Program PWSCF v.5.1.1 starts on 1Nov2015 at 7:15:39 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 2494 1378 207 Max 69 47 14 2500 1407 209 Sum 3301 2239 627 119879 67027 10005 bravais-lattice index = 14 lattice parameter (alat) = 12.8797 a.u. unit-cell volume = 1644.7152 (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)= 12.879654 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: 119879 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 67027 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.51 Mb ( 364, 92) NL pseudopotentials 0.46 Mb ( 182, 164) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2500) G-vector shells 0.00 Mb ( 508) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.04 Mb ( 364, 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 47.2 secs Computing kpt #: 2 total cpu time spent up to now is 53.2 secs Computing kpt #: 3 total cpu time spent up to now is 59.2 secs Computing kpt #: 4 total cpu time spent up to now is 65.0 secs Computing kpt #: 5 total cpu time spent up to now is 70.9 secs Computing kpt #: 6 total cpu time spent up to now is 76.9 secs Computing kpt #: 7 total cpu time spent up to now is 82.3 secs Computing kpt #: 8 total cpu time spent up to now is 88.5 secs Computing kpt #: 9 total cpu time spent up to now is 94.0 secs Computing kpt #: 10 total cpu time spent up to now is 100.0 secs Computing kpt #: 11 total cpu time spent up to now is 106.1 secs Computing kpt #: 12 total cpu time spent up to now is 112.4 secs Computing kpt #: 13 total cpu time spent up to now is 118.5 secs Computing kpt #: 14 total cpu time spent up to now is 124.7 secs Computing kpt #: 15 total cpu time spent up to now is 132.2 secs Computing kpt #: 16 total cpu time spent up to now is 138.6 secs Computing kpt #: 17 total cpu time spent up to now is 144.7 secs Computing kpt #: 18 total cpu time spent up to now is 150.9 secs Computing kpt #: 19 total cpu time spent up to now is 156.9 secs Computing kpt #: 20 total cpu time spent up to now is 162.9 secs Computing kpt #: 21 total cpu time spent up to now is 169.0 secs Computing kpt #: 22 total cpu time spent up to now is 175.3 secs Computing kpt #: 23 total cpu time spent up to now is 181.3 secs Computing kpt #: 24 total cpu time spent up to now is 187.4 secs Computing kpt #: 25 total cpu time spent up to now is 194.0 secs Computing kpt #: 26 total cpu time spent up to now is 200.1 secs Computing kpt #: 27 total cpu time spent up to now is 208.1 secs Computing kpt #: 28 total cpu time spent up to now is 215.7 secs Computing kpt #: 29 total cpu time spent up to now is 221.7 secs Computing kpt #: 30 total cpu time spent up to now is 227.7 secs Computing kpt #: 31 total cpu time spent up to now is 233.8 secs Computing kpt #: 32 total cpu time spent up to now is 239.5 secs Computing kpt #: 33 total cpu time spent up to now is 245.5 secs Computing kpt #: 34 total cpu time spent up to now is 251.3 secs Computing kpt #: 35 total cpu time spent up to now is 257.3 secs Computing kpt #: 36 total cpu time spent up to now is 262.8 secs Computing kpt #: 37 total cpu time spent up to now is 268.4 secs Computing kpt #: 38 total cpu time spent up to now is 274.0 secs Computing kpt #: 39 total cpu time spent up to now is 279.4 secs Computing kpt #: 40 total cpu time spent up to now is 284.9 secs Computing kpt #: 41 total cpu time spent up to now is 290.2 secs Computing kpt #: 42 total cpu time spent up to now is 295.6 secs Computing kpt #: 43 total cpu time spent up to now is 300.9 secs Computing kpt #: 44 total cpu time spent up to now is 306.4 secs Computing kpt #: 45 total cpu time spent up to now is 311.8 secs Computing kpt #: 46 total cpu time spent up to now is 317.4 secs Computing kpt #: 47 total cpu time spent up to now is 323.5 secs Computing kpt #: 48 total cpu time spent up to now is 329.7 secs Computing kpt #: 49 total cpu time spent up to now is 336.0 secs Computing kpt #: 50 total cpu time spent up to now is 342.2 secs Computing kpt #: 51 total cpu time spent up to now is 348.2 secs Computing kpt #: 52 total cpu time spent up to now is 354.3 secs Computing kpt #: 53 total cpu time spent up to now is 360.3 secs Computing kpt #: 54 total cpu time spent up to now is 366.3 secs Computing kpt #: 55 total cpu time spent up to now is 372.4 secs Computing kpt #: 56 total cpu time spent up to now is 378.6 secs Computing kpt #: 57 total cpu time spent up to now is 384.8 secs Computing kpt #: 58 total cpu time spent up to now is 390.9 secs Computing kpt #: 59 total cpu time spent up to now is 397.2 secs Computing kpt #: 60 total cpu time spent up to now is 403.1 secs Computing kpt #: 61 total cpu time spent up to now is 410.6 secs Computing kpt #: 62 total cpu time spent up to now is 416.7 secs Computing kpt #: 63 total cpu time spent up to now is 422.8 secs Computing kpt #: 64 total cpu time spent up to now is 429.1 secs Computing kpt #: 65 total cpu time spent up to now is 435.4 secs Computing kpt #: 66 total cpu time spent up to now is 441.6 secs Computing kpt #: 67 total cpu time spent up to now is 448.1 secs Computing kpt #: 68 total cpu time spent up to now is 454.7 secs Computing kpt #: 69 total cpu time spent up to now is 461.5 secs Computing kpt #: 70 total cpu time spent up to now is 468.2 secs Computing kpt #: 71 total cpu time spent up to now is 475.2 secs Computing kpt #: 72 total cpu time spent up to now is 481.8 secs Computing kpt #: 73 total cpu time spent up to now is 488.5 secs Computing kpt #: 74 total cpu time spent up to now is 495.1 secs Computing kpt #: 75 total cpu time spent up to now is 501.7 secs Computing kpt #: 76 total cpu time spent up to now is 509.2 secs Computing kpt #: 77 total cpu time spent up to now is 515.6 secs Computing kpt #: 78 total cpu time spent up to now is 522.1 secs Computing kpt #: 79 total cpu time spent up to now is 528.6 secs Computing kpt #: 80 total cpu time spent up to now is 534.8 secs Computing kpt #: 81 total cpu time spent up to now is 541.0 secs Computing kpt #: 82 