -3.4016 -3.3662 -3.3555 -3.3555 -3.3370 -3.3370 -3.3225 -3.3225 -3.3191 -3.3009 -3.2885 -3.2885 -3.2658 -3.2520 -3.2520 0.8395 0.8395 1.1089 1.1124 1.1124 1.1315 2.8343 2.8343 3.2436 3.2436 3.2572 3.2713 3.8861 3.8861 3.9626 3.9626 4.0489 4.0771 4.1544 4.1544 4.6679 4.6679 4.7059 4.7392 4.9554 4.9554 5.2991 5.3581 5.3581 5.4819 7.9075 7.9590 7.9590 8.1337 8.3867 8.5745 8.5960 8.5960 9.1938 9.1938 9.3643 9.3643 9.6204 9.7093 9.9030 9.9030 k = 0.1429 0.2020 0.3499 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1659 -6.1659 -5.8532 -5.8469 -5.8469 -5.8025 -5.8025 -5.7093 -5.5558 -5.5490 -5.5478 -5.5478 -5.5075 -5.5075 -5.4285 -5.3815 -5.3815 -5.3147 -5.3147 -5.2122 -3.4040 -3.4019 -3.4019 -3.4005 -3.3658 -3.3566 -3.3566 -3.3375 -3.3375 -3.3241 -3.3241 -3.3199 -3.3015 -3.2898 -3.2898 -3.2677 -3.2524 -3.2524 0.8246 0.8246 1.0922 1.0948 1.0948 1.1139 2.8154 2.8155 3.2465 3.2465 3.2578 3.2726 3.8889 3.8889 3.9558 3.9558 4.0362 4.0617 4.1913 4.1913 4.7101 4.7101 4.7525 4.7835 5.0216 5.0216 5.3158 5.3718 5.3718 5.4953 7.8932 7.9455 7.9455 8.1119 8.3758 8.5742 8.5911 8.5911 9.1768 9.1768 9.3657 9.3657 9.6344 9.6985 9.8907 9.8907 k = 0.1500 0.2121 0.3674 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1526 -6.1526 -5.8532 -5.8468 -5.8468 -5.8034 -5.8034 -5.7153 -5.5552 -5.5482 -5.5464 -5.5464 -5.5088 -5.5088 -5.4249 -5.3876 -5.3876 -5.3176 -5.3176 -5.2168 -3.4026 -3.4002 -3.4002 -3.3993 -3.3648 -3.3577 -3.3577 -3.3381 -3.3381 -3.3256 -3.3256 -3.3207 -3.3021 -3.2910 -3.2910 -3.2697 -3.2530 -3.2530 0.8119 0.8119 1.0766 1.0783 1.0783 1.0974 2.7991 2.7991 3.2497 3.2497 3.2587 3.2743 3.8883 3.8883 3.9490 3.9490 4.0235 4.0460 4.2304 4.2304 4.7493 4.7493 4.7961 4.8252 5.0847 5.0847 5.3288 5.3823 5.3823 5.5031 7.8893 7.9393 7.9393 8.0966 8.3668 8.5751 8.5868 8.5868 9.1535 9.1535 9.3620 9.3620 9.6474 9.6863 9.8792 9.8792 k = 0.1571 0.2222 0.3849 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1397 -6.1397 -5.8530 -5.8469 -5.8469 -5.8041 -5.8041 -5.7223 -5.5545 -5.5476 -5.5449 -5.5449 -5.5100 -5.5100 -5.4202 -5.3935 -5.3935 -5.3203 -5.3203 -5.2221 -3.4011 -3.3985 -3.3985 -3.3982 -3.3635 -3.3587 -3.3587 -3.3388 -3.3388 -3.3271 -3.3271 -3.3215 -3.3028 -3.2921 -3.2921 -3.2719 -3.2535 -3.2535 0.8015 0.8015 1.0621 1.0629 1.0629 1.0819 2.7852 2.7852 3.2530 3.2530 3.2600 3.2761 3.8848 3.8848 3.9424 3.9424 4.0108 4.0302 4.2712 4.2712 4.7856 4.7856 4.8369 4.8644 5.1428 5.1428 5.3373 5.3898 5.3898 5.5047 7.8964 7.9410 7.9410 8.0881 8.3597 8.5776 8.5833 8.5833 9.1261 9.1261 9.3532 9.3533 9.6592 9.6728 9.8669 9.8670 k = 0.1643 0.2323 0.4024 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1273 -6.1273 -5.8525 -5.8471 -5.8471 -5.8047 -5.8047 -5.7299 -5.5539 -5.5470 -5.5435 -5.5435 -5.5110 -5.5110 -5.4145 -5.3992 -5.3992 -5.3228 -5.3228 -5.2280 -3.3996 -3.3970 -3.3967 -3.3967 -3.3618 -3.3598 -3.3598 -3.3396 -3.3396 -3.3284 -3.3284 -3.3225 -3.3034 -3.2931 -3.2931 -3.2741 -3.2541 -3.2541 0.7936 0.7936 1.0484 1.0484 1.0487 1.0673 2.7737 2.7737 3.2564 3.2564 3.2616 3.2780 3.8792 3.8792 3.9359 3.9360 3.9982 4.0145 4.3133 4.3133 4.8191 4.8191 4.8749 4.9011 5.1933 5.1933 5.3411 5.3956 5.3956 5.4997 7.9144 7.9505 7.9505 8.0864 8.3545 8.5811 8.5811 8.5820 9.0959 9.0959 9.3401 9.3401 9.6583 9.6697 9.8527 9.8527 k = 0.1714 0.2424 0.4199 ( 8436 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0495 -26.0495 -6.1157 -6.1157 -5.8519 -5.8472 -5.8472 -5.8052 -5.8052 -5.7382 -5.5532 -5.5466 -5.5423 -5.5423 -5.5118 -5.5118 -5.4081 -5.4047 -5.4047 -5.3251 -5.3251 -5.2345 -3.3980 -3.3958 -3.3949 -3.3949 -3.3608 -3.3608 -3.3597 -3.3405 -3.3405 -3.3297 -3.3297 -3.3235 -3.3040 -3.2940 -3.2940 -3.2764 -3.2547 -3.2547 0.7881 0.7881 1.0349 1.0349 1.0362 1.0535 2.7645 2.7645 3.2598 3.2598 3.2633 3.2799 3.8722 3.8722 3.9297 3.9297 3.9859 3.9991 4.3566 4.3566 4.8494 4.8494 4.9101 4.9351 5.2330 5.2330 5.3402 5.4023 5.4023 5.4887 7.9428 7.9673 7.9673 8.0908 8.3514 8.5805 8.5805 8.5885 9.0647 9.0647 9.3234 9.3234 9.6436 9.6786 9.8357 9.8357 k = 0.1786 0.2525 0.4374 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.1049 -6.1049 -5.8510 -5.8473 -5.8473 -5.8058 -5.8058 -5.7468 -5.5524 -5.5462 -5.5412 -5.5412 -5.5123 -5.5123 -5.4098 -5.4098 -5.4011 -5.3270 -5.3270 -5.2414 -3.3964 -3.3946 -3.3931 -3.3931 -3.3619 -3.3619 -3.3574 -3.3414 -3.3414 -3.3308 -3.3308 -3.3245 -3.3045 -3.2948 -3.2948 -3.2787 -3.2553 -3.2553 0.7853 0.7853 1.0223 1.0223 1.0245 1.0406 2.7576 2.7576 3.2631 3.2631 3.2650 3.2816 3.8642 3.8642 3.9235 3.9235 3.9739 3.9843 4.4007 4.4007 4.8765 4.8765 4.9421 4.9662 5.2584 5.2584 5.3352 5.4133 5.4133 5.4722 7.9801 7.9905 7.9905 8.1004 8.3510 8.5821 8.5821 8.5974 9.0337 9.0337 9.3033 9.3033 9.6292 9.6861 9.8159 9.8159 k = 0.1857 0.2626 0.4549 ( 8445 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0495 -26.0495 -6.0950 -6.0950 -5.8499 -5.8472 -5.8472 -5.8063 -5.8063 -5.7557 -5.5517 -5.5459 -5.5405 -5.5405 -5.5123 -5.5123 -5.4147 -5.4147 -5.3938 -5.3287 -5.3287 -5.2489 -3.3949 -3.3934 -3.3912 -3.3912 -3.3630 -3.3630 -3.3548 -3.3423 -3.3423 -3.3318 -3.3318 -3.3257 -3.3050 -3.2955 -3.2955 -3.2810 -3.2560 -3.2560 0.7851 0.7851 1.0104 1.0104 1.0137 1.0283 2.7528 2.7528 3.2662 3.2662 3.2669 3.2832 3.8559 3.8559 3.9174 3.9174 3.9624 3.9701 4.4454 4.4454 4.8998 4.8998 4.9708 4.9937 5.2688 5.2688 5.3274 5.4295 5.4295 5.4517 8.0187 8.0187 8.0239 8.1140 8.3545 8.5863 8.5863 8.6090 9.0043 9.0043 9.2795 9.2795 9.6162 9.6921 9.7940 9.7940 k = 0.1929 0.2727 0.4724 ( 8439 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0862 -6.0862 -5.8486 -5.8468 -5.8468 -5.8069 -5.8069 -5.7648 -5.5509 -5.5456 -5.5400 -5.5400 -5.5120 -5.5120 -5.4192 -5.4192 -5.3862 -5.3300 -5.3300 -5.2567 -3.3933 -3.3920 -3.3894 -3.3894 -3.3643 -3.3643 -3.3522 -3.3432 -3.3432 -3.3327 -3.3327 -3.3268 -3.3054 -3.2961 -3.2961 -3.2833 -3.2566 -3.2566 0.7877 0.7877 0.9992 0.9992 1.0034 1.0165 2.7498 2.7498 3.2687 3.2691 3.2691 3.2844 3.8474 3.8474 3.9115 3.9115 3.9513 3.9567 4.4903 4.4903 4.9187 4.9187 4.9953 5.0165 5.2686 5.2686 5.3185 5.4290 5.4477 5.4477 8.0501 8.0501 8.0707 8.1299 8.3637 8.5938 8.5938 8.6233 8.9775 8.9775 9.2513 9.2513 9.6057 9.6969 9.7713 9.7714 k = 0.2000 0.2828 0.4899 ( 8439 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0786 -6.0786 -5.8472 -5.8461 -5.8461 -5.8075 -5.8075 -5.7739 -5.5501 -5.5454 -5.5399 -5.5399 -5.5112 -5.5112 -5.4232 -5.4232 -5.3784 -5.3311 -5.3311 -5.2650 -3.3916 -3.3907 -3.3876 -3.3876 -3.3656 -3.3656 -3.3494 -3.3440 -3.3440 -3.3335 -3.3335 -3.3280 -3.3057 -3.2967 -3.2967 -3.2855 -3.2572 -3.2572 0.7931 0.7931 0.9883 0.9883 0.9936 1.0051 2.7484 2.7484 3.2705 3.2718 3.2718 3.2853 3.8392 3.8392 3.9060 3.9060 3.9409 3.9444 4.5351 4.5351 4.9321 4.9321 5.0148 5.0329 5.2635 5.2635 5.3111 5.4063 5.4635 5.4635 8.0828 8.0828 8.1156 8.1468 8.3817 8.6053 8.6053 8.6399 8.9541 8.9541 9.2175 9.2175 9.5987 9.7005 9.7499 9.7499 k = 0.2071 0.2929 0.5074 ( 8439 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0722 -6.0722 -5.8455 -5.8449 -5.8449 -5.8082 -5.8082 -5.7830 -5.5493 -5.5451 -5.5401 -5.5401 -5.5101 -5.5101 -5.4268 -5.4268 -5.3707 -5.3318 -5.3318 -5.2735 -3.3900 -3.3893 -3.3859 -3.3859 -3.3671 -3.3671 -3.3467 -3.3445 -3.3445 -3.3342 -3.3342 -3.3293 -3.3058 -3.2971 -3.2971 -3.2876 -3.2578 -3.2578 0.8013 0.8013 0.9778 0.9778 0.9840 0.9939 2.7484 2.7484 3.2723 3.2741 3.2741 3.2858 3.8314 3.8314 3.9010 3.9010 3.9312 3.9330 4.5792 4.5792 4.9395 4.9395 5.0278 5.0414 5.2585 5.2585 5.3078 5.3863 5.4739 5.4739 8.1146 8.1146 8.1532 8.1632 8.4121 8.6213 8.6213 8.6585 8.9343 8.9343 9.1770 9.1770 9.5964 9.7032 9.7317 9.7317 k = 0.2143 0.3030 0.5249 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0670 -6.0670 -5.8437 -5.8434 -5.8434 -5.8089 -5.8089 -5.7919 -5.5484 -5.5449 -5.5406 -5.5406 -5.5088 -5.5088 -5.4299 -5.4299 -5.3630 -5.3321 -5.3321 -5.2823 -3.3884 -3.3879 -3.3843 -3.3843 -3.3687 -3.3687 -3.3449 -3.3449 -3.3441 -3.3349 -3.3349 -3.3305 -3.3057 -3.2975 -3.2975 -3.2897 -3.2583 -3.2583 0.8125 0.8125 0.9673 0.9673 0.9745 0.9828 2.7493 2.7493 3.2740 3.2762 3.2762 3.2860 3.8243 3.8243 3.8968 3.8968 3.9222 3.9229 4.6221 4.6221 4.9407 4.9407 5.0330 5.0408 5.2565 5.2565 5.3107 5.3715 5.4774 5.4774 8.1436 8.1436 8.1779 8.1801 8.4564 8.6424 8.6424 8.6782 8.9182 8.9182 9.1293 9.1293 9.5998 9.7051 9.7185 9.7185 k = 0.2214 0.3131 0.5424 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0630 -6.0630 -5.8417 -5.8414 -5.8414 -5.8097 -5.8097 -5.8006 -5.5476 -5.5446 -5.5412 -5.5412 -5.5074 -5.5074 -5.4324 -5.4324 -5.3555 -5.3321 -5.3321 -5.2913 -3.3868 -3.3864 -3.3829 -3.3829 -3.3705 -3.3705 -3.3451 -3.3451 -3.3417 -3.3354 -3.3354 -3.3317 -3.3052 -3.2979 -3.2979 -3.2918 -3.2587 -3.2587 0.8266 0.8266 0.9568 0.9568 0.9648 0.9714 2.7509 2.7509 3.2756 3.2780 3.2780 3.2857 3.8181 3.8181 3.8934 3.8934 3.9140 3.9141 4.6625 4.6625 4.9370 4.9370 5.0294 5.0317 5.2588 5.2588 5.3202 5.3639 5.4734 5.4734 8.1683 8.1683 8.1904 8.1967 8.5120 8.6687 8.6687 8.6979 8.9053 8.9053 9.0746 9.0746 9.6095 9.7066 9.7114 9.7114 k = 0.2286 0.3232 0.5599 ( 8409 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0601 -6.0601 -5.8395 -5.8392 -5.8392 -5.8105 -5.8105 -5.8090 -5.5466 -5.5444 -5.5418 -5.5418 -5.5062 -5.5062 -5.4342 -5.4342 -5.3483 -5.3318 -5.3318 -5.3004 -3.3852 -3.3849 -3.3815 -3.3815 -3.3724 -3.3724 -3.3451 -3.3451 -3.3396 -3.3358 -3.3358 -3.3329 -3.3044 -3.2983 -3.2983 -3.2937 -3.2591 -3.2591 0.8436 0.8436 0.9459 0.9459 0.9547 0.9596 2.7528 2.7528 3.2772 3.2794 3.2794 3.2851 3.8129 3.8129 3.8912 3.8912 3.9064 3.9069 4.6986 4.6986 4.9316 4.9316 5.0161 5.0176 5.2652 5.2652 5.3353 5.3641 5.4621 5.4621 8.1877 8.1877 8.2001 8.2059 8.5744 8.6995 8.6995 8.7168 8.8948 8.8949 9.0144 9.0144 9.6256 9.7075 9.7099 9.7099 k = 0.2357 0.3334 0.5774 ( 8403 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0582 -6.0582 -5.8371 -5.8368 -5.8368 -5.8170 -5.8113 -5.8113 -5.5457 -5.5442 -5.5425 -5.5425 -5.5052 -5.5052 -5.4355 -5.4355 -5.3413 -5.3310 -5.3310 -5.3097 -3.3837 -3.3835 -3.3804 -3.3804 -3.3743 -3.3743 -3.3450 -3.3450 -3.3380 -3.3361 -3.3361 -3.3340 -3.3031 -3.2986 -3.2986 -3.2956 -3.2594 -3.2594 0.8635 0.8635 0.9347 0.9347 0.9440 0.9472 2.7546 2.7546 3.2787 3.2805 3.2805 3.2842 3.8089 3.8089 3.8901 3.8901 3.9002 3.9007 4.7274 4.7274 4.9292 4.9292 4.9963 4.9994 5.2743 5.2743 5.3544 5.3712 5.4442 5.4442 8.2013 8.2013 8.2068 8.2104 8.6390 8.7333 8.7333 8.7340 8.8849 8.8849 8.9523 8.9523 9.6478 9.7077 9.7120 9.7120 k = 0.2429 0.3435 0.5949 ( 8403 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0571 -6.0571 -5.8346 -5.8343 -5.8343 -5.8247 -5.8119 -5.8119 -5.5448 -5.5440 -5.5432 -5.5432 -5.5046 -5.5046 -5.4362 -5.4362 -5.3347 -5.3299 -5.3299 -5.3191 -3.3821 -3.3820 -3.3799 -3.3799 -3.3760 -3.3760 -3.3449 -3.3449 -3.3368 -3.3362 -3.3362 -3.3351 -3.3014 -3.2990 -3.2990 -3.2975 -3.2596 -3.2596 0.8858 0.8858 0.9233 0.9233 0.9324 0.9340 2.7559 2.7559 3.2802 3.2812 3.2812 3.2830 3.8064 3.8064 3.8904 3.8904 3.8954 3.8958 4.7453 4.7453 4.9353 4.9353 4.9746 4.9770 5.2836 5.2836 5.3761 5.3834 5.4217 5.4217 8.2093 8.2093 8.2108 8.2121 8.7024 8.7491 8.7639 8.7639 8.8666 8.8666 8.9033 8.9033 9.6748 9.7070 9.7127 9.7127 k = 0.2500 0.3536 0.6124 ( 8472 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -6.0568 -6.0568 -5.8320 -5.8320 -5.8320 -5.8320 -5.8121 -5.8121 -5.5438 -5.5438 -5.5438 -5.5438 -5.5044 -5.5044 -5.4365 -5.4365 -5.3285 -5.3285 -5.3285 -5.3285 -3.3806 -3.3806 -3.3806 -3.3806 -3.3767 -3.3767 -3.3449 -3.3449 -3.3361 -3.3361 -3.3361 -3.3361 -3.2993 -3.2993 -3.2993 -3.2993 -3.2596 -3.2596 0.9024 0.9024 0.9198 0.9198 0.9198 0.9198 2.7565 2.7565 3.2815 3.2815 3.2815 3.2815 3.8056 3.8056 3.8922 3.8922 3.8922 3.8922 4.7507 4.7507 4.9528 4.9528 4.9528 4.9528 5.2884 5.2884 5.3991 5.3991 5.3991 5.3991 8.2120 8.2120 8.2120 8.2120 8.7621 8.7621 8.7621 8.7621 8.8457 8.8457 8.8907 8.8907 9.7049 9.7049 9.7049 9.7049 k = 0.2500 0.3536 0.6124 ( 8472 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -6.0568 -6.0568 -5.8320 -5.8320 -5.8320 -5.8320 -5.8121 -5.8121 -5.5438 -5.5438 -5.5438 -5.5438 -5.5044 -5.5044 -5.4365 -5.4365 -5.3285 -5.3285 -5.3285 -5.3285 -3.3806 -3.3806 -3.3806 -3.3806 -3.3767 -3.3767 -3.3449 -3.3449 -3.3361 -3.3361 -3.3361 -3.3361 -3.2993 -3.2993 -3.2993 -3.2993 -3.2596 -3.2596 0.9024 0.9024 0.9198 0.9198 0.9198 0.9198 2.7565 2.7565 3.2815 3.2815 3.2815 3.2815 3.8056 3.8056 3.8922 3.8922 3.8922 3.8922 4.7507 4.7507 4.9528 4.9528 4.9528 4.9528 5.2884 5.2884 5.3991 5.3991 5.3991 5.3991 8.2120 8.2120 8.2120 8.2120 8.7621 8.7621 8.7621 8.7621 8.8457 8.8457 8.8907 8.8907 9.7049 9.7049 9.7049 9.7049 k = 0.2571 0.3334 0.6124 ( 8397 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0571 -6.0571 -5.8387 -5.8301 -5.8301 -5.8291 -5.8118 -5.8118 -5.5444 -5.5444 -5.5436 -5.5428 -5.5046 -5.5046 -5.4363 -5.4363 -5.3378 -5.3266 -5.3266 -5.3226 -3.3825 -3.3825 -3.3792 -3.3791 -3.3764 -3.3764 -3.3449 -3.3449 -3.3370 -3.3358 -3.3358 -3.3358 -3.3010 -3.2995 -3.2995 -3.2967 -3.2596 -3.2596 0.8924 0.8924 0.9044 0.9059 0.9447 0.9447 2.7559 2.7559 3.2800 3.2814 3.2814 3.2828 3.8065 3.8065 3.8902 3.8906 3.8957 3.8957 4.7468 4.7468 4.9286 4.9322 4.9799 4.9799 5.2801 5.2801 5.3849 5.3849 5.4169 5.4226 8.2100 8.2100 8.2109 8.2110 8.7092 8.7092 8.7732 8.8164 8.8516 8.8516 8.9038 8.9038 9.6853 9.6853 9.7006 9.7356 k = 0.2643 0.3131 0.6124 ( 8397 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0578 -6.0578 -5.8450 -5.8288 -5.8288 -5.8262 -5.8108 -5.8108 -5.5448 -5.5448 -5.5434 -5.5418 -5.5052 -5.5052 -5.4358 -5.4358 -5.3471 -5.3243 -5.3243 -5.3173 -3.3848 -3.3848 -3.3778 -3.3776 -3.3759 -3.3759 -3.3452 -3.3452 -3.3378 -3.3359 -3.3352 -3.3352 -3.3027 -3.2998 -3.2998 -3.2940 -3.2594 -3.2594 0.8772 0.8773 0.8876 0.8906 0.9764 0.9764 2.7539 2.7539 3.2784 3.2807 3.2807 3.2839 3.8093 3.8093 3.8901 3.8908 3.9008 3.9008 4.7383 4.7383 4.9056 4.9136 5.0126 5.0126 5.2530 5.2530 5.3853 5.3853 5.4360 5.4463 8.2036 8.2036 8.2076 8.2094 8.6450 8.6450 8.7827 8.8480 8.8480 8.8639 8.9389 8.9389 9.6580 9.6580 9.6935 9.7642 k = 0.2714 0.2929 0.6124 ( 8400 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0587 -6.0587 -5.8508 -5.8282 -5.8282 -5.8230 -5.8090 -5.8090 -5.5452 -5.5452 -5.5433 -5.5408 -5.5061 -5.5061 -5.4353 -5.4353 -5.3563 -5.3218 -5.3218 -5.3125 -3.3872 -3.3872 -3.3765 -3.3761 -3.3754 -3.3754 -3.3456 -3.3456 -3.3385 -3.3362 -3.3345 -3.3345 -3.3044 -3.2999 -3.2999 -3.2910 -3.2591 -3.2591 0.8602 0.8602 0.8693 0.8737 1.0116 1.0116 2.7504 2.7504 3.2767 3.2793 3.2793 3.2847 3.8142 3.8142 3.8920 3.8929 3.9077 3.9077 4.7288 4.7288 4.8849 4.8978 5.0477 5.0477 5.2128 5.2128 5.3953 5.3953 5.4555 5.4695 8.1927 8.1927 8.2025 8.2076 8.5818 8.5818 8.7910 8.8375 8.8375 8.9041 8.9813 8.9813 9.6281 9.6281 9.6831 9.7877 k = 0.2786 0.2727 0.6124 ( 8418 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0599 -6.0599 -5.8560 -5.8281 -5.8281 -5.8198 -5.8068 -5.8068 -5.5454 -5.5454 -5.5431 -5.5397 -5.5073 -5.5073 -5.4347 -5.4347 -5.3654 -5.3189 -5.3189 -5.3081 -3.3897 -3.3897 -3.3752 -3.3750 -3.3750 -3.3746 -3.3462 -3.3462 -3.3391 -3.3368 -3.3337 -3.3337 -3.3060 -3.3000 -3.3000 -3.2879 -3.2587 -3.2587 0.8415 0.8415 0.8495 0.8550 1.0498 1.0498 2.7454 2.7454 3.2751 3.2773 3.2773 3.2853 3.8213 3.8213 3.8963 3.8970 3.9160 3.9160 4.7202 4.7202 4.8668 4.8853 5.0820 5.0820 5.1671 5.1671 5.4094 5.4094 5.4751 5.4921 8.1773 8.1773 8.1959 8.2059 8.5232 8.5232 8.7982 8.8229 8.8229 8.9363 9.0251 9.0251 9.5986 9.5986 9.6694 9.8035 k = 0.2857 0.2525 0.6124 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0611 -6.0611 -5.8606 -5.8284 -5.8284 -5.8163 -5.8041 -5.8041 -5.5456 -5.5456 -5.5430 -5.5387 -5.5087 -5.5087 -5.4343 -5.4343 -5.3744 -5.3159 -5.3159 -5.3043 -3.3922 -3.3922 -3.3748 -3.3748 -3.3741 -3.3732 -3.3469 -3.3469 -3.3395 -3.3375 -3.3329 -3.3329 -3.3076 -3.3000 -3.3000 -3.2849 -3.2581 -3.2581 0.8210 0.8210 0.8280 0.8345 1.0909 1.0909 2.7387 2.7387 3.2734 3.2746 3.2746 3.2855 3.8306 3.8306 3.9033 3.9033 3.9257 3.9257 4.7138 4.7138 4.8519 4.8763 5.0947 5.0947 5.1393 5.1393 5.4248 5.4248 5.4943 5.5138 8.1571 8.1571 8.1882 8.2045 8.4712 8.4712 8.8046 8.8046 8.8047 8.9605 9.0683 9.0683 9.5713 9.5713 9.6527 9.8093 k = 0.2929 0.2323 0.6124 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0622 -6.0622 -5.8647 -5.8287 -5.8287 -5.8128 -5.8013 -5.8013 -5.5456 -5.5456 -5.5429 -5.5376 -5.5103 -5.5103 -5.4341 -5.4341 -5.3832 -5.3126 -5.3126 -5.3011 -3.3947 -3.3947 -3.3746 -3.3746 -3.3730 -3.3718 -3.3478 -3.3478 -3.3399 -3.3383 -3.3321 -3.3321 -3.3092 -3.2998 -3.2998 -3.2818 -3.2575 -3.2575 0.7988 0.7988 0.8047 0.8122 1.1348 1.1348 2.7306 2.7306 3.2710 3.2710 3.2718 3.2852 3.8424 3.8424 3.9119 3.9132 3.9361 3.9362 4.7102 4.7102 4.8404 4.8711 5.0511 5.0511 5.1653 5.1653 5.4405 5.4405 5.5129 5.5344 8.1320 8.1320 8.1797 8.2036 8.4270 8.4270 8.7827 8.7827 8.8101 8.9766 9.1099 9.1099 9.5470 9.5470 9.6339 9.8044 k = 0.3000 0.2121 0.6124 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0632 -6.0632 -5.8681 -5.8291 -5.8291 -5.8091 -5.7985 -5.7985 -5.5455 -5.5455 -5.5428 -5.5365 -5.5119 -5.5119 -5.4340 -5.4340 -5.3918 -5.3094 -5.3094 -5.2984 -3.3973 -3.3973 -3.3746 -3.3746 -3.3720 -3.3704 -3.3489 -3.3489 -3.3402 -3.3392 -3.3313 -3.3313 -3.3107 -3.2996 -3.2996 -3.2789 -3.2568 -3.2568 0.7749 0.7749 0.7798 0.7881 1.1813 1.1813 2.7212 2.7212 3.2668 3.2668 3.2702 3.2845 3.8564 3.8564 3.9231 3.9263 3.9468 3.9468 4.7097 4.7097 4.8322 4.8696 4.9985 4.9985 5.1993 5.1993 5.4558 5.4558 5.5306 5.5538 8.1024 8.1024 8.1708 8.2033 8.3909 8.3909 8.7577 8.7577 8.8144 8.9844 9.1490 9.1490 9.5260 9.5260 9.6143 9.7898 k = 0.3071 0.1919 0.6124 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0640 -6.0640 -5.8710 -5.8294 -5.8294 -5.8053 -5.7956 -5.7956 -5.5453 -5.5453 -5.5427 -5.5354 -5.5136 -5.5136 -5.4343 -5.4343 -5.4002 -5.3061 -5.3061 -5.2962 -3.3998 -3.3998 -3.3746 -3.3746 -3.3711 -3.3690 -3.3500 -3.3500 -3.3404 -3.3400 -3.3306 -3.3306 -3.3122 -3.2992 -3.2992 -3.2761 -3.2561 -3.2561 0.7492 0.7492 0.7533 0.7622 1.2303 1.2303 2.7107 2.7107 3.2619 3.2619 3.2687 3.2833 3.8727 3.8727 3.9368 3.9426 3.9569 3.9569 4.7120 4.7120 4.8276 4.8721 4.9463 4.9463 5.2333 5.2333 5.4704 5.4704 5.5475 5.5719 8.0695 8.0695 8.1618 8.2039 8.3623 8.3623 8.7299 8.7299 8.8170 8.9840 9.1853 9.1853 9.5082 9.5082 9.5950 9.7675 k = 0.3143 0.1717 0.6124 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0644 -6.0644 -5.8732 -5.8295 -5.8295 -5.8013 -5.7929 -5.7929 -5.5450 -5.5450 -5.5426 -5.5343 -5.5154 -5.5154 -5.4348 -5.4348 -5.4083 -5.3030 -5.3030 -5.2946 -3.4023 -3.4023 -3.3747 -3.3747 -3.3704 -3.3676 -3.3513 -3.3513 -3.3409 -3.3406 -3.3300 -3.3300 -3.3135 -3.2987 -3.2987 -3.2734 -3.2553 -3.2553 0.7220 0.7220 0.7253 0.7346 1.2816 1.2816 2.6995 2.6995 3.2564 3.2564 3.2671 3.2815 3.8907 3.8907 3.9532 3.9623 3.9657 3.9657 4.7169 4.7169 4.8263 4.8783 4.8968 4.8968 5.2663 5.2663 5.4841 5.4841 5.5632 5.5886 8.0347 8.0347 8.1529 8.2053 8.3400 8.3400 8.7001 8.7001 8.8177 8.9756 9.2182 9.2182 9.4933 9.4933 9.5772 9.7404 k = 0.3214 0.1515 0.6124 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0646 -6.0646 -5.8748 -5.8295 -5.8295 -5.7973 -5.7903 -5.7903 -5.5446 -5.5446 -5.5425 -5.5332 -5.5171 -5.5171 -5.4356 -5.4356 -5.4161 -5.3001 -5.3001 -5.2936 -3.4048 -3.4048 -3.3749 -3.3749 -3.3698 -3.3662 -3.3526 -3.3526 -3.3417 -3.3407 -3.3294 -3.3294 -3.3148 -3.2982 -3.2982 -3.2709 -3.2545 -3.2545 0.6933 0.6933 0.6958 0.7054 1.3349 1.3349 2.6880 2.6880 3.2505 3.2505 3.2655 3.2794 3.9092 3.9092 3.9722 3.9733 3.9733 3.9854 4.7230 4.7230 4.8284 4.8530 4.8530 4.8882 5.2980 5.2980 5.4968 5.4968 5.5779 5.6037 7.9994 7.9994 8.1444 8.2076 8.3224 8.3224 8.6693 8.6693 8.8158 8.9595 9.2475 9.2475 9.4804 9.4804 9.5617 9.7112 k = 0.3286 0.1313 0.6124 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0644 -6.0643 -5.8759 -5.8293 -5.8293 -5.7932 -5.7879 -5.7879 -5.5440 -5.5440 -5.5425 -5.5321 -5.5188 -5.5188 -5.4366 -5.4366 -5.4236 -5.2975 -5.2975 -5.2931 -3.4073 -3.4073 -3.3751 -3.3751 -3.3694 -3.3649 -3.3540 -3.3540 -3.3424 -3.3408 -3.3288 -3.3288 -3.3160 -3.2976 -3.2976 -3.2687 -3.2538 -3.2538 0.6633 0.6633 0.6651 0.6748 1.3899 1.3899 2.6766 2.6766 3.2443 3.2443 3.2639 3.2768 3.9247 3.9247 3.9814 3.9814 3.9938 4.0115 4.7270 4.7270 4.8196 4.8196 4.8337 4.9018 5.3282 5.3282 5.5082 5.5082 5.5913 5.6173 7.9648 7.9648 8.1364 8.2109 8.3083 