total cpu time spent up to now is 547.3 secs Computing kpt #: 83 total cpu time spent up to now is 553.5 secs Computing kpt #: 84 total cpu time spent up to now is 559.7 secs Computing kpt #: 85 total cpu time spent up to now is 566.0 secs Computing kpt #: 86 total cpu time spent up to now is 572.2 secs Computing kpt #: 87 total cpu time spent up to now is 578.4 secs Computing kpt #: 88 total cpu time spent up to now is 584.6 secs Computing kpt #: 89 total cpu time spent up to now is 590.9 secs Computing kpt #: 90 total cpu time spent up to now is 597.1 secs Computing kpt #: 91 total cpu time spent up to now is 603.2 secs Computing kpt #: 92 total cpu time spent up to now is 608.8 secs Computing kpt #: 93 total cpu time spent up to now is 614.4 secs Computing kpt #: 94 total cpu time spent up to now is 620.0 secs Computing kpt #: 95 total cpu time spent up to now is 625.6 secs Computing kpt #: 96 total cpu time spent up to now is 631.6 secs Computing kpt #: 97 total cpu time spent up to now is 637.9 secs Computing kpt #: 98 total cpu time spent up to now is 645.3 secs Computing kpt #: 99 total cpu time spent up to now is 651.2 secs Computing kpt #: 100 total cpu time spent up to now is 656.7 secs Computing kpt #: 101 total cpu time spent up to now is 662.5 secs Computing kpt #: 102 total cpu time spent up to now is 668.3 secs Computing kpt #: 103 total cpu time spent up to now is 673.6 secs Computing kpt #: 104 total cpu time spent up to now is 679.0 secs Computing kpt #: 105 total cpu time spent up to now is 685.0 secs Computing kpt #: 106 total cpu time spent up to now is 691.1 secs Computing kpt #: 107 total cpu time spent up to now is 697.0 secs Computing kpt #: 108 total cpu time spent up to now is 704.8 secs Computing kpt #: 109 total cpu time spent up to now is 710.3 secs Computing kpt #: 110 total cpu time spent up to now is 716.4 secs Computing kpt #: 111 total cpu time spent up to now is 722.6 secs Computing kpt #: 112 total cpu time spent up to now is 728.7 secs Computing kpt #: 113 total cpu time spent up to now is 734.8 secs Computing kpt #: 114 total cpu time spent up to now is 740.9 secs Computing kpt #: 115 total cpu time spent up to now is 747.0 secs Computing kpt #: 116 total cpu time spent up to now is 753.1 secs Computing kpt #: 117 total cpu time spent up to now is 759.2 secs Computing kpt #: 118 total cpu time spent up to now is 765.8 secs Computing kpt #: 119 total cpu time spent up to now is 772.0 secs Computing kpt #: 120 total cpu time spent up to now is 778.1 secs Computing kpt #: 121 total cpu time spent up to now is 785.4 secs Computing kpt #: 122 total cpu time spent up to now is 791.9 secs Computing kpt #: 123 total cpu time spent up to now is 798.1 secs Computing kpt #: 124 total cpu time spent up to now is 804.4 secs Computing kpt #: 125 total cpu time spent up to now is 811.6 secs Computing kpt #: 126 total cpu time spent up to now is 817.8 secs Computing kpt #: 127 total cpu time spent up to now is 823.9 secs Computing kpt #: 128 total cpu time spent up to now is 830.1 secs Computing kpt #: 129 total cpu time spent up to now is 836.3 secs Computing kpt #: 130 total cpu time spent up to now is 842.5 secs Computing kpt #: 131 total cpu time spent up to now is 848.8 secs Computing kpt #: 132 total cpu time spent up to now is 855.0 secs Computing kpt #: 133 total cpu time spent up to now is 861.1 secs Computing kpt #: 134 total cpu time spent up to now is 867.3 secs Computing kpt #: 135 total cpu time spent up to now is 873.6 secs Computing kpt #: 136 total cpu time spent up to now is 879.7 secs Computing kpt #: 137 total cpu time spent up to now is 885.7 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 903.9 secs Computing kpt #: 141 total cpu time spent up to now is 910.0 secs Computing kpt #: 142 total cpu time spent up to now is 916.2 secs Computing kpt #: 143 total cpu time spent up to now is 922.3 secs Computing kpt #: 144 total cpu time spent up to now is 928.5 secs Computing kpt #: 145 total cpu time spent up to now is 934.6 secs Computing kpt #: 146 total cpu time spent up to now is 940.7 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 952.9 secs Computing kpt #: 149 total cpu time spent up to now is 959.0 secs Computing kpt #: 150 total cpu time spent up to now is 965.1 secs Computing kpt #: 151 total cpu time spent up to now is 971.1 secs Computing kpt #: 152 total cpu time spent up to now is 977.2 secs Computing kpt #: 153 total cpu time spent up to now is 983.3 secs Computing kpt #: 154 total cpu time spent up to now is 989.5 secs Computing kpt #: 155 total cpu time spent up to now is 995.7 secs Computing kpt #: 156 total cpu time spent up to now is 1001.7 secs Computing kpt #: 157 total cpu time spent up to now is 1007.8 secs Computing kpt #: 158 total cpu time spent up to now is 1013.9 secs Computing kpt #: 159 total cpu time spent up to now is 1020.0 secs Computing kpt #: 160 total cpu time spent up to now is 1026.1 secs Computing kpt #: 161 total cpu time spent up to now is 1032.1 secs Computing kpt #: 162 total cpu time spent up to now is 1038.2 secs Computing kpt #: 163 total cpu time spent up to now is 1044.3 secs Computing kpt #: 164 total cpu time spent up to now is 1050.3 secs Computing kpt #: 165 total cpu time spent up to now is 1056.4 secs Computing kpt #: 166 total cpu time spent up to now is 1062.0 secs Computing kpt #: 167 total cpu time spent up to now is 1067.5 secs Computing kpt #: 168 total cpu time spent up to now is 1073.1 secs Computing kpt #: 169 total cpu time spent up to now is 1080.8 secs Computing kpt #: 170 total cpu time spent up to now is 1086.3 secs Computing kpt #: 171 total cpu time spent up to now is 1092.0 secs Computing kpt #: 172 total cpu time spent up to now is 1097.4 secs Computing kpt #: 173 total cpu time spent up to now is 1102.7 secs Computing kpt #: 174 total cpu time spent up to now is 1109.7 secs Computing kpt #: 175 total cpu time spent up to now is 1115.9 secs Computing kpt #: 176 total cpu time spent up to now is 1122.1 secs Computing kpt #: 177 total cpu time spent up to now is 1128.2 secs Computing kpt #: 178 total cpu time spent up to now is 1135.9 secs Computing kpt #: 179 total cpu time spent up to now is 1142.0 secs Computing kpt #: 180 total cpu time spent up to now is 1149.5 secs Computing kpt #: 181 total cpu time spent up to now is 1155.7 secs Computing kpt #: 182 total cpu time spent up to now is 1161.8 secs Computing kpt #: 183 total cpu time spent up to now is 1168.0 secs Computing kpt #: 184 total cpu time spent up to now is 1174.1 secs Computing kpt #: 185 total cpu time spent up to now is 1180.3 secs Computing kpt #: 186 total cpu time spent up to now is 1186.4 secs Computing kpt #: 187 total cpu time spent up to now is 1192.7 secs Computing kpt #: 188 total cpu time spent up to now is 1199.0 secs Computing kpt #: 189 total cpu time spent up to now is 1205.3 secs Computing kpt #: 190 total cpu time spent up to now is 1212.2 secs Computing kpt #: 191 total cpu time spent up to now is 1218.7 secs Computing kpt #: 192 total cpu time spent up to now is 1225.3 secs Computing kpt #: 193 total cpu time spent up to now is 1231.9 secs Computing kpt #: 194 total cpu time spent up to now is 1238.4 secs ethr = 1.32E-11, avg # of iterations = 21.5 total cpu time spent up to now is 1238.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3174 -6.3174 -5.8296 -5.8296 -5.7499 -5.7499 -5.7499 -5.7499 -5.5175 -5.5175 -5.5175 -5.5175 -5.4509 -5.4509 -5.2381 -5.2381 -5.2381 -5.2381 -5.2377 -5.2377 -3.3748 -3.3748 -3.3748 -3.3748 -3.3034 -3.3034 -3.2779 -3.2779 -3.2779 -3.2779 -3.2567 -3.2567 -3.2338 -3.2338 -3.2338 -3.2338 -3.1999 -3.1999 1.2496 1.2496 1.4796 1.4796 1.4796 1.4796 3.3389 3.3389 3.4012 3.4012 3.4696 3.4696 3.4696 3.4696 3.7281 3.7281 3.7281 3.7281 3.8060 3.8060 4.0753 4.0753 4.2609 4.2609 4.2609 4.2609 5.1792 5.1792 5.1792 5.1792 8.3814 8.3814 8.4857 8.4857 8.4857 8.4857 8.8447 8.8447 8.8447 8.8447 9.7594 9.7594 9.7594 9.7594 10.3510 10.3510 k = 0.0125-0.0088 0.0153 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3168 -6.3168 -5.8295 -5.8295 -5.7546 -5.7546 -5.7451 -5.7451 -5.5175 -5.5175 -5.5174 -5.5174 -5.4509 -5.4509 -5.2457 -5.2457 -5.2380 -5.2380 -5.2308 -5.2308 -3.3749 -3.3749 -3.3746 -3.3746 -3.3034 -3.3034 -3.2793 -3.2793 -3.2769 -3.2769 -3.2568 -3.2568 -3.2355 -3.2355 -3.2319 -3.2319 -3.1999 -3.1999 1.2474 1.2474 1.4751 1.4751 1.4806 1.4806 3.3350 3.3350 3.4002 3.4002 3.4651 3.4651 3.4714 3.4714 3.7317 3.7317 3.7366 3.7366 3.8106 3.8106 4.0765 4.0765 4.2588 4.2588 4.2644 4.2644 5.1739 5.1739 5.1855 5.1855 8.3818 8.3818 8.4755 8.4755 8.4966 8.4966 8.8371 8.8371 8.8514 8.8514 9.7369 9.7369 9.7775 9.7775 10.3470 10.3470 k = 0.0250-0.0177 0.0306 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3151 -6.3151 -5.8292 -5.8292 -5.7592 -5.7592 -5.7403 -5.7403 -5.5174 -5.5174 -5.5173 -5.5173 -5.4510 -5.4510 -5.2538 -5.2538 -5.2386 -5.2386 -5.2241 -5.2241 -3.3749 -3.3749 -3.3743 -3.3743 -3.3034 -3.3034 -3.2809 -3.2809 -3.2761 -3.2761 -3.2570 -3.2570 -3.2372 -3.2372 -3.2301 -3.2301 -3.2001 -3.2001 1.2409 1.2409 1.4626 1.4626 1.4832 1.4832 3.3248 3.3248 3.3952 3.3952 3.4534 3.4534 3.4773 3.4773 3.7469 3.7469 3.7560 3.7560 3.8241 3.8241 4.0800 4.0800 4.2579 4.2579 4.2694 4.2694 5.1697 5.1697 5.1929 5.1929 8.3825 8.3825 8.4667 8.4667 8.5074 8.5074 8.8285 8.8285 8.8572 8.8572 9.7086 9.7086 9.7922 9.7922 10.3352 10.3352 k = 0.0375-0.0265 0.0459 ( 8411 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.3122 -6.3122 -5.8287 -5.8287 -5.7637 -5.7637 -5.7354 -5.7354 -5.5174 -5.5174 -5.5171 -5.5171 -5.4511 -5.4511 -5.2623 -5.2623 -5.2397 -5.2397 -5.2178 -5.2178 -3.3750 -3.3750 -3.3738 -3.3738 -3.3035 -3.3035 -3.2828 -3.2828 -3.2755 -3.2755 -3.2573 -3.2573 -3.2387 -3.2387 -3.2283 -3.2283 -3.2003 -3.2003 1.2298 1.2298 1.4423 1.4423 1.4876 1.4876 3.3105 3.3105 3.3842 3.3842 3.4366 3.4366 3.4888 3.4888 3.7716 3.7716 3.7848 3.7848 3.8456 3.8456 4.0859 4.0859 4.2583 4.2583 4.2760 4.2760 5.1667 5.1667 5.2012 5.2012 8.3828 8.3828 8.4604 8.4604 8.5176 8.5176 8.8195 8.8195 8.8621 8.8621 9.6738 9.6738 9.8040 9.8040 10.3173 10.3173 k = 0.0500-0.0354 0.0612 ( 8399 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3083 -6.3083 -5.8280 -5.8280 -5.7680 -5.7680 -5.7305 -5.7305 -5.5173 -5.5173 -5.5169 -5.5169 -5.4513 -5.4513 -5.2711 -5.2711 -5.2411 -5.2411 -5.2121 -5.2121 -3.3750 -3.3750 -3.3731 -3.3731 -3.3035 -3.3035 -3.2850 -3.2850 -3.2752 -3.2752 -3.2578 -3.2578 -3.2401 -3.2401 -3.2266 -3.2266 -3.2005 -3.2005 1.2144 1.2144 1.4149 1.4149 1.4941 1.4941 3.2935 3.2935 3.3679 3.3679 3.4169 3.4169 3.5049 3.5049 3.8025 3.8025 3.8222 3.8222 3.8743 3.8743 4.0943 4.0943 4.2600 4.2600 4.2844 4.2844 5.1648 5.1648 5.2106 5.2106 8.3813 8.3813 8.4578 8.4578 8.5266 8.5266 8.8107 8.8107 8.8662 8.8662 9.6326 9.6326 9.8122 9.8122 10.2954 10.2954 k = 0.0625-0.0442 0.0765 ( 8396 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3032 -6.3032 -5.8272 -5.8272 -5.7722 -5.7722 -5.7256 -5.7256 -5.5172 -5.5172 -5.5166 -5.5166 -5.4515 -5.4515 -5.2802 -5.2802 -5.2430 -5.2430 -5.2069 -5.2069 -3.3751 -3.3751 -3.3723 -3.3723 -3.3035 -3.3035 -3.2875 -3.2875 -3.2751 -3.2751 -3.2583 -3.2583 -3.2414 -3.2414 -3.2251 -3.2251 -3.2007 -3.2007 1.1947 1.1947 1.3811 1.3811 1.5029 1.5029 3.2746 3.2746 3.3482 3.3483 3.3959 3.3959 3.5242 3.5242 3.8366 3.8366 3.8674 3.8674 3.9094 3.9094 4.1052 4.1052 4.2629 4.2629 4.2948 4.2948 5.1642 5.1642 5.2210 5.2210 8.3769 8.3769 8.4597 8.4597 8.5336 8.5336 8.8032 8.8032 8.8694 8.8694 9.5854 9.5854 9.8148 9.8148 10.2732 10.2732 k = 0.0750-0.0530 0.0919 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2970 -6.2970 -5.8262 -5.8262 -5.7763 -5.7763 -5.7207 -5.7207 -5.5170 -5.5170 -5.5162 -5.5162 -5.4518 -5.4518 -5.2896 -5.2896 -5.2453 -5.2453 -5.2023 -5.2023 -3.3752 -3.3752 -3.3712 -3.3712 -3.3036 -3.3036 -3.2901 -3.2901 -3.2751 -3.2751 -3.2591 -3.2591 -3.2426 -3.2426 -3.2238 -3.2238 -3.2009 -3.2009 1.1709 1.1709 1.3418 1.3418 1.5141 1.5141 3.2540 3.2540 3.3268 3.3268 3.3748 3.3748 3.5455 