8.3083 8.6385 8.6385 8.8110 8.9365 9.2729 9.2729 9.4687 9.4687 9.5489 9.6824 k = 0.3357 0.1111 0.6124 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0637 -6.0637 -5.8763 -5.8289 -5.8289 -5.7891 -5.7856 -5.7856 -5.5433 -5.5433 -5.5425 -5.5310 -5.5205 -5.5205 -5.4378 -5.4378 -5.4307 -5.2953 -5.2953 -5.2931 -3.4098 -3.4098 -3.3754 -3.3754 -3.3691 -3.3636 -3.3554 -3.3554 -3.3430 -3.3410 -3.3284 -3.3284 -3.3171 -3.2969 -3.2969 -3.2667 -3.2530 -3.2530 0.6321 0.6321 0.6333 0.6430 1.4463 1.4463 2.6658 2.6658 3.2380 3.2380 3.2622 3.2739 3.9310 3.9310 3.9949 3.9949 4.0177 4.0406 4.7217 4.7217 4.8046 4.8046 4.8422 4.9190 5.3570 5.3570 5.5185 5.5185 5.6035 5.6294 7.9315 7.9315 8.1290 8.2152 8.2964 8.2964 8.6089 8.6089 8.8028 8.9077 9.2944 9.2944 9.4573 9.4573 9.5386 9.6555 k = 0.3429 0.0909 0.6124 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0626 -6.0626 -5.8761 -5.8283 -5.8283 -5.7849 -5.7835 -5.7835 -5.5425 -5.5425 -5.5425 -5.5300 -5.5221 -5.5221 -5.4392 -5.4392 -5.4374 -5.2937 -5.2936 -5.2936 -3.4123 -3.4123 -3.3758 -3.3758 -3.3691 -3.3625 -3.3569 -3.3569 -3.3435 -3.3412 -3.3280 -3.3280 -3.3179 -3.2962 -3.2962 -3.2650 -3.2523 -3.2523 0.6000 0.6000 0.6007 0.6102 1.5035 1.5036 2.6561 2.6561 3.2317 3.2317 3.2606 3.2708 3.9244 3.9244 4.0162 4.0163 4.0439 4.0723 4.7058 4.7058 4.8103 4.8103 4.8538 4.9395 5.3843 5.3843 5.5276 5.5276 5.6144 5.6397 7.8998 7.8998 8.1221 8.2203 8.2859 8.2859 8.5816 8.5816 8.7912 8.8742 9.3121 9.3121 9.4455 9.4455 9.5304 9.6318 k = 0.3500 0.0707 0.6124 ( 8427 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0611 -6.0611 -5.8754 -5.8276 -5.8276 -5.7816 -5.7816 -5.7807 -5.5425 -5.5416 -5.5416 -5.5291 -5.5236 -5.5236 -5.4437 -5.4407 -5.4407 -5.2949 -5.2924 -5.2924 -3.4147 -3.4147 -3.3761 -3.3761 -3.3692 -3.3614 -3.3583 -3.3583 -3.3438 -3.3414 -3.3278 -3.3278 -3.3186 -3.2955 -3.2955 -3.2635 -3.2517 -3.2517 0.5671 0.5672 0.5674 0.5767 1.5611 1.5611 2.6482 2.6482 3.2256 3.2256 3.2590 3.2676 3.9070 3.9070 4.0426 4.0426 4.0719 4.1062 4.6880 4.6880 4.8279 4.8279 4.8684 4.9634 5.4099 5.4099 5.5353 5.5353 5.6242 5.6485 7.8697 7.8697 8.1159 8.2261 8.2760 8.2760 8.5577 8.5577 8.7765 8.8375 9.3259 9.3259 9.4329 9.4329 9.5237 9.6117 k = 0.3571 0.0505 0.6124 ( 8433 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0591 -6.0591 -5.8740 -5.8266 -5.8266 -5.7799 -5.7799 -5.7766 -5.5425 -5.5406 -5.5406 -5.5283 -5.5248 -5.5248 -5.4495 -5.4423 -5.4423 -5.2965 -5.2918 -5.2918 -3.4171 -3.4171 -3.3765 -3.3765 -3.3695 -3.3604 -3.3597 -3.3597 -3.3440 -3.3417 -3.3276 -3.3276 -3.3190 -3.2948 -3.2948 -3.2622 -3.2512 -3.2512 0.5337 0.5339 0.5339 0.5428 1.6184 1.6184 2.6428 2.6428 3.2197 3.2197 3.2575 3.2644 3.8810 3.8810 4.0716 4.0716 4.1015 4.1418 4.6734 4.6734 4.8521 4.8521 4.8861 4.9904 5.4341 5.4341 5.5418 5.5418 5.6327 5.6556 7.8410 7.8410 8.1100 8.2322 8.2660 8.2660 8.5383 8.5383 8.7590 8.7989 9.3356 9.3356 9.4198 9.4198 9.5178 9.5952 k = 0.3643 0.0303 0.6124 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0567 -6.0567 -5.8722 -5.8255 -5.8255 -5.7784 -5.7784 -5.7725 -5.5425 -5.5396 -5.5396 -5.5276 -5.5258 -5.5258 -5.4546 -5.4440 -5.4440 -5.2987 -5.2918 -5.2918 -3.4195 -3.4195 -3.3769 -3.3769 -3.3699 -3.3610 -3.3610 -3.3596 -3.3441 -3.3420 -3.3275 -3.3275 -3.3191 -3.2940 -3.2940 -3.2613 -3.2507 -3.2507 0.4999 0.5004 0.5004 0.5086 1.6746 1.6746 2.6406 2.6406 3.2142 3.2142 3.2560 3.2613 3.8480 3.8480 4.1017 4.1017 4.1323 4.1786 4.6632 4.6632 4.8808 4.8808 4.9067 5.0204 5.4567 5.4567 5.5472 5.5472 5.6401 5.6611 7.8133 7.8133 8.1045 8.2385 8.2555 8.2555 8.5238 8.5238 8.7395 8.7598 9.3405 9.3405 9.4070 9.4070 9.5120 9.5818 k = 0.3714 0.0101 0.6124 ( 8415 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0538 -6.0538 -5.8698 -5.8243 -5.8243 -5.7772 -5.7772 -5.7686 -5.5426 -5.5387 -5.5387 -5.5272 -5.5264 -5.5264 -5.4591 -5.4457 -5.4457 -5.3014 -5.2924 -5.2924 -3.4218 -3.4218 -3.3773 -3.3773 -3.3705 -3.3623 -3.3623 -3.3590 -3.3441 -3.3423 -3.3274 -3.3274 -3.3189 -3.2933 -3.2933 -3.2606 -3.2504 -3.2504 0.4662 0.4669 0.4669 0.4744 1.7289 1.7289 2.6425 2.6425 3.2092 3.2092 3.2546 3.2583 3.8095 3.8095 4.1321 4.1322 4.1640 4.2160 4.6567 4.6567 4.9131 4.9131 4.9304 5.0533 5.4777 5.4777 5.5514 5.5514 5.6464 5.6651 7.7864 7.7864 8.0989 8.2442 8.2444 8.2444 8.5145 8.5145 8.7191 8.7213 9.3398 9.3398 9.3961 9.3961 9.5056 9.5707 k = 0.3786-0.0101 0.6124 ( 8409 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0505 -6.0505 -5.8669 -5.8230 -5.8230 -5.7762 -5.7762 -5.7649 -5.5427 -5.5381 -5.5381 -5.5271 -5.5264 -5.5264 -5.4628 -5.4473 -5.4473 -5.3046 -5.2937 -5.2937 -3.4241 -3.4241 -3.3777 -3.3777 -3.3712 -3.3634 -3.3634 -3.3587 -3.3439 -3.3426 -3.3275 -3.3275 -3.3184 -3.2926 -3.2926 -3.2602 -3.2501 -3.2501 0.4328 0.4337 0.4337 0.4405 1.7803 1.7803 2.6493 2.6493 3.2046 3.2046 3.2533 3.2556 3.7671 3.7671 4.1624 4.1624 4.1961 4.2534 4.6530 4.6530 4.9486 4.9486 4.9569 5.0887 5.4971 5.4971 5.5546 5.5546 5.6517 5.6676 7.7600 7.7600 8.0931 8.2326 8.2326 8.2489 8.5103 8.5103 8.6848 8.6987 9.3329 9.3329 9.3884 9.3884 9.4982 9.5609 k = 0.3857-0.0303 0.6124 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0468 -6.0468 -5.8635 -5.8216 -5.8216 -5.7754 -5.7754 -5.7614 -5.5427 -5.5379 -5.5379 -5.5273 -5.5257 -5.5257 -5.4656 -5.4489 -5.4489 -5.3082 -5.2957 -5.2957 -3.4264 -3.4264 -3.3780 -3.3780 -3.3720 -3.3645 -3.3645 -3.3588 -3.3437 -3.3428 -3.3277 -3.3277 -3.3177 -3.2919 -3.2919 -3.2600 -3.2500 -3.2500 0.4000 0.4010 0.4010 0.4072 1.8278 1.8278 2.6619 2.6619 3.2004 3.2004 3.2521 3.2531 3.7219 3.7219 4.1918 4.1919 4.2283 4.2903 4.6509 4.6509 4.9863 4.9869 4.9869 5.1265 5.5147 5.5147 5.5573 5.5573 5.6561 5.6686 7.7339 7.7339 8.0868 8.2200 8.2200 8.2515 8.5107 8.5107 8.6517 8.6793 9.3215 9.3215 9.3829 9.3829 9.4894 9.5513 k = 0.3929-0.0505 0.6124 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0427 -6.0427 -5.8597 -5.8202 -5.8202 -5.7749 -5.7749 -5.7583 -5.5429 -5.5381 -5.5381 -5.5279 -5.5242 -5.5242 -5.4675 -5.4503 -5.4503 -5.3122 -5.2984 -5.2984 -3.4286 -3.4286 -3.3782 -3.3782 -3.3728 -3.3655 -3.3655 -3.3591 -3.3434 -3.3429 -3.3281 -3.3281 -3.3167 -3.2912 -3.2912 -3.2601 -3.2499 -3.2499 0.3680 0.3691 0.3691 0.3747 1.8706 1.8706 2.6808 2.6808 3.1968 3.1968 3.2508 3.2510 3.6753 3.6753 4.2202 4.2202 4.2604 4.3261 4.6495 4.6495 5.0184 5.0276 5.0276 5.1662 5.5298 5.5298 5.5602 5.5602 5.6598 5.6683 7.7081 7.7081 8.0796 8.2067 8.2067 8.2513 8.5150 8.5150 8.6231 8.6618 9.3084 9.3084 9.3777 9.3777 9.4789 9.5410 k = 0.4000-0.0707 0.6124 ( 8439 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0383 -6.0383 -5.8555 -5.8189 -5.8189 -5.7746 -5.7746 -5.7555 -5.5430 -5.5386 -5.5386 -5.5288 -5.5221 -5.5221 -5.4684 -5.4515 -5.4515 -5.3167 -5.3018 -5.3018 -3.4307 -3.4307 -3.3784 -3.3784 -3.3736 -3.3664 -3.3664 -3.3598 -3.3431 -3.3428 -3.3285 -3.3285 -3.3155 -3.2905 -3.2905 -3.2605 -3.2500 -3.2500 0.3370 0.3382 0.3382 0.3432 1.9079 1.9079 2.7066 2.7066 3.1936 3.1936 3.2489 3.2500 3.6283 3.6283 4.2470 4.2470 4.2918 4.3604 4.6478 4.6478 5.0529 5.0701 5.0701 5.2075 5.5404 5.5404 5.5655 5.5655 5.6629 5.6669 7.6827 7.6827 8.0715 8.1926 8.1926 8.2472 8.5226 8.5226 8.6002 8.6470 9.2953 9.2953 9.3715 9.3715 9.4665 9.5290 k = 0.4071-0.0909 0.6124 ( 8421 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0336 -6.0336 -5.8509 -5.8177 -5.8177 -5.7745 -5.7745 -5.7531 -5.5431 -5.5392 -5.5392 -5.5301 -5.5196 -5.5196 -5.4683 -5.4524 -5.4524 -5.3216 -5.3058 -5.3058 -3.4327 -3.4327 -3.3784 -3.3784 -3.3744 -3.3672 -3.3672 -3.3607 -3.3427 -3.3426 -3.3290 -3.3290 -3.3141 -3.2898 -3.2898 -3.2611 -3.2501 -3.2501 0.3073 0.3085 0.3085 0.3129 1.9395 1.9395 2.7393 2.7393 3.1908 3.1908 3.2473 3.2492 3.5817 3.5817 4.2721 4.2721 4.3224 4.3927 4.6454 4.6454 5.0896 5.1139 5.1139 5.2498 5.5448 5.5448 5.5750 5.5750 5.6643 5.6656 7.6579 7.6579 8.0624 8.1776 8.1776 8.2388 8.5326 8.5326 8.5836 8.6353 9.2832 9.2832 9.3639 9.3639 9.4523 9.5147 k = 0.4143-0.1111 0.6124 ( 8434 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0287 -6.0287 -5.8459 -5.8167 -5.8167 -5.7746 -5.7746 -5.7513 -5.5432 -5.5399 -5.5399 -5.5316 -5.5168 -5.5168 -5.4673 -5.4530 -5.4530 -5.3269 -5.3105 -5.3105 -3.4346 -3.4346 -3.3784 -3.3784 -3.3751 -3.3679 -3.3679 -3.3618 -3.3424 -3.3423 -3.3297 -3.3297 -3.3124 -3.2892 -3.2892 -3.2619 -3.2504 -3.2504 0.2790 0.2801 0.2801 0.2840 1.9654 1.9654 2.7782 2.7782 3.1884 3.1884 3.2459 3.2485 3.5364 3.5364 4.2951 4.2951 4.3520 4.4227 4.6416 4.6416 5.1280 5.1583 5.1583 5.2925 5.5451 5.5451 5.5871 5.5871 5.6610 5.6681 7.6339 7.6339 8.0524 8.1615 8.1615 8.2259 8.5444 8.5444 8.5735 8.6270 9.2724 9.2724 9.3549 9.3549 9.4364 9.4976 k = 0.4214-0.1313 0.6124 ( 8428 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0237 -6.0237 -5.8407 -5.8158 -5.8158 -5.7748 -5.7748 -5.7500 -5.5434 -5.5406 -5.5406 -5.5332 -5.5138 -5.5138 -5.4654 -5.4530 -5.4530 -5.3325 -5.3157 -5.3157 -3.4365 -3.4365 -3.3783 -3.3783 -3.3758 -3.3685 -3.3685 -3.3631 -3.3420 -3.3420 -3.3305 -3.3305 -3.3106 -3.2886 -3.2886 -3.2630 -3.2506 -3.2506 0.2523 0.2534 0.2534 0.2568 1.9860 1.9860 2.8227 2.8227 3.1863 3.1863 3.2448 3.2479 3.4929 3.4929 4.3159 4.3160 4.3802 4.4502 4.6364 4.6364 5.1675 5.2027 5.2027 5.3349 5.5434 5.5434 5.5998 5.5998 5.6571 5.6705 7.6111 7.6111 8.0418 8.1445 8.1445 8.2091 8.5573 8.5573 8.5691 8.6219 9.2626 9.2626 9.3448 9.3448 9.4189 9.4776 k = 0.4286-0.1515 0.6124 ( 8398 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0185 -6.0185 -5.8352 -5.8152 -5.8152 -5.7751 -5.7751 -5.7493 -5.5435 -5.5412 -5.5412 -5.5349 -5.5107 -5.5107 -5.4627 -5.4525 -5.4525 -5.3384 -5.3216 -5.3216 -3.4381 -3.4381 -3.3781 -3.3781 -3.3765 -3.3690 -3.3690 -3.3645 -3.3417 -3.3416 -3.3314 -3.3314 -3.3087 -3.2880 -3.2880 -3.2642 -3.2510 -3.2510 0.2273 0.2284 0.2284 0.2314 2.0020 2.0020 2.8713 2.8713 3.1845 3.1845 3.2440 3.2474 3.4519 3.4519 4.3343 4.3344 4.4070 4.4750 4.6296 4.6296 5.2074 5.2462 5.2462 5.3761 5.5406 5.5406 5.6123 5.6123 5.6529 5.6731 7.5897 7.5897 8.0309 8.1267 8.1267 8.1894 8.5694 8.5705 8.5705 8.6198 9.2532 9.2532 9.3342 9.3342 9.4002 9.4550 k = 0.4357-0.1717 0.6124 ( 8401 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0134 -6.0134 -5.8294 -5.8149 -5.8149 -5.7754 -5.7754 -5.7492 -5.5437 -5.5418 -5.5418 -5.5366 -5.5078 -5.5078 -5.4594 -5.4512 -5.4512 -5.3447 -5.3280 -5.3280 -3.4397 -3.4397 -3.3779 -3.3779 -3.3770 -3.3693 -3.3693 -3.3659 -3.3413 -3.3412 -3.3324 -3.3324 -3.3066 -3.2874 -3.2874 -3.2657 -3.2513 -3.2513 0.2043 0.2054 0.2054 0.2079 2.0141 2.0141 2.9226 2.9226 3.1829 3.1829 3.2434 3.2470 3.4137 3.4137 4.3501 4.3501 4.4322 4.4970 4.6216 4.6216 5.2469 5.2880 5.2880 5.4149 5.5372 5.5372 5.6247 5.6247 5.6491 5.6760 7.5700 7.5700 8.0203 8.1085 8.1085 8.1679 8.5731 8.5835 8.5835 8.6202 9.2438 9.2438 9.3237 9.3237 9.3807 9.4303 k = 0.4429-0.1919 0.6124 ( 8389 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0084 -6.0084 -5.8235 -5.8149 -5.8149 -5.7757 -5.7757 -5.7498 -5.5439 -5.5423 -5.5423 -5.5381 -5.5052 -5.5052 -5.4554 -5.4490 -5.4490 -5.3512 -5.3349 -5.3349 -3.4411 -3.4411 -3.3776 -3.3776 -3.3775 -3.3695 -3.3695 -3.3674 -3.3410 -3.3409 -3.3334 -3.3334 -3.3044 -3.2869 -3.2869 -3.2673 -3.2517 -3.2517 0.1834 0.1844 0.1844 0.1865 2.0231 2.0231 2.9749 2.9749 3.1814 3.1814 3.2431 3.2466 3.3790 3.3790 4.3630 4.3630 4.4556 4.5161 4.6125 4.6125 5.2854 5.3272 5.3272 5.4501 5.5334 5.5334 5.6368 5.6368 5.6464 5.6794 7.5521 7.5521 8.0103 8.0903 8.0903 8.1456 8.5792 8.5956 8.5956 8.6224 9.2339 9.2339 9.3138 9.3138 9.3610 9.4042 k = 0.4500-0.2121 0.6124 ( 8395 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0035 -6.0035 -5.8175 -5.8152 -5.8152 -5.7759 -5.7759 -5.7511 -5.5440 -5.5428 -5.5428 -5.5395 -5.5028 -5.5028 -5.4508 -5.4460 -5.4460 -5.3579 -5.3422 -5.3422 -3.4424 -3.4424 -3.3778 -3.3773 -3.3773 -3.3696 -3.3696 -3.3688 -3.3407 -3.3406 -3.3345 -3.3345 -3.3021 -3.2865 -3.2865 -3.2691 -3.2521 -3.2521 0.1647 0.1656 0.1656 0.1673 2.0297 2.0297 3.0265 3.0266 3.1800 3.1800 3.2429 3.2463 3.3480 3.3480 4.3729 4.3729 4.4772 4.5324 4.6031 4.6031 5.3220 5.3631 5.3631 5.4799 5.5294 5.5294 5.6459 5.6486 5.6486 5.6834 7.5363 7.5363 8.0016 8.0727 8.0727 8.1233 8.5867 8.6063 8.6063 8.6259 9.2238 9.2238 9.3046 9.3046 9.3415 9.3779 k = 0.4571-0.2323 0.6124 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9990 -5.9990 -5.8158 -5.8158 -5.8114 -5.7761 -5.7761 -5.7530 -5.5442 -5.5432 -5.5432 -5.5407 -5.5010 -5.5010 -5.4458 -5.4419 -5.4419 -5.3648 -5.3498 -5.3498 -3.4436 -3.4436 -3.3780 -3.3771 -3.3771 -3.3702 -3.3696 -3.3696 -3.3404 -3.3403 -3.3356 -3.3356 -3.2998 -3.2861 -3.2861 -3.2711 -3.2524 -3.2524 0.1482 0.1490 0.1490 0.1505 2.0344 2.0344 3.0755 3.0755 3.1791 3.1791 3.2428 3.2459 3.3211 3.3211 4.3797 4.3797 4.4968 4.5458 4.5940 4.5940 5.3561 5.3951 5.3951 5.5022 5.5253 5.5253 5.6489 5.6602 5.6602 5.6879 7.5225 7.5225 7.9946 8.0561 8.0561 8.1016 8.5948 8.6154 8.6154 8.6299 9.2139 9.2139 9.2961 9.2961 9.3230 9.3523 k = 0.4643-0.2525 0.6124 ( 8410 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9949 -5.9949 -5.8165 -5.8165 -5.8053 -5.7763 -5.7763 -5.7555 -5.5443 -5.5435 -5.5435 -5.5417 -5.4995 -5.4995 -5.4403 -5.4369 -5.4369 -5.3718 -5.3578 -5.3578 -3.4445 -3.4445 -3.3781 -3.3769 -3.3769 -3.3715 -3.3694 -3.3694 -3.3402 -3.3401 -3.3366 -3.3366 -3.2973 -3.2857 -3.2857 -3.2731 -3.2527 -3.2527 0.1342 0.1349 0.1349 0.1360 2.0377 2.0377 3.1188 3.1188 3.1797 3.1797 3.2429 3.2457 3.2986 3.2986 4.3835 4.3835 4.5144 4.5564 4.5857 4.5857 5.3870 5.4225 5.4225 5.5159 5.5212 5.5212 5.6561 5.6712 5.6712 5.6927 7.5110 7.5110 7.9897 8.0412 8.0412 8.0809 8.6031 