3.5455 3.8720 3.8720 3.9181 3.9181 3.9512 3.9512 4.1189 4.1189 4.2673 4.2673 4.3077 4.3077 5.1650 5.1650 5.2326 5.2326 8.3696 8.3696 8.4657 8.4657 8.5382 8.5382 8.7981 8.7981 8.8715 8.8715 9.5336 9.5336 9.8088 9.8088 10.2546 10.2546 k = 0.0875-0.0619 0.1072 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2898 -6.2898 -5.8250 -5.8250 -5.7801 -5.7801 -5.7159 -5.7159 -5.5168 -5.5168 -5.5157 -5.5157 -5.4522 -5.4522 -5.2992 -5.2992 -5.2479 -5.2479 -5.1983 -5.1983 -3.3752 -3.3752 -3.3700 -3.3700 -3.3038 -3.3038 -3.2928 -3.2928 -3.2753 -3.2753 -3.2599 -3.2599 -3.2438 -3.2438 -3.2228 -3.2228 -3.2010 -3.2010 1.1434 1.1434 1.2980 1.2981 1.5278 1.5278 3.2317 3.2317 3.3050 3.3050 3.3541 3.3541 3.5678 3.5678 3.9077 3.9077 3.9698 3.9698 4.0016 4.0016 4.1356 4.1356 4.2732 4.2732 4.3234 4.3234 5.1673 5.1673 5.2453 5.2453 8.3600 8.3600 8.4738 8.4738 8.5408 8.5408 8.7964 8.7964 8.8719 8.8719 9.4787 9.4787 9.7914 9.7914 10.2437 10.2437 k = 0.1000-0.0707 0.1225 ( 8416 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.2816 -6.2816 -5.8237 -5.8237 -5.7837 -5.7837 -5.7111 -5.7111 -5.5166 -5.5166 -5.5152 -5.5152 -5.4527 -5.4527 -5.3088 -5.3088 -5.2509 -5.2509 -5.1949 -5.1949 -3.3754 -3.3754 -3.3687 -3.3687 -3.3043 -3.3043 -3.2954 -3.2954 -3.2755 -3.2755 -3.2609 -3.2609 -3.2450 -3.2450 -3.2220 -3.2220 -3.2010 -3.2010 1.1126 1.1126 1.2506 1.2506 1.5439 1.5439 3.2074 3.2074 3.2838 3.2838 3.3343 3.3343 3.5903 3.5903 3.9426 3.9426 4.0187 4.0187 4.0615 4.0615 4.1559 4.1559 4.2813 4.2813 4.3427 4.3427 5.1711 5.1711 5.2592 5.2592 8.3489 8.3489 8.4806 8.4806 8.5434 8.5434 8.7981 8.7981 8.8701 8.8701 9.4227 9.4227 9.7610 9.7610 10.2428 10.2428 k = 0.1125-0.0795 0.1378 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2724 -6.2724 -5.8222 -5.8222 -5.7871 -5.7871 -5.7065 -5.7065 -5.5163 -5.5163 -5.5147 -5.5147 -5.4533 -5.4533 -5.3186 -5.3186 -5.2542 -5.2542 -5.1920 -5.1920 -3.3755 -3.3755 -3.3672 -3.3672 -3.3051 -3.3051 -3.2977 -3.2977 -3.2758 -3.2758 -3.2620 -3.2620 -3.2463 -3.2463 -3.2215 -3.2215 -3.2008 -3.2008 1.0789 1.0789 1.2004 1.2004 1.5623 1.5623 3.1809 3.1809 3.2642 3.2642 3.3157 3.3157 3.6123 3.6123 3.9760 3.9760 4.0652 4.0652 4.1256 4.1257 4.1819 4.1819 4.2922 4.2922 4.3662 4.3662 5.1765 5.1765 5.2745 5.2745 8.3369 8.3369 8.4817 8.4817 8.5500 8.5500 8.8021 8.8021 8.8661 8.8661 9.3680 9.3680 9.7183 9.7183 10.2518 10.2518 k = 0.1250-0.0884 0.1531 ( 8396 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2624 -6.2624 -5.8206 -5.8206 -5.7902 -5.7902 -5.7020 -5.7020 -5.5160 -5.5160 -5.5141 -5.5141 -5.4540 -5.4540 -5.3283 -5.3283 -5.2579 -5.2579 -5.1898 -5.1898 -3.3757 -3.3757 -3.3656 -3.3656 -3.3067 -3.3067 -3.2993 -3.2993 -3.2761 -3.2761 -3.2633 -3.2633 -3.2476 -3.2476 -3.2212 -3.2212 -3.2005 -3.2005 1.0428 1.0428 1.1481 1.1481 1.5829 1.5829 3.1525 3.1525 3.2467 3.2467 3.2983 3.2983 3.6331 3.6331 4.0074 4.0074 4.1095 4.1095 4.1792 4.1792 4.2244 4.2244 4.3077 4.3077 4.3949 4.3949 5.1836 5.1836 5.2912 5.2912 8.3243 8.3243 8.4751 8.4751 8.5627 8.5627 8.8042 8.8042 8.8615 8.8615 9.3174 9.3174 9.6657 9.6657 10.2686 10.2686 k = 0.1375-0.0972 0.1684 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2514 -6.2514 -5.8190 -5.8190 -5.7930 -5.7930 -5.6977 -5.6977 -5.5156 -5.5156 -5.5134 -5.5134 -5.4548 -5.4548 -5.3380 -5.3380 -5.2618 -5.2618 -5.1882 -5.1882 -3.3759 -3.3759 -3.3638 -3.3638 -3.3090 -3.3090 -3.3002 -3.3002 -3.2763 -3.2763 -3.2646 -3.2646 -3.2491 -3.2491 -3.2212 -3.2212 -3.2001 -3.2001 1.0046 1.0046 1.0944 1.0944 1.6057 1.6057 3.1225 3.1225 3.2314 3.2314 3.2823 3.2823 3.6521 3.6521 4.0365 4.0365 4.1500 4.1500 4.2126 4.2126 4.2882 4.2882 4.3316 4.3316 4.4299 4.4299 5.1923 5.1923 5.3092 5.3092 8.3114 8.3114 8.4628 8.4628 8.5797 8.5797 8.7960 8.7960 8.8623 8.8623 9.2736 9.2736 9.6061 9.6061 10.2904 10.2904 k = 0.1500-0.1061 0.1837 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2397 -6.2397 -5.8173 -5.8173 -5.7954 -5.7954 -5.6936 -5.6936 -5.5151 -5.5151 -5.5127 -5.5127 -5.4558 -5.4558 -5.3475 -5.3475 -5.2660 -5.2660 -5.1872 -5.1872 -3.3762 -3.3762 -3.3620 -3.3620 -3.3118 -3.3118 -3.3007 -3.3007 -3.2766 -3.2766 -3.2661 -3.2661 -3.2508 -3.2508 -3.2212 -3.2212 -3.1997 -3.1997 0.9648 0.9648 1.0399 1.0399 1.6304 1.6304 3.0915 3.0915 3.2183 3.2183 3.2677 3.2677 3.6684 3.6684 4.0636 4.0636 4.1851 4.1851 4.2390 4.2390 4.3454 4.3454 4.3774 4.3774 4.4725 4.4725 5.2028 5.2028 5.3287 5.3287 8.2985 8.2985 8.4473 8.4473 8.5982 8.5982 8.7726 8.7726 8.8712 8.8712 9.2390 9.2390 9.5425 9.5425 10.3138 10.3138 k = 0.1625-0.1149 0.1990 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2273 -6.2273 -5.8158 -5.8158 -5.7973 -5.7973 -5.6899 -5.6899 -5.5146 -5.5146 -5.5120 -5.5120 -5.4569 -5.4569 -5.3567 -5.3567 -5.2704 -5.2704 -5.1868 -5.1868 -3.3765 -3.3765 -3.3601 -3.3601 -3.3147 -3.3147 -3.3009 -3.3009 -3.2768 -3.2768 -3.2678 -3.2678 -3.2527 -3.2527 -3.2213 -3.2213 -3.1993 -3.1993 0.9237 0.9237 0.9851 0.9851 1.6568 1.6568 3.0602 3.0602 3.2073 3.2073 3.2545 3.2545 3.6817 3.6817 4.0890 4.0890 4.2142 4.2142 4.2623 4.2623 4.3899 4.3899 4.4448 4.4448 4.5241 4.5241 5.2149 5.2149 5.3495 5.3495 8.2858 8.2858 8.4302 8.4302 8.6146 8.6146 8.7386 8.7386 8.8845 8.8845 9.2148 9.2148 9.4774 9.4774 10.3348 10.3348 k = 0.1750-0.1237 0.2143 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2142 -6.2142 -5.8145 -5.8145 -5.7986 -5.7986 -5.6865 -5.6865 -5.5140 -5.5140 -5.5112 -5.5112 -5.4583 -5.4583 -5.3656 -5.3656 -5.2751 -5.2751 -5.1870 -5.1870 -3.3769 -3.3769 -3.3582 -3.3582 -3.3176 -3.3176 -3.3011 -3.3011 -3.2770 -3.2770 -3.2695 -3.2695 -3.2546 -3.2546 -3.2214 -3.2214 -3.1989 -3.1989 0.8817 0.8817 0.9304 0.9304 1.6848 1.6848 3.0292 3.0292 3.1982 3.1982 3.2427 3.2427 3.6913 3.6913 4.1131 4.1131 4.2379 4.2379 4.2840 4.2840 4.4384 4.4384 4.5122 4.5122 4.5858 4.5858 5.2286 5.2286 5.3714 5.3714 8.2734 8.2734 8.4126 8.4126 8.6194 8.6194 8.7057 8.7057 8.8984 8.8984 9.2007 9.2007 9.4133 9.4133 10.3471 10.3471 k = 0.1875-0.1326 0.2296 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2006 -6.2006 -5.8135 -5.8135 -5.7991 -5.7991 -5.6835 -5.6835 -5.5133 -5.5133 -5.5104 -5.5104 -5.4598 -5.4598 -5.3740 -5.3740 -5.2799 -5.2799 -5.1878 -5.1878 -3.3773 -3.3773 -3.3562 -3.3562 -3.3204 -3.3204 -3.3011 -3.3011 -3.2772 -3.2772 -3.2714 -3.2714 -3.2567 -3.2567 -3.2215 -3.2215 -3.1986 -3.1986 0.8391 0.8391 0.8762 0.8762 1.7141 1.7141 2.9991 2.9991 3.1909 3.1909 3.2324 3.2324 3.6969 3.6969 4.1363 4.1363 4.2575 4.2575 4.3054 4.3054 4.4919 4.4919 4.5760 4.5760 4.6561 4.6561 5.2440 5.2440 5.3942 5.3942 8.2613 8.2613 8.3949 8.3949 8.5935 8.5935 8.6957 8.6957 8.9102 8.9102 9.1953 9.1953 9.3533 9.3533 10.3404 10.3404 k = 0.2000-0.1414 0.2449 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1864 -6.1864 -5.8131 -5.8131 -5.7986 -5.7986 -5.6810 -5.6810 -5.5125 -5.5125 -5.5096 -5.5096 -5.4615 -5.4615 -5.3820 -5.3820 -5.2848 -5.2848 -5.1892 -5.1892 -3.3779 -3.3779 -3.3542 -3.3542 -3.3231 -3.3231 -3.3012 -3.3012 -3.2774 -3.2774 -3.2733 -3.2733 -3.2588 -3.2588 -3.2216 -3.2216 -3.1984 -3.1984 0.7961 0.7961 0.8228 0.8228 1.7443 1.7443 2.9707 2.9707 3.1854 3.1854 3.2234 3.2234 3.6982 3.6982 4.1589 4.1589 4.2743 4.2743 4.3274 4.3274 4.5490 4.5490 4.6382 4.6382 4.7307 4.7307 5.2609 5.2609 5.4176 5.4176 8.2494 8.2494 8.3765 8.3765 8.5444 8.5444 8.7033 8.7033 8.9173 8.9173 9.1970 9.1970 9.3009 9.3009 10.3042 10.3042 k = 0.2125-0.1503 0.2603 ( 8360 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.1719 -6.1719 -5.8131 -5.8131 -5.7973 -5.7973 -5.6790 -5.6790 -5.5117 -5.5117 -5.5086 -5.5086 -5.4635 -5.4635 -5.3893 -5.3893 -5.2898 -5.2898 -5.1912 -5.1912 -3.3785 -3.3785 -3.3522 -3.3522 -3.3256 -3.3256 -3.3013 -3.3013 -3.2777 -3.2777 -3.2753 -3.2753 -3.2608 -3.2608 -3.2217 -3.2217 -3.1983 -3.1983 0.7530 0.7530 0.7705 0.7705 1.7752 1.7752 2.9444 2.9444 3.1815 3.1815 3.2157 3.2157 3.6952 3.6952 4.1810 4.1810 4.2893 4.2893 4.3501 4.3501 4.6085 4.6085 4.7005 4.7005 4.8060 4.8060 5.2794 5.2794 5.4411 5.4411 8.2372 8.2372 8.3558 8.3558 8.4914 8.4914 8.7122 8.7122 8.9176 8.9176 9.2038 9.2038 9.2606 9.2606 10.2389 10.2389 k = 0.2250-0.1591 0.2756 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1572 -6.1572 -5.8132 -5.8132 -5.7954 -5.7954 -5.6777 -5.6777 -5.5107 -5.5107 -5.5076 -5.5076 -5.4655 -5.4655 -5.3960 -5.3960 -5.2949 -5.2949 -5.1938 -5.1938 -3.3793 -3.3793 -3.3502 -3.3502 -3.3279 -3.3279 -3.3014 -3.3014 -3.2786 -3.2786 -3.2767 -3.2767 -3.2627 -3.2627 -3.2218 -3.2218 -3.1983 -3.1983 0.7098 0.7098 0.7197 0.7197 1.8064 1.8064 2.9209 2.9209 3.1790 3.1790 3.2093 3.2093 3.6879 3.6879 4.2028 4.2028 4.3034 4.3034 4.3736 4.3736 4.6694 4.6694 4.7634 4.7634 4.8801 4.8801 5.2996 5.2996 5.4642 5.4642 8.2232 8.2232 8.3292 8.3292 8.4460 8.4460 8.7153 8.7153 8.9106 8.9106 9.2113 9.2113 9.2388 9.2388 10.1549 10.1549 k = 0.2375-0.1679 0.2909 ( 8372 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1422 -6.1422 -5.8134 -5.8134 -5.7931 -5.7931 -5.6770 -5.6770 -5.5097 -5.5097 -5.5064 -5.5064 -5.4677 -5.4677 -5.4021 -5.4021 -5.3000 -5.3000 -5.1969 -5.1969 -3.3801 -3.3801 -3.3483 -3.3483 -3.3299 -3.3299 -3.3016 -3.3016 -3.2805 -3.2805 -3.2774 -3.2774 -3.2643 -3.2643 -3.2219 -3.2219 -3.1984 -3.1984 0.6663 0.6663 0.6710 0.6711 1.8375 1.8375 2.9008 2.9008 3.1780 3.1780 3.2041 3.2041 3.6767 3.6767 4.2243 4.2243 4.3174 4.3174 4.3977 4.3977 4.7312 4.7312 4.8268 4.8268 4.9515 4.9515 5.3216 5.3216 5.4864 5.4864 8.2034 8.2034 8.2958 8.2958 8.4158 8.4158 8.7077 8.7077 8.8994 8.8994 9.2119 9.2119 9.2425 9.2425 10.0612 10.0612 k = 0.2500-0.1768 0.3062 ( 8356 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.1272 -6.1272 -5.8133 -5.8133 -5.7906 -5.7906 -5.6770 -5.6769 -5.5088 -5.5088 -5.5050 -5.5050 -5.4699 -5.4699 -5.4075 -5.4075 -5.3050 -5.3050 -5.2006 -5.2006 -3.3811 -3.3811 -3.3465 -3.3465 -3.3316 -3.3316 -3.3019 -3.3019 -3.2827 -3.2827 -3.2779 -3.2779 -3.2655 -3.2655 -3.2221 -3.2221 -3.1987 -3.1987 0.6207 0.6207 0.6267 0.6267 1.8680 1.8680 2.8848 2.8848 3.1782 3.1782 3.2002 3.2002 3.6617 3.6617 4.2455 4.2455 4.3314 4.3314 4.4223 4.4223 4.7933 4.7933 4.8903 4.8903 5.0192 5.0192 5.3456 5.3456 5.5073 5.5073 8.1699 8.1699 8.2657 8.2657 8.3999 8.3999 8.6864 8.6864 8.8892 8.8892 9.2152 9.2152 9.2584 9.2584 9.9641 9.9641 k = 0.2625-0.1856 0.3215 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.1123 -6.1123 -5.8129 -5.8129 -5.7879 -5.7879 -5.6777 -5.6777 -5.5078 -5.5078 -5.5034 -5.5034 -5.4721 -5.4721 -5.4122 -5.4122 -5.3100 -5.3100 -5.2049 -5.2049 -3.3822 -3.3822 -3.3448 -3.3448 -3.3330 -3.3330 -3.3023 -3.3023 -3.2850 -3.2850 -3.2786 -3.2786 -3.2663 -3.2663 -3.2223 -3.2223 -3.1990 -3.1990 0.5750 0.5750 0.5849 0.5849 1.8974 1.8974 2.8733 2.8733 3.1793 3.1793 3.1974 3.1974 3.6434 3.6434 4.2661 4.2661 4.3458 4.3458 4.4470 4.4470 4.8552 4.8552 4.9533 4.9533 5.0825 5.0825 5.3717 5.3717 5.5264 5.5264 8.1207 8.1207 8.2468 8.2468 8.3932 8.3932 8.6523 8.6523 8.8829 8.8829 9.2254 9.2254 9.2773 9.2773 9.8677 9.8677 k = 0.2750-0.1945 0.3368 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0975 -6.0975 -5.8123 -5.8123 -5.7853 -5.7853 -5.6791 -5.6791 -5.5070 -5.5070 -5.5015 -5.5015 -5.4740 -5.4740 -5.4164 -5.4164 -5.3149 -5.3149 -5.2096 -5.2096 -3.3834 -3.3834 -3.3432 -3.3432 -3.3341 -3.3341 -3.3031 -3.3031 -3.2870 -3.2870 -3.2795 -3.2795 -3.2665 -3.2665 -3.2225 -3.2225 -3.1995 -3.1995 0.5309 0.5309 0.5443 0.5443 1.9252 1.9252 2.8670 2.8670 3.1812 3.1812 3.1960 3.1960 3.6223 3.6223 4.2861 4.2861 4.3608 4.3608 4.4715 4.4715 4.9165 4.9165 5.0152 5.0152 5.1412 5.1412 5.3999 5.3999 5.5434 5.5434 8.0633 8.0633 8.2353 8.2353 8.3923 8.3923 8.6099 8.6099 8.8794 8.8794 9.2405 9.2405 9.2967 9.2967 9.7750 9.7750 k = 0.2875-0.2033 0.3521 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0830 -6.0830 -5.8112 -5.8112 -5.7826 -5.7826 -5.6811 -5.6811 -5.5062 -5.5062 -5.4994 -5.4994 -5.4756 -5.4756 -5.4200 -5.4200 -5.3196 -5.3196 -5.2149 -5.2149 -3.3848 -3.3848 -3.3419 -3.3419 -3.3348 -3.3348 -3.3042 -3.3042 -3.2888 -3.2888 -3.2806 -3.2806 -3.2664 -3.2664 -3.2228 -3.2228 -3.2000 -3.2000 0.4888 0.4888 0.5048 0.5048 1.9510 1.9510 2.8662 2.8662 3.1834 3.1834 3.1961 3.1961 3.5988 3.5988 4.3052 4.3052 4.3766 4.3766 4.4957 4.4957 4.9767 4.9767 5.0751 5.0751 5.1954 5.1954 5.4300 5.4300 5.5580 5.5580 8.0038 8.0038 8.2269 8.2269 8.3948 8.3948 8.5643 8.5643 8.8766 8.8766 9.2581 9.2581 9.3154 9.3154 9.6889 9.6889 k = 0.3000-0.2121 0.3674 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0689 -6.0689 -5.8097 -5.8097 -5.7800 -5.7800 -5.6838 -5.6838 -5.5055 -5.5055 -5.4973 -5.4973 -5.4768 -5.4768 -5.4231 -5.4231 -5.3242 -5.3242 -5.2206 -5.2206 -3.3862 -3.3862 -3.3407 -3.3407 -3.3352 -3.3352 -3.3056 -3.3056 -3.2902 -3.2902 -3.2818 -3.2818 -3.2659 -3.2659 -3.2231 -3.2231 -3.2006 -3.2006 0.4488 0.4488 0.4666 0.4666 1.9743 1.9743 2.8713 2.8713 3.1852 3.1852 3.1981 3.1981 3.5735 3.5735 4.3232 4.3232 4.3931 4.3931 4.5189 4.5189 5.0354 5.0354 5.1318 5.1318 5.2459 5.2459 5.4615 5.4615 5.5701 5.5701 7.9452 7.9452 8.2192 8.2192 8.3979 8.3979 8.5205 8.5205 8.8726 8.8726 9.2763 9.2763 9.3322 9.3322 9.6118 9.6118 k = 0.3125-0.2210 0.3827 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0553 -6.0553 -5.8078 -5.8078 -5.7775 -5.7775 -5.6871 -5.6871 -5.5048 -5.5048 -5.4954 -5.4954 -5.4772 -5.4772 -5.4257 -5.4257 -5.3285 -5.3285 -5.2269 -5.2269 -3.3876 -3.3876 -3.3399 -3.3399 -3.3351 -3.3351 -3.3074 -3.3074 -3.2912 -3.2912 -3.2830 -3.2830 -3.2651 -3.2651 -3.2235 -3.2235 -3.2013 -3.2013 0.4110 0.4110 0.4297 0.4297 1.9949 1.9949 2.8824 2.8824 3.1866 3.1866 3.2019 3.2019 3.5469 3.5469 4.3399 4.3399 4.4105 4.4105 4.5409 4.5409 5.0921 5.0921 5.1842 5.1842 5.2941 5.2941 5.4933 5.4933 5.5799 5.5799 7.8889 7.8889 8.2110 8.2110 8.3949 8.3949 8.4870 8.4870 8.8659 8.8659 9.2931 9.2931 9.3462 9.3462 9.5462 9.5462 k = 0.3250-0.2298 0.3980 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0424 -6.0424 -5.8055 -5.8055 -5.7752 -5.7752 -5.6907 -5.6907 -5.5042 -5.5042 -5.4938 -5.4938 -5.4768 -5.4768 -5.4277 -5.4277 -5.3327 -5.3326 -5.2335 -5.2335 -3.3891 -3.3891 -3.3392 -3.3392 -3.3348 -3.3348 -3.3095 -3.3095 -3.2919 -3.2919 -3.2843 -3.2843 -3.2641 -3.2641 -3.2240 -3.2240 -3.2020 -3.2020 0.3753 0.3753 0.3944 0.3944 2.0126 2.0126 2.8994 2.8995 3.1879 3.1879 3.2070 3.2070 3.5195 3.5195 4.3553 4.3553 4.4285 4.4285 4.5611 4.5611 5.1463 5.1463 5.2312 5.2312 5.3414 5.3414 5.5243 5.5243 5.5880 5.5880 7.8359 7.8359 8.2013 8.2013 8.3751 8.3751 8.4752 8.4752 8.8557 8.8557 9.3063 9.3063 9.3565 9.3565 9.4947 9.4947 k = 0.3375-0.2386 0.4134 ( 8408 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0301 -6.0301 -5.8028 -5.8028 -5.7732 -5.7732 -5.6946 -5.6946 -5.5036 -5.5036 -5.4929 -5.4929 -5.4753 -5.4753 -5.4291 -5.4291 -5.3365 -5.3365 -5.2406 -5.2406 -3.3907 -3.3907 -3.3388 -3.3388 -3.3342 -3.3342 -3.3118 -3.3118 -3.2924 -3.2924 -3.2855 -3.2855 -3.2630 -3.2630 -3.2246 -3.2246 -3.2027 -3.2027 0.3420 0.3420 0.3607 0.3607 2.0275 2.0275 2.9221 2.9221 3.1891 3.1891 3.2129 3.2129 3.4917 3.4917 4.3692 4.3692 4.4469 4.4469 4.5791 4.5791 5.1974 5.1974 5.2728 5.2728 5.3885 5.3885 5.5524 5.5524 5.5954 5.5954 7.7868 7.7868 8.1897 8.1897 8.3417 8.3417 8.4825 8.4825 8.8419 8.8419 9.3129 9.3129 9.3631 9.3631 9.4591 9.4591 k = 0.3500-0.2475 0.4287 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0186 -6.0186 -5.7998 -5.7998 -5.7714 -5.7714 -5.6987 -5.6987 -5.5031 -5.5031 -5.4927 -5.4927 -5.4728 -5.4728 -5.4299 -5.4299 -5.3401 -5.3401 -5.2481 -5.2481 -3.3922 -3.3922 -3.3384 -3.3384 -3.3334 -3.3334 -3.3140 -3.3140 -3.2928 -3.2928 -3.2867 -3.2867 -3.2617 -3.2617 -3.2252 -3.2252 -3.2035 -3.2035 0.3111 0.3111 0.3288 0.3288 2.0398 2.0398 2.9497 2.9497 3.1904 3.1904 3.2193 3.2193 3.4641 3.4641 4.3818 4.3818 4.4654 4.4654 4.5945 4.5945 5.2448 5.2448 5.3095 5.3095 5.4352 5.4352 5.5735 5.5735 5.6061 5.6061 7.7421 7.7421 8.1756 8.1756 8.3053 8.3053 8.4983 8.4983 8.8248 8.8248 9.3109 9.3109 9.3676 9.3676 9.4383 9.4383 k = 0.3625-0.2563 0.4440 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0080 -6.0080 -5.7965 -5.7965 -5.7700 -5.7700 -5.7028 -5.7028 -5.5026 -5.5026 -5.4929 -5.4929 -5.4698 -5.4698 -5.4298 -5.4298 -5.3435 -5.3435 -5.2560 -5.2560 -3.3937 -3.3937 -3.3379 -3.3379 -3.3327 -3.3327 -3.3163 -3.3163 -3.2931 -3.2931 -3.2879 -3.2879 -3.2602 -3.2602 -3.2259 -3.2259 -3.2042 -3.2042 0.2825 0.2825 0.2988 0.2988 2.0497 2.0497 2.9817 2.9817 3.1918 3.1918 3.2260 3.2260 3.4371 3.4371 4.3929 4.3929 4.4836 4.4836 4.6069 4.6069 5.2878 5.2878 5.3427 5.3427 5.4807 5.4807 5.5836 5.5836 5.6240 5.6240 7.7020 7.7020 8.1592 8.1592 8.2702 8.2702 8.5180 8.5180 8.8056 8.8056 9.3024 9.3024 9.3713 9.3713 9.4266 9.4266 k = 0.3750-0.2652 0.4593 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9983 -5.9983 -5.7931 -5.7931 -5.7688 -5.7688 -5.7069 -5.7069 -5.5022 -5.5022 -5.4935 -5.4935 -5.4667 -5.4667 -5.4287 -5.4287 -5.3465 -5.3465 -5.2642 -5.2642 -3.3952 -3.3952 -3.3374 -3.3374 -3.3319 -3.3319 -3.3184 -3.3184 -3.2933 -3.2933 -3.2889 -3.2889 -3.2587 -3.2587 -3.2267 -3.2267 -3.2049 -3.2049 0.2563 0.2563 0.2710 0.2710 2.0576 2.0576 3.0170 3.0170 3.1931 3.1931 3.2327 3.2327 3.4111 3.4111 4.4026 4.4026 4.5014 4.5014 4.6161 4.6161 5.3260 5.3260 5.3737 5.3737 5.5239 5.5239 5.5870 5.5870 5.6448 5.6448 7.6666 7.6666 8.1409 8.1409 8.2378 8.2378 8.5396 8.5396 8.7857 8.7857 9.2920 9.2920 9.3731 9.3731 9.4180 9.4180 k = 0.3875-0.2740 0.4746 ( 8372 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9894 -5.9894 -5.7897 -5.7897 -5.7678 -5.7678 -5.7107 -5.7107 -5.5018 -5.5018 -5.4942 -5.4942 -5.4637 -5.4637 -5.4264 -5.4264 -5.3492 -5.3492 -5.2727 -5.2727 -3.3966 -3.3966 -3.3370 -3.3370 -3.3313 -3.3313 -3.3204 -3.3204 -3.2936 -3.2936 -3.2899 -3.2899 -3.2570 -3.2570 -3.2276 -3.2276 -3.2056 -3.2056 0.2325 0.2325 0.2453 0.2453 2.0638 2.0638 3.0547 3.0547 3.1943 3.1943 3.2394 3.2394 3.3866 3.3866 4.4106 4.4106 4.5183 4.5183 4.6222 4.6222 5.3592 5.3592 5.4033 5.4033 5.5641 5.5641 5.5877 5.5877 5.6648 5.6648 7.6359 7.6359 8.1217 8.1217 8.2083 8.2083 8.5619 8.5619 8.7666 8.7666 9.2823 9.2823 9.3723 9.3723 9.4090 9.4090 k = 0.4000-0.2828 0.4899 ( 8368 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9815 -5.9815 -5.7866 -5.7866 -5.7667 -5.7667 -5.7143 -5.7143 -5.5014 -5.5014 -5.4950 -5.4950 -5.4612 -5.4612 -5.4227 -5.4227 -5.3517 -5.3517 -5.2816 -5.2816 -3.3979 -3.3979 -3.3365 -3.3365 -3.3306 -3.3306 -3.3222 -3.3222 -3.2938 -3.2938 -3.2909 -3.2909 -3.2553 -3.2553 -3.2286 -3.2286 -3.2063 -3.2063 0.2112 0.2112 0.2220 0.2220 2.0686 2.0686 3.0936 3.0936 3.1952 3.1952 3.2458 3.2458 3.3640 3.3640 4.4169 4.4169 4.5342 4.5342 4.6252 4.6252 5.3880 5.3880 5.4311 5.4311 5.5870 5.5870 5.6007 5.6007 5.6828 5.6828 7.6099 7.6099 8.1026 8.1026 8.1816 8.1816 8.5841 8.5841 8.7492 8.7492 9.2736 9.2736 9.3685 9.3685 9.3983 9.3983 k = 0.4125-0.2917 0.5052 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9745 -5.9745 -5.7843 -5.7843 -5.7651 -5.7651 -5.7177 -5.7177 -5.5011 -5.5011 -5.4959 -5.4959 -5.4592 -5.4592 -5.4178 -5.4178 -5.3539 -5.3539 -5.2907 -5.2907 -3.3991 -3.3991 -3.3360 -3.3360 -3.3302 -3.3302 -3.3237 -3.3237 -3.2941 -3.2941 -3.2918 -3.2918 -3.2535 -3.2535 -3.2297 -3.2297 -3.2069 -3.2069 0.1924 0.1924 0.2011 0.2011 2.0724 2.0724 3.1324 3.1324 3.1958 3.1958 3.2518 3.2518 3.3438 3.3438 4.4212 4.4212 4.5488 4.5488 4.6257 4.6257 5.4132 5.4132 5.4566 5.4566 5.5854 5.5854 5.6332 5.6332 5.6986 5.6986 7.5883 7.5883 8.0850 8.0850 8.1573 8.1573 8.6054 8.6054 8.7342 8.7342 9.2658 9.2658 9.3621 9.3621 9.3859 9.3859 k = 0.4250-0.3005 0.5205 ( 8372 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9684 -5.9684 -5.7829 -5.7829 -5.7629 -5.7629 -5.7210 -5.7210 -5.5008 -5.5008 -5.4968 -5.4968 -5.4577 -5.4577 -5.4117 -5.4117 -5.3558 -5.3558 -5.2999 -5.2999 -3.4002 -3.4002 -3.3355 -3.3355 -3.3299 -3.3299 -3.3248 -3.3248 -3.2944 -3.2944 -3.2926 -3.2926 -3.2516 -3.2516 -3.2310 -3.2310 -3.2074 -3.2074 0.1761 0.1761 0.1828 0.1828 2.0753 2.0753 3.1696 3.1696 3.1962 3.1962 3.2573 3.2573 3.3263 3.3263 4.4236 4.4237 4.5620 4.5620 4.6242 4.6242 5.4360 5.4360 5.4791 5.4791 5.5829 5.5829 5.6614 5.6614 5.7121 5.7121 7.5707 7.5707 8.0697 8.0697 8.1352 8.1352 8.6253 8.6253 8.7218 8.7218 9.2586 9.2586 9.3536 9.3536 9.3724 9.3724 k = 0.4375-0.3094 0.5358 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9633 -5.9633 -5.7825 -5.7825 -5.7598 -5.7598 -5.7241 -5.7241 -5.5006 -5.5006 -5.4976 -5.4976 -5.4565 -5.4565 -5.4047 -5.4047 -5.3575 -5.3575 -5.3094 -5.3094 -3.4011 -3.4011 -3.3350 -3.3350 -3.3300 -3.3300 -3.3253 -3.3253 -3.2947 -3.2947 -3.2934 -3.2934 -3.2498 -3.2498 -3.2323 -3.2323 -3.2078 -3.2078 0.1623 0.1623 0.1671 0.1671 2.0776 2.0776 3.1928 3.1928 3.2072 3.2072 3.2622 3.2622 3.3120 3.3120 4.4242 4.4242 4.5736 4.5736 4.6214 4.6214 5.4569 5.4569 5.4981 5.4981 5.5794 5.5794 5.6853 5.6853 5.7234 5.7234 7.5567 7.5567 8.0574 8.0574 8.1154 8.1154 8.6432 8.6432 8.7119 8.7119 9.2521 9.2521 9.3440 9.3440 9.3585 9.3585 k = 0.4500-0.3182 0.5511 ( 8400 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -5.9591 -5.9591 -5.7828 -5.7828 -5.7562 -5.7562 -5.7272 -5.7272 -5.5004 -5.5004 -5.4984 -5.4984 -5.4557 -5.4557 -5.3970 -5.3970 -5.3588 -5.3588 -5.3189 -5.3189 -3.4020 -3.4020 -3.3346 -3.3346 -3.3305 -3.3305 -3.3254 -3.3254 -3.2949 -3.2949 -3.2941 -3.2941 -3.2479 -3.2479 -3.2338 -3.2338 -3.2081 -3.2081 0.1509 0.1509 0.1542 0.1542 2.0793 2.0793 3.1929 3.1929 3.2365 3.2365 3.2663 3.2663 3.3011 3.3011 4.4232 4.4232 4.5834 4.5834 4.6182 4.6182 5.4762 5.4762 5.5136 5.5136 5.5745 5.5745 5.7049 5.7049 5.7325 5.7325 7.5459 7.5459 8.0486 8.0486 8.0977 8.0977 8.6585 8.6585 8.7042 8.7042 9.2464 9.2464 9.3344 9.3344 9.3452 9.3452 k = 0.4625-0.3270 0.5664 ( 8408 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -5.9558 -5.9558 -5.7833 -5.7833 -5.7523 -5.7523 -5.7303 -5.7303 -5.5003 -5.5003 -5.4990 -5.4990 -5.4550 -5.4550 -5.3887 -5.3887 -5.3599 -5.3599 -5.3283 -5.3283 -3.4026 -3.4026 -3.3342 -3.3342 -3.3311 -3.3311 -3.3253 -3.3253 -3.2951 -3.2951 -3.2946 -3.2946 -3.2460 -3.2460 -3.2353 -3.2353 -3.2084 -3.2084 0.1421 0.1421 0.1440 0.1440 2.0805 2.0805 3.1916 3.1916 3.2601 3.2601 3.2697 3.2697 3.2949 3.2949 4.4211 4.4211 4.5915 4.5915 4.6149 4.6149 5.4940 5.4940 5.5255 5.5255 5.5681 5.5681 5.7204 5.7204 5.7392 5.7392 7.5380 7.5380 8.0436 8.0436 8.0822 8.0822 8.6709 8.6709 8.6986 8.6986 9.2417 9.2417 9.3258 9.3258 9.3333 9.3333 k = 0.4750-0.3359 0.5818 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9534 -5.9534 -5.7839 -5.7839 -5.7484 -5.7484 -5.7336 -5.7336 -5.5002 -5.5002 -5.4995 -5.4995 -5.4546 -5.4546 -5.3802 -5.3802 -5.3609 -5.3609 -5.3375 -5.3375 -3.4031 -3.4031 -3.3338 -3.3338 -3.3318 -3.3318 -3.3251 -3.3251 -3.2953 -3.2953 -3.2950 -3.2950 -3.2441 -3.2441 -3.2369 -3.2369 -3.2086 -3.2086 0.1358 0.1358 0.1368 0.1368 2.0814 2.0814 3.1902 3.1902 3.2720 3.2720 3.2724 3.2724 3.2964 3.2964 4.4188 4.4188 4.5978 4.5978 4.6119 4.6119 5.5104 5.5104 5.5340 5.5340 5.5601 5.5601 5.7318 5.7318 5.7435 5.7435 7.5326 7.5326 8.0422 8.0422 8.0689 8.0689 8.6801 8.6801 8.6946 8.6946 9.2383 9.2383 9.3191 9.3191 9.3237 9.3237 k = 0.4875-0.3447 0.5971 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9520 -5.9520 -5.7843 -5.7843 -5.7444 -5.7444 -5.7370 -5.7370 -5.5001 -5.5001 -5.4998 -5.4998 -5.4543 -5.4543 -5.3720 -5.3720 -5.3622 -5.3622 -5.3454 -5.3454 -3.4033 -3.4033 -3.3334 -3.3334 -3.3324 -3.3324 -3.3249 -3.3249 -3.2954 -3.2954 -3.2953 -3.2953 -3.2423 -3.2422 -3.2386 -3.2386 -3.2087 -3.2087 0.1320 0.1320 0.1324 0.1324 2.0819 2.0819 3.1892 3.1892 3.2735 3.2735 3.2743 3.2743 3.3034 3.3034 4.4171 4.4171 4.6025 4.6025 4.6091 4.6091 5.5251 5.5251 5.5389 5.5389 5.5504 5.5504 5.7396 5.7396 5.7452 5.7452 7.5294 7.5294 8.0443 8.0443 8.0580 8.0580 8.6862 8.6862 8.6919 8.6919 9.2363 9.2363 9.3151 9.3151 9.3173 9.3173 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9515 -5.9515 -5.7845 -5.7845 -5.7406 -5.7406 -5.7406 -5.7406 -5.5000 -5.5000 -5.5000 -5.5000 -5.4543 -5.4543 -5.3653 -5.3653 -5.3653 -5.3653 -5.3492 -5.3492 -3.4034 -3.4034 -3.3329 -3.3329 -3.3329 -3.3329 -3.3248 -3.3248 -3.2954 -3.2954 -3.2954 -3.2954 -3.2404 -3.2404 -3.2404 -3.2404 -3.2087 -3.2087 0.1308 0.1308 0.1308 0.1308 2.0821 2.0821 3.1888 3.1888 3.2741 3.2741 3.2741 3.2741 3.3066 3.3066 4.4164 4.4164 4.6061 4.6061 4.6061 4.6061 5.5377 5.5377 5.5377 5.5377 5.5424 5.5424 5.7440 