8.6225 8.6225 8.6337 9.2050 9.2050 9.2882 9.2882 9.3061 9.3285 k = 0.4714-0.2727 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -5.9913 -5.9913 -5.8173 -5.8173 -5.7992 -5.7763 -5.7763 -5.7587 -5.5444 -5.5438 -5.5438 -5.5426 -5.4984 -5.4984 -5.4343 -5.4311 -5.4311 -5.3790 -5.3659 -5.3659 -3.4453 -3.4453 -3.3781 -3.3767 -3.3767 -3.3727 -3.3692 -3.3692 -3.3400 -3.3399 -3.3376 -3.3376 -3.2949 -3.2854 -3.2854 -3.2753 -3.2530 -3.2530 0.1226 0.1232 0.1232 0.1241 2.0400 2.0400 3.1492 3.1492 3.1874 3.1874 3.2431 3.2454 3.2808 3.2808 4.3846 4.3846 4.5297 4.5642 4.5789 4.5789 5.4147 5.4453 5.4453 5.5172 5.5172 5.5213 5.6667 5.6814 5.6814 5.6975 7.5016 7.5016 7.9872 8.0284 8.0284 8.0616 8.6111 8.6278 8.6278 8.6368 9.1977 9.1977 9.2809 9.2809 9.2913 9.3075 k = 0.4786-0.2929 0.6124 ( 8431 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -5.9884 -5.9884 -5.8181 -5.8181 -5.7932 -5.7763 -5.7763 -5.7624 -5.5445 -5.5440 -5.5440 -5.5432 -5.4977 -5.4977 -5.4281 -5.4247 -5.4247 -5.3862 -5.3741 -5.3741 -3.4459 -3.4459 -3.3779 -3.3766 -3.3766 -3.3739 -3.3689 -3.3689 -3.3399 -3.3398 -3.3384 -3.3384 -3.2924 -3.2852 -3.2852 -3.2776 -3.2532 -3.2532 0.1136 0.1141 0.1141 0.1147 2.0416 2.0416 3.1589 3.1589 3.2087 3.2087 3.2433 3.2451 3.2677 3.2677 4.3838 4.3838 4.5428 4.5691 4.5738 4.5738 5.4388 5.4636 5.4636 5.5132 5.5132 5.5201 5.6785 5.6902 5.6902 5.7016 7.4944 7.4944 7.9874 8.0180 8.0180 8.0441 8.6185 8.6314 8.6314 8.6387 9.1921 9.1921 9.2745 9.2745 9.2792 9.2902 k = 0.4857-0.3131 0.6124 ( 8458 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9862 -5.9862 -5.8187 -5.8187 -5.7874 -5.7763 -5.7763 -5.7666 -5.5445 -5.5442 -5.5442 -5.5437 -5.4972 -5.4972 -5.4216 -5.4179 -5.4179 -5.3935 -5.3821 -5.3821 -3.4464 -3.4464 -3.3776 -3.3766 -3.3766 -3.3749 -3.3687 -3.3687 -3.3398 -3.3397 -3.3391 -3.3391 -3.2899 -3.2850 -3.2850 -3.2800 -3.2534 -3.2534 0.1072 0.1075 0.1075 0.1079 2.0426 2.0426 3.1596 3.1596 3.2300 3.2300 3.2436 3.2448 3.2594 3.2594 4.3821 4.3821 4.5536 4.5703 4.5703 4.5713 5.4597 5.4776 5.4776 5.5091 5.5091 5.5141 5.6893 5.6971 5.6971 5.7044 7.4892 7.4892 7.9903 8.0104 8.0104 8.0285 8.6252 8.6335 8.6335 8.6391 9.1885 9.1885 9.2693 9.2693 9.2705 9.2771 k = 0.4929-0.3334 0.6124 ( 8452 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9848 -5.9848 -5.8191 -5.8191 -5.7817 -5.7763 -5.7763 -5.7713 -5.5444 -5.5443 -5.5443 -5.5441 -5.4970 -5.4970 -5.4148 -5.4113 -5.4113 -5.4007 -5.3893 -5.3893 -3.4467 -3.4467 -3.3771 -3.3765 -3.3765 -3.3758 -3.3685 -3.3685 -3.3397 -3.3397 -3.3395 -3.3395 -3.2874 -3.2849 -3.2849 -3.2824 -3.2535 -3.2535 0.1034 0.1035 0.1035 0.1037 2.0431 2.0431 3.1590 3.1590 3.2419 3.2419 3.2439 3.2445 3.2569 3.2569 4.3806 4.3806 4.5619 4.5683 4.5683 4.5708 5.4775 5.4877 5.4877 5.5047 5.5049 5.5049 5.6977 5.7014 5.7014 5.7050 7.4862 7.4862 7.9959 8.0058 8.0058 8.0152 8.6307 8.6347 8.6347 8.6378 9.1865 9.1865 9.2655 9.2660 9.2660 9.2686 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -5.9844 -5.9844 -5.8193 -5.8193 -5.7763 -5.7763 -5.7763 -5.7763 -5.5443 -5.5443 -5.5443 -5.5443 -5.4969 -5.4969 -5.4078 -5.4078 -5.4078 -5.4078 -5.3931 -5.3931 -3.4468 -3.4468 -3.3765 -3.3765 -3.3765 -3.3765 -3.3684 -3.3684 -3.3397 -3.3397 -3.3397 -3.3397 -3.2849 -3.2849 -3.2849 -3.2849 -3.2535 -3.2535 0.1022 0.1022 0.1022 0.1022 2.0433 2.0433 3.1587 3.1587 3.2442 3.2442 3.2442 3.2442 3.2581 3.2581 4.3800 4.3800 4.5677 4.5677 4.5677 4.5677 5.4925 5.4925 5.4925 5.4925 5.5020 5.5020 5.7029 5.7029 5.7029 5.7029 7.4852 7.4852 8.0043 8.0043 8.0043 8.0043 8.6350 8.6350 8.6350 8.6350 9.1858 9.1858 9.2648 9.2648 9.2648 9.2648 k = 0.2500 0.3536 0.6124 ( 8472 PWs) bands (ev): -61.8658 -61.8658 -34.7457 -34.7457 -26.0496 -26.0496 -26.0496 -26.0496 -6.0568 -6.0568 -5.8320 -5.8320 -5.8320 -5.8320 -5.8121 -5.8121 -5.5438 -5.5438 -5.5438 -5.5438 -5.5044 -5.5044 -5.4365 -5.4365 -5.3285 -5.3285 -5.3285 -5.3285 -3.3806 -3.3806 -3.3806 -3.3806 -3.3767 -3.3767 -3.3449 -3.3449 -3.3361 -3.3361 -3.3361 -3.3361 -3.2993 -3.2993 -3.2993 -3.2993 -3.2596 -3.2596 0.9024 0.9024 0.9198 0.9198 0.9198 0.9198 2.7565 2.7565 3.2815 3.2815 3.2815 3.2815 3.8056 3.8056 3.8922 3.8922 3.8922 3.8922 4.7507 4.7507 4.9528 4.9528 4.9528 4.9528 5.2884 5.2884 5.3991 5.3991 5.3991 5.3991 8.2120 8.2120 8.2120 8.2120 8.7621 8.7621 8.7621 8.7621 8.8457 8.8457 8.8907 8.8907 9.7049 9.7049 9.7049 9.7049 k = 0.2375 0.3359 0.6124 ( 8400 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0571 -6.0571 -5.8361 -5.8361 -5.8279 -5.8279 -5.8118 -5.8118 -5.5444 -5.5444 -5.5431 -5.5431 -5.5046 -5.5046 -5.4363 -5.4363 -5.3341 -5.3341 -5.3227 -5.3227 -3.3823 -3.3823 -3.3795 -3.3795 -3.3762 -3.3762 -3.3449 -3.3449 -3.3366 -3.3366 -3.3355 -3.3355 -3.3007 -3.3007 -3.2977 -3.2977 -3.2596 -3.2596 0.8877 0.8877 0.9141 0.9141 0.9404 0.9404 2.7559 2.7559 3.2804 3.2804 3.2825 3.2825 3.8065 3.8065 3.8902 3.8902 3.8959 3.8959 4.7459 4.7459 4.9325 4.9325 4.9783 4.9783 5.2820 5.2820 5.3807 5.3807 5.4222 5.4222 8.2089 8.2089 8.2119 8.2119 8.7118 8.7118 8.7826 8.7826 8.8621 8.8621 8.9030 8.9030 9.6834 9.6834 9.7200 9.7200 k = 0.2250 0.3182 0.6124 ( 8400 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0580 -6.0580 -5.8401 -5.8401 -5.8243 -5.8243 -5.8108 -5.8108 -5.5450 -5.5450 -5.5424 -5.5424 -5.5052 -5.5052 -5.4357 -5.4357 -5.3396 -5.3396 -5.3169 -5.3169 -3.3844 -3.3844 -3.3790 -3.3790 -3.3750 -3.3750 -3.3451 -3.3451 -3.3371 -3.3371 -3.3350 -3.3350 -3.3019 -3.3019 -3.2961 -3.2961 -3.2594 -3.2594 0.8658 0.8658 0.9125 0.9125 0.9650 0.9650 2.7541 2.7541 3.2788 3.2788 3.2835 3.2835 3.8086 3.8086 3.8890 3.8890 3.9024 3.9024 4.7321 4.7321 4.9188 4.9188 5.0073 5.0073 5.2657 5.2657 5.3643 5.3643 5.4498 5.4498 8.1996 8.1996 8.2113 8.2113 8.6500 8.6500 8.7791 8.7791 8.8847 8.8847 8.9420 8.9420 9.6584 9.6584 9.7294 9.7294 k = 0.2125 0.3005 0.6124 ( 8410 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0594 -6.0594 -5.8439 -5.8439 -5.8215 -5.8215 -5.8087 -5.8087 -5.5456 -5.5456 -5.5417 -5.5417 -5.5062 -5.5062 -5.4350 -5.4350 -5.3448 -5.3448 -5.3112 -5.3112 -3.3866 -3.3866 -3.3788 -3.3788 -3.3736 -3.3736 -3.3454 -3.3454 -3.3375 -3.3375 -3.3345 -3.3345 -3.3029 -3.3029 -3.2944 -3.2944 -3.2591 -3.2591 0.8440 0.8440 0.9104 0.9104 0.9906 0.9906 2.7508 2.7508 3.2768 3.2768 3.2854 3.2854 3.8109 3.8109 3.8877 3.8877 3.9127 3.9127 4.7108 4.7108 4.9115 4.9115 5.0380 5.0380 5.2445 5.2445 5.3467 5.3467 5.4804 5.4804 8.1844 8.1844 8.2101 8.2101 8.5847 8.5847 8.7691 8.7691 8.9034 8.9034 8.9933 8.9933 9.6336 9.6336 9.7359 9.7359 k = 0.2000 0.2828 0.6124 ( 8420 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0613 -6.0613 -5.8475 -5.8475 -5.8199 -5.8199 -5.8053 -5.8053 -5.5461 -5.5461 -5.5408 -5.5408 -5.5074 -5.5074 -5.4342 -5.4342 -5.3494 -5.3494 -5.3056 -5.3056 -3.3889 -3.3889 -3.3787 -3.3787 -3.3722 -3.3722 -3.3458 -3.3458 -3.3377 -3.3377 -3.3343 -3.3343 -3.3036 -3.3036 -3.2928 -3.2928 -3.2587 -3.2587 0.8230 0.8230 0.9076 0.9076 1.0166 1.0166 2.7458 2.7458 3.2743 3.2743 3.2895 3.2895 3.8124 3.8124 3.8861 3.8861 3.9274 3.9274 4.6842 4.6842 4.9097 4.9097 5.0693 5.0693 5.2220 5.2220 5.3262 5.3262 5.5124 5.5124 8.1638 8.1638 8.2080 8.2080 8.5183 8.5183 8.7584 8.7584 8.9219 8.9219 9.0452 9.0452 9.6115 9.6115 9.7411 9.7411 k = 0.1875 0.2652 0.6124 ( 8428 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0636 -6.0636 -5.8508 -5.8508 -5.8192 -5.8192 -5.8009 -5.8009 -5.5467 -5.5467 -5.5400 -5.5400 -5.5087 -5.5087 -5.4337 -5.4337 -5.3534 -5.3534 -5.3003 -5.3003 -3.3912 -3.3912 -3.3787 -3.3787 -3.3709 -3.3709 -3.3463 -3.3463 -3.3379 -3.3379 -3.3342 -3.3342 -3.3040 -3.3040 -3.2912 -3.2912 -3.2582 -3.2582 0.8030 0.8030 0.9042 0.9042 1.0429 1.0430 2.7388 2.7388 3.2712 3.2712 3.2969 3.2969 3.8125 3.8125 3.8836 3.8836 3.9460 3.9460 4.6546 4.6546 4.9119 4.9119 5.1002 5.1002 5.2000 5.2000 5.3023 5.3023 5.5449 5.5449 8.1382 8.1382 8.2046 8.2046 8.4524 8.4524 8.7495 8.7495 8.9408 8.9408 9.0942 9.0942 9.5934 9.5934 9.7456 9.7456 k = 0.1750 0.2475 0.6124 ( 8428 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0663 -6.0663 -5.8540 -5.8540 -5.8189 -5.8189 -5.7960 -5.7960 -5.5471 -5.5471 -5.5391 -5.5391 -5.5101 -5.5101 -5.4336 -5.4336 -5.3564 -5.3564 -5.2952 -5.2952 -3.3936 -3.3936 -3.3787 -3.3787 -3.3697 -3.3697 -3.3469 -3.3469 -3.3380 -3.3380 -3.3343 -3.3343 -3.3040 -3.3040 -3.2896 -3.2896 -3.2576 -3.2576 0.7841 0.7841 0.9003 0.9003 1.0693 1.0693 2.7296 2.7296 3.2677 3.2677 3.3086 3.3086 3.8113 3.8113 3.8800 3.8800 3.9674 3.9674 4.6237 4.6237 4.9167 4.9167 5.1293 5.1293 5.1800 5.1800 5.2759 5.2759 5.5772 5.5772 8.1082 8.1082 8.1996 8.1996 8.3881 8.3881 8.7436 8.7436 8.9601 8.9601 9.1386 9.1386 9.5798 9.5798 9.7493 9.7493 k = 0.1625 0.2298 0.6124 ( 8428 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0693 -6.0693 -5.8568 -5.8568 -5.8189 -5.8189 -5.7909 -5.7909 -5.5476 -5.5476 -5.5382 -5.5382 -5.5114 -5.5114 -5.4344 -5.4344 -5.3584 -5.3584 -5.2903 -5.2903 -3.3958 -3.3958 -3.3787 -3.3787 -3.3687 -3.3687 -3.3474 -3.3474 -3.3380 -3.3380 -3.3346 -3.3346 -3.3036 -3.3036 -3.2880 -3.2880 -3.2570 -3.2570 0.7664 0.7664 0.8959 0.8959 1.0955 1.0956 2.7183 2.7183 3.2638 3.2638 3.3252 3.3252 3.8092 3.8092 3.8752 3.8752 3.9902 3.9902 4.5927 4.5927 4.9232 4.9232 5.1476 5.1476 5.1699 5.1699 5.2484 5.2484 5.6086 5.6086 8.0741 8.0741 8.1924 8.1924 8.3271 8.3271 8.7415 8.7415 8.9797 8.9797 9.1775 9.1775 9.5709 9.5709 9.7519 9.7519 k = 0.1500 0.2121 0.6124 ( 8430 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0725 -6.0725 -5.8595 -5.8595 -5.8190 -5.8190 -5.7857 -5.7857 -5.5481 -5.5481 -5.5373 -5.5373 -5.5126 -5.5126 -5.4360 -5.4360 -5.3593 -5.3593 -5.2858 -5.2858 -3.3981 -3.3981 -3.3788 -3.3788 -3.3679 -3.3679 -3.3480 -3.3480 -3.3382 -3.3382 -3.3350 -3.3350 -3.3029 -3.3029 -3.2865 -3.2865 -3.2564 -3.2564 0.7499 0.7499 0.8912 0.8912 1.1214 1.1214 2.7052 2.7052 3.2595 3.2595 3.3471 3.3471 3.8063 3.8063 3.8692 3.8692 4.0130 4.0130 4.5625 4.5625 4.9304 4.9304 5.1357 5.1357 5.1842 5.1842 5.2260 5.2260 5.6389 5.6389 8.0365 8.0365 8.1823 8.1823 8.2710 8.2710 8.7438 8.7438 8.9992 8.9992 9.2104 9.2104 9.5667 9.5667 9.7528 9.7528 k = 0.1375 0.1945 0.6124 ( 8430 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0757 -6.0757 -5.8619 -5.8619 -5.8193 -5.8193 -5.7806 -5.7806 -5.5485 -5.5485 -5.5364 -5.5364 -5.5135 -5.5135 -5.4385 -5.4385 -5.3592 -5.3592 -5.2816 -5.2816 -3.4002 -3.4002 -3.3788 -3.3788 -3.3672 -3.3672 -3.3485 -3.3485 -3.3385 -3.3385 -3.3354 -3.3354 -3.3020 -3.3020 -3.2851 -3.2851 -3.2557 -3.2557 0.7346 0.7346 0.8864 0.8864 1.1466 1.1466 2.6906 2.6906 3.2551 3.2551 3.3741 3.3741 3.8028 3.8028 3.8621 3.8621 4.0344 4.0344 4.5338 4.5338 4.9372 4.9372 5.1177 5.1177 5.1783 5.1783 5.2304 5.2304 5.6675 5.6675 7.9960 7.9960 8.1671 8.1671 8.2231 8.2231 8.7507 8.7507 9.0185 9.0185 9.2371 9.2371 9.5666 9.5666 9.7511 9.7511 k = 0.1250 0.1768 0.6124 ( 8434 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0790 -6.0790 -5.8641 -5.8641 -5.8195 -5.8195 -5.7756 -5.7756 -5.5490 -5.5490 -5.5356 -5.5356 -5.5141 -5.5141 -5.4419 -5.4419 -5.3581 -5.3581 -5.2778 -5.2778 -3.4022 -3.4022 -3.3789 -3.3789 -3.3666 -3.3666 -3.3490 -3.3490 -3.3391 -3.3391 -3.3355 -3.3355 -3.3009 -3.3009 -3.2838 -3.2838 -3.2551 -3.2551 0.7205 0.7205 0.8815 0.8815 1.1709 1.1709 2.6751 2.6751 3.2506 3.2506 3.4060 3.4060 3.7990 3.7990 3.8541 3.8541 4.0532 4.0532 4.5070 4.5070 4.9422 4.9422 5.0984 5.0984 5.1590 5.1590 5.2517 5.2517 5.6943 5.6943 7.9533 7.9533 8.1414 8.1414 8.1897 8.1897 8.7622 8.7622 9.0372 9.0372 9.2578 9.2578 9.5700 9.5700 9.7460 9.7460 k = 0.1125 0.1591 0.6124 ( 8436 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0823 -6.0823 -5.8660 -5.8660 -5.8198 -5.8198 -5.7708 -5.7708 -5.5494 -5.5494 -5.5349 -5.5349 -5.5143 -5.5143 -5.4459 -5.4459 -5.3563 -5.3563 -5.2743 -5.2743 -3.4041 -3.4041 -3.3789 -3.3789 -3.3661 -3.3661 -3.3494 -3.3494 -3.3399 -3.3399 -3.3356 -3.3356 -3.2998 -3.2998 -3.2825 -3.2825 -3.2545 -3.2545 0.7078 0.7078 0.8766 0.8766 1.1941 1.1941 2.6592 2.6592 3.2461 3.2461 3.4424 3.4424 3.7946 3.7946 3.8456 3.8456 4.0680 4.0681 4.4824 4.4824 4.9437 4.9437 5.0792 5.0792 5.1430 5.1430 5.2740 5.2740 5.7190 5.7190 7.9095 7.9095 8.1067 8.1067 8.1697 8.1697 8.7779 8.7779 9.0549 9.0549 9.2732 9.2732 9.5755 9.5755 9.7368 9.7368 k = 0.1000 0.1414 0.6124 ( 8440 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0854 -6.0854 -5.8678 -5.8678 -5.8201 -5.8201 -5.7664 -5.7664 -5.5498 -5.5498 -5.5344 -5.5344 -5.5140 -5.5140 -5.4504 -5.4504 -5.3541 -5.3541 -5.2713 -5.2713 -3.4059 -3.4059 -3.3790 -3.3790 -3.3656 -3.3656 -3.3499 -3.3499 -3.3408 -3.3408 -3.3355 -3.3355 -3.2986 -3.2986 -3.2813 -3.2813 -3.2540 -3.2540 0.6963 0.6963 0.8720 0.8720 1.2159 1.2159 2.6436 2.6436 3.2418 3.2418 3.4824 3.4824 3.7898 3.7898 3.8371 3.8371 4.0779 4.0780 4.4602 4.4602 4.9393 4.9393 5.0634 5.0634 5.1319 5.1319 5.2950 5.2950 5.7414 5.7414 7.8662 7.8662 8.0717 8.0717 8.1551 8.1551 8.7974 8.7974 9.0712 9.0712 9.2840 9.2840 9.5817 9.5817 9.7238 9.7238 k = 0.0875 0.1237 0.6124 ( 8436 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0496 -26.0496 -26.0495 -26.0495 -6.0883 -6.0883 -5.8693 -5.8693 -5.8204 -5.8204 -5.7623 -5.7623 -5.5501 -5.5501 -5.5340 -5.5340 -5.5131 -5.5131 -5.4553 -5.4553 -5.3516 -5.3516 -5.2686 -5.2686 -3.4075 -3.4075 -3.3791 -3.3791 -3.3652 -3.3652 -3.3503 -3.3503 -3.3418 -3.3418 -3.3353 -3.3353 -3.2974 -3.2974 -3.2802 -3.2802 -3.2535 -3.2535 0.6862 0.6862 0.8676 0.8676 1.2359 1.2359 2.6286 2.6286 3.2377 3.2377 3.5255 3.5255 3.7844 3.7844 3.8294 3.8294 4.0819 4.0819 4.4404 4.4404 4.9283 4.9283 5.0538 5.0538 5.1248 5.1248 5.3142 5.3142 5.7614 5.7614 7.8246 7.8246 8.0398 8.0398 8.1424 8.1424 8.8199 8.8199 9.0857 9.0857 9.2910 9.2910 9.5861 9.5861 9.7086 9.7086 k = 0.0750 0.1061 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0909 -6.0909 -5.8707 -5.8707 -5.8207 -5.8207 -5.7586 -5.7586 -5.5505 -5.5505 -5.5338 -5.5338 -5.5117 -5.5117 -5.4602 -5.4602 -5.3491 -5.3491 -5.2663 -5.2663 -3.4089 -3.4089 -3.3793 -3.3793 -3.3649 -3.3649 -3.3506 -3.3506 -3.3426 -3.3426 -3.3352 -3.3352 -3.2963 -3.2963 -3.2792 -3.2792 -3.2530 -3.2530 0.6774 0.6774 0.8636 0.8636 1.2540 1.2540 2.6148 2.6148 3.2340 3.2340 3.5706 3.5706 3.7787 3.7787 3.8228 3.8228 4.0791 4.0791 4.4231 4.4231 4.9125 4.9125 5.0502 5.0502 5.1206 5.1207 5.3311 5.3311 5.7789 5.7789 7.7861 7.7861 8.0118 8.0118 8.1310 8.1310 8.8448 8.8448 9.0978 9.0978 9.2952 9.2952 9.5859 9.5859 9.6949 9.6949 k = 0.0625 0.0884 0.6124 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0933 -6.0933 -5.8718 -5.8718 -5.8209 -5.8209 -5.7554 -5.7554 -5.5508 -5.5508 -5.5337 -5.5337 -5.5099 -5.5099 -5.4652 -5.4652 -5.3467 -5.3467 -5.2643 -5.2643 -3.4101 -3.4101 -3.3794 -3.3794 -3.3646 -3.3646 -3.3510 -3.3510 -3.3434 -3.3434 -3.3350 -3.3350 -3.2953 -3.2953 -3.2783 -3.2783 -3.2526 -3.2526 0.6699 0.6699 0.8600 0.8600 1.2699 1.2699 2.6025 2.6025 3.2307 3.2307 3.6165 3.6165 3.7731 3.7731 3.8180 3.8180 4.0691 4.0691 4.4085 4.4085 4.8955 4.8955 5.0502 5.0502 5.1186 5.1186 5.3457 5.3457 5.7938 5.7938 7.7519 7.7519 7.9880 7.9880 8.1210 8.1210 8.8710 8.8710 9.1073 9.1073 9.2971 9.2971 9.5781 9.5781 9.6868 9.6868 k = 0.0500 0.0707 0.6124 ( 8420 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0952 -6.0952 -5.8728 -5.8728 -5.8211 -5.8211 -5.7527 -5.7527 -5.5511 -5.5511 -5.5337 -5.5337 -5.5077 -5.5077 -5.4700 -5.4700 -5.3446 -5.3446 -5.2628 -5.2628 -3.4110 -3.4110 -3.3795 -3.3795 -3.3643 -3.3643 -3.3513 -3.3513 -3.3441 -3.3441 -3.3349 -3.3349 -3.2945 -3.2945 -3.2776 -3.2776 -3.2524 -3.2524 0.6638 0.6638 0.8571 0.8571 1.2832 1.2832 2.5920 2.5920 3.2279 3.2279 3.6610 3.6610 3.7691 3.7691 3.8152 3.8152 4.0521 4.0521 4.3965 4.3965 4.8798 4.8798 5.0517 5.0517 5.1180 5.1180 5.3578 5.3578 5.8060 5.8060 7.7227 7.7227 7.9683 7.9683 8.1125 8.1125 8.8973 8.8973 9.1137 9.1137 9.2975 9.2975 9.5637 9.5637 9.6851 9.6851 k = 0.0375 0.0530 0.6124 ( 8424 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0968 -6.0968 -5.8735 -5.8735 -5.8213 -5.8213 -5.7506 -5.7506 -5.5513 -5.5513 -5.5338 -5.5338 -5.5052 -5.5052 -5.4746 -5.4746 -5.3428 -5.3428 -5.2616 -5.2616 -3.4118 -3.4118 -3.3796 -3.3796 -3.3641 -3.3641 -3.3515 -3.3515 -3.3447 -3.3447 -3.3347 -3.3347 -3.2939 -3.2939 -3.2769 -3.2769 -3.2521 -3.2521 0.6591 0.6591 0.8547 0.8547 1.2939 1.2939 2.5836 2.5836 3.2257 3.2257 3.6992 3.6992 3.7694 3.7694 3.8153 3.8153 4.0289 4.0289 4.3872 4.3872 4.8670 4.8670 5.0536 5.0536 5.1183 5.1183 5.3673 5.3673 5.8156 5.8156 7.6993 7.6993 7.9528 7.9528 8.1057 8.1057 8.9221 8.9221 9.1170 9.1170 9.2968 9.2968 9.5469 9.5469 9.6873 9.6873 k = 0.0250 0.0354 0.6124 ( 8408 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0979 -6.0979 -5.8740 -5.8740 -5.8214 -5.8214 -5.7490 -5.7490 -5.5514 -5.5514 -5.5338 -5.5338 -5.5028 -5.5028 -5.4785 -5.4785 -5.3415 -5.3415 -5.2607 -5.2607 -3.4124 -3.4124 -3.3796 -3.3796 -3.3640 -3.3640 -3.3517 -3.3517 -3.3450 -3.3450 -3.3346 -3.3346 -3.2934 -3.2934 -3.2765 -3.2765 -3.2520 -3.2520 0.6557 0.6557 0.8529 0.8529 1.3016 1.3016 2.5775 2.5775 3.2240 3.2240 3.7223 3.7223 3.7778 3.7778 3.8216 3.8216 4.0018 4.0018 4.3805 4.3805 4.8577 4.8577 5.0552 5.0552 5.1189 5.1189 5.3741 5.3741 5.8224 5.8224 7.6822 7.6822 7.9417 7.9417 8.1007 8.1007 8.9432 8.9432 9.1175 9.1175 9.2958 9.2958 9.5319 9.5319 9.6906 9.6906 k = 0.0125 0.0177 0.6124 ( 8398 PWs) bands (ev): -61.8657 -61.8657 -34.7456 -34.7456 -26.0495 -26.0495 -26.0494 -26.0494 -6.0986 -6.0986 -5.8744 -5.8744 -5.8214 -5.8214 -5.7481 -5.7481 -5.5515 -5.5515 -5.5339 -5.5339 -5.5007 -5.5007 -5.4815 -5.4815 -5.3407 -5.3407 -5.2602 -5.2602 -3.4127 -3.4127 -3.3797 -3.3797 -3.3639 -3.3639 -3.3518 -3.3518 -3.3453 -3.3453 -3.3346 -3.3346 -3.2931 -3.2931 -3.2762 -3.2762 -3.2519 -3.2519 0.6537 0.6537 0.8519 0.8519 1.3063 1.3063 2.5738 2.5738 3.2231 3.2231 3.7298 3.7298 3.7868 3.7868 3.8372 3.8372 3.9760 3.9760 4.3766 4.3766 4.8522 4.8522 5.0563 5.0563 5.1194 5.1194 5.3782 5.3782 5.8265 5.8265 7.6718 7.6718 7.9350 7.9350 8.0977 8.0977 8.9577 8.9577 9.1167 9.1167 9.2949 9.2949 9.5219 9.5219 9.6932 9.6932 k = 0.0000 0.0000 0.6124 ( 8422 PWs) bands (ev): -61.8658 -61.8658 -34.7456 -34.7456 -26.0495 -26.0495 -26.0495 -26.0495 -6.0988 -6.0988 -5.8745 -5.8745 -5.8215 -5.8215 -5.7477 -5.7477 -5.5516 -5.5516 -5.5339 -5.5339 -5.4998 -5.4998 -5.4827 -5.4827 -5.3404 -5.3404 -5.2601 -5.2601 -3.4129 -3.4129 -3.3797 -3.3797 -3.3638 -3.3638 -3.3519 -3.3519 -3.3454 -3.3454 -3.3346 -3.3346 -3.2930 -3.2930 -3.2761 -3.2761 -3.2518 -3.2518 0.6530 0.6530 0.8515 0.8515 1.3079 1.3079 2.5726 2.5726 3.2227 3.2227 3.7311 3.7311 3.7893 3.7893 3.8476 3.8476 3.9637 3.9637 4.3753 4.3753 4.8503 4.8503 5.0566 5.0566 5.1196 5.1196 5.3796 5.3796 5.8279 5.8279 7.6683 7.6683 7.9328 7.9328 8.0967 8.0967 8.9630 8.9630 9.1161 9.1161 9.2945 9.2945 9.5184 9.5184 9.6941 9.6941 Writing output data file TaTl3Se4.save init_run : 3.90s CPU 13.70s WALL ( 1 calls) electrons : 1183.09s CPU 1194.83s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.43s CPU 1.54s WALL ( 1 calls) Called by electrons: c_bands : 1182.99s CPU 1194.57s WALL ( 1 calls) v_of_rho : 0.23s CPU 0.90s WALL ( 1 calls) v_h : 0.01s CPU 0.06s WALL ( 1 calls) v_xc : 0.22s CPU 0.61s WALL ( 1 calls) newd : 0.63s CPU 0.73s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.15s WALL ( 194 calls) cegterg : 1112.43s CPU 1119.78s WALL ( 346 calls) Called by sum_band: Called by *egterg: h_psi : 535.12s CPU 541.90s WALL ( 4698 calls) s_psi : 38.16s CPU 38.22s WALL ( 4698 calls) g_psi : 1.13s CPU 1.17s WALL ( 4158 calls) cdiaghg : 385.22s CPU 384.88s WALL ( 4352 calls) cegterg:over : 99.66s CPU 99.24s WALL ( 4158 calls) cegterg:upda : 36.61s CPU 37.34s WALL ( 4158 calls) cegterg:last : 28.63s CPU 28.86s WALL ( 928 calls) Called by h_psi: h_psi:vloc : 456.75s CPU 460.52s WALL ( 4698 calls) h_psi:vnl : 77.51s CPU 80.13s WALL ( 4698 calls) add_vuspsi : 30.42s CPU 31.78s WALL ( 4698 calls) General routines calbec : 47.05s CPU 48.27s WALL ( 4698 calls) fft : 0.28s CPU 1.35s WALL ( 19 calls) ffts : 0.03s CPU 0.04s WALL ( 4 calls) fftw : 429.82s CPU 432.24s WALL ( 1072228 calls) interpolate : 0.08s CPU 0.09s WALL ( 4 calls) davcio : 0.04s CPU 1.93s WALL ( 388 calls) Parallel routines fft_scatter : 228.08s CPU 243.33s WALL ( 1072251 calls) PWSCF : 21m 1.92s CPU 23m12.03s WALL This run was terminated on: 20:40:40 31Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=