5.7440 5.7440 5.7440 7.5284 7.5284 8.0497 8.0497 8.0497 8.0497 8.6896 8.6896 8.6896 8.6896 9.2356 9.2356 9.3144 9.3144 9.3144 9.3144 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9515 -5.9515 -5.7845 -5.7845 -5.7406 -5.7406 -5.7406 -5.7406 -5.5000 -5.5000 -5.5000 -5.5000 -5.4543 -5.4543 -5.3653 -5.3653 -5.3653 -5.3653 -5.3492 -5.3492 -3.4034 -3.4034 -3.3329 -3.3329 -3.3329 -3.3329 -3.3248 -3.3248 -3.2954 -3.2954 -3.2954 -3.2954 -3.2404 -3.2404 -3.2404 -3.2404 -3.2087 -3.2087 0.1308 0.1308 0.1308 0.1308 2.0821 2.0821 3.1888 3.1888 3.2741 3.2741 3.2741 3.2741 3.3066 3.3066 4.4164 4.4164 4.6061 4.6061 4.6061 4.6061 5.5377 5.5377 5.5377 5.5377 5.5424 5.5424 5.7440 5.7440 5.7440 5.7440 7.5284 7.5284 8.0497 8.0497 8.0497 8.0497 8.6896 8.6896 8.6896 8.6896 9.2356 9.2356 9.3144 9.3144 9.3144 9.3144 k = 0.4828-0.3414 0.6124 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9520 -5.9520 -5.7844 -5.7843 -5.7457 -5.7420 -5.7393 -5.7359 -5.5001 -5.5000 -5.4999 -5.4997 -5.4543 -5.4543 -5.3723 -5.3697 -5.3669 -5.3588 -5.3460 -5.3454 -3.4033 -3.4033 -3.3335 -3.3331 -3.3327 -3.3322 -3.3249 -3.3249 -3.2954 -3.2954 -3.2953 -3.2953 -3.2428 -3.2411 -3.2398 -3.2380 -3.2087 -3.2087 0.1320 0.1321 0.1322 0.1323 2.0819 2.0819 3.1891 3.1892 3.2731 3.2736 3.2741 3.2745 3.3034 3.3040 4.4170 4.4170 4.6008 4.6055 4.6077 4.6093 5.5232 5.5292 5.5336 5.5457 5.5469 5.5508 5.7388 5.7415 5.7435 5.7462 7.5293 7.5294 8.0418 8.0486 8.0537 8.0601 8.6854 8.6885 8.6899 8.6924 9.2362 9.2363 9.3151 9.3154 9.3160 9.3180 k = 0.4655-0.3292 0.6124 ( 8434 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9533 -5.9533 -5.7840 -5.7839 -5.7511 -5.7432 -5.7382 -5.7314 -5.5002 -5.4999 -5.4998 -5.4994 -5.4546 -5.4545 -5.3800 -5.3757 -5.3720 -5.3522 -5.3398 -5.3376 -3.4031 -3.4031 -3.3340 -3.3332 -3.3327 -3.3313 -3.3251 -3.3250 -3.2955 -3.2954 -3.2950 -3.2949 -3.2453 -3.2418 -3.2393 -3.2357 -3.2086 -3.2086 0.1356 0.1360 0.1360 0.1365 2.0814 2.0814 3.1893 3.1906 3.2652 3.2705 3.2751 3.2756 3.2960 3.3011 4.4184 4.4188 4.5931 4.6059 4.6089 4.6118 5.5061 5.5167 5.5247 5.5489 5.5521 5.5612 5.7304 5.7364 5.7402 5.7457 7.5320 7.5327 8.0367 8.0502 8.0613 8.0725 8.6793 8.6873 8.6884 8.6947 9.2377 9.2388 9.3188 9.3196 9.3199 9.3262 k = 0.4483-0.3170 0.6124 ( 8414 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -5.9555 -5.9554 -5.7836 -5.7831 -5.7567 -5.7443 -5.7372 -5.7273 -5.5002 -5.4997 -5.4997 -5.4988 -5.4552 -5.4548 -5.3880 -5.3813 -5.3777 -5.3457 -5.3327 -5.3289 -3.4026 -3.4026 -3.3344 -3.3332 -3.3327 -3.3303 -3.3254 -3.3251 -3.2955 -3.2955 -3.2945 -3.2942 -3.2477 -3.2426 -3.2388 -3.2334 -3.2085 -3.2084 0.1417 0.1423 0.1426 0.1433 2.0805 2.0805 3.1875 3.1924 3.2449 3.2590 3.2775 3.2775 3.2925 3.3041 4.4199 4.4211 4.5831 4.6070 4.6075 4.6165 5.4864 5.5011 5.5126 5.5509 5.5553 5.5698 5.7191 5.7289 5.7345 5.7429 7.5362 7.5385 8.0343 8.0544 8.0728 8.0866 8.6710 8.6840 8.6864 8.6970 9.2400 9.2436 9.3247 9.3248 9.3282 9.3388 k = 0.4310-0.3048 0.6124 ( 8410 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -5.9586 -5.9583 -5.7832 -5.7820 -5.7624 -5.7450 -5.7366 -5.7235 -5.5002 -5.4997 -5.4995 -5.4981 -5.4562 -5.4552 -5.3955 -5.3867 -5.3834 -5.3391 -5.3252 -5.3200 -3.4020 -3.4020 -3.3348 -3.3331 -3.3329 -3.3291 -3.3259 -3.3252 -3.2956 -3.2955 -3.2939 -3.2932 -3.2501 -3.2435 -3.2384 -3.2312 -3.2084 -3.2080 0.1503 0.1511 0.1518 0.1527 2.0791 2.0792 3.1783 3.1906 3.2186 3.2427 3.2802 3.2814 3.2958 3.3119 4.4204 4.4230 4.5709 4.6024 4.6103 4.6232 5.4639 5.4821 5.4967 5.5519 5.5558 5.5763 5.7052 5.7202 5.7269 5.7385 7.5420 7.5468 8.0341 8.0617 8.0881 8.1022 8.6606 8.6762 8.6861 8.6996 9.2428 9.2511 9.3304 9.3329 9.3395 9.3554 k = 0.4138-0.2926 0.6124 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -5.9623 -5.9619 -5.7832 -5.7807 -5.7682 -5.7453 -5.7364 -5.7200 -5.5002 -5.4996 -5.4991 -5.4972 -5.4576 -5.4557 -5.4023 -5.3916 -5.3889 -5.3326 -5.3175 -5.3112 -3.4013 -3.4012 -3.3350 -3.3333 -3.3329 -3.3279 -3.3265 -3.3251 -3.2957 -3.2956 -3.2933 -3.2920 -3.2525 -3.2443 -3.2381 -3.2291 -3.2082 -3.2076 0.1613 0.1623 0.1635 0.1646 2.0771 2.0772 3.1541 3.1639 3.2103 3.2330 3.2840 3.2866 3.3031 3.3227 4.4190 4.4231 4.5566 4.5950 4.6145 4.6317 5.4384 5.4597 5.4765 5.5516 5.5527 5.5806 5.6897 5.7115 5.7177 5.7332 7.5492 7.5575 8.0354 8.0728 8.1054 8.1206 8.6480 8.6648 8.6868 8.7027 9.2459 9.2614 9.3361 9.3423 9.3535 9.3755 k = 0.3966-0.2804 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9667 -5.9660 -5.7837 -5.7793 -5.7738 -5.7450 -5.7366 -5.7169 -5.5001 -5.4997 -5.4987 -5.4960 -5.4597 -5.4562 -5.4079 -5.3962 -5.3940 -5.3260 -5.3098 -5.3027 -3.4004 -3.4002 -3.3352 -3.3338 -3.3324 -3.3271 -3.3266 -3.3248 -3.2958 -3.2958 -3.2927 -3.2906 -3.2549 -3.2452 -3.2378 -3.2271 -3.2080 -3.2071 0.1748 0.1759 0.1777 0.1791 2.0742 2.0744 3.1159 3.1196 3.2145 3.2313 3.2891 3.2930 3.3138 3.3358 4.4150 4.4205 4.5403 4.5847 4.6203 4.6420 5.4100 5.4340 5.4517 5.5444 5.5498 5.5828 5.6735 5.7045 5.7073 5.7279 7.5580 7.5704 8.0376 8.0888 8.1208 8.1452 8.6332 8.6495 8.6889 8.7065 9.2489 9.2740 9.3413 9.3520 9.3697 9.3982 k = 0.3793-0.2682 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9717 -5.9707 -5.7857 -5.7784 -5.7777 -5.7442 -5.7373 -5.7142 -5.5001 -5.4998 -5.4983 -5.4947 -5.4624 -5.4567 -5.4122 -5.4004 -5.3988 -5.3196 -5.3020 -5.2946 -3.3993 -3.3991 -3.3354 -3.3344 -3.3319 -3.3278 -3.3257 -3.3239 -3.2960 -3.2959 -3.2922 -3.2891 -3.2572 -3.2461 -3.2377 -3.2253 -3.2079 -3.2064 0.1906 0.1919 0.1943 0.1959 2.0703 2.0705 3.0695 3.0696 3.2209 3.2332 3.2958 3.3006 3.3276 3.3511 4.4081 4.4142 4.5220 4.5717 4.6276 4.6534 5.3789 5.4049 5.4220 5.5298 5.5459 5.5827 5.6574 5.6958 5.7008 5.7237 7.5682 7.5847 8.0402 8.1105 8.1329 8.1766 8.6164 8.6305 8.6927 8.7113 9.2515 9.2879 9.3460 9.3612 9.3880 9.4226 k = 0.3621-0.2560 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9771 -5.9758 -5.7898 -5.7812 -5.7762 -5.7428 -5.7387 -5.7117 -5.5000 -5.4999 -5.4978 -5.4931 -5.4658 -5.4573 -5.4151 -5.4041 -5.4033 -5.3132 -5.2944 -5.2870 -3.3982 -3.3978 -3.3354 -3.3349 -3.3313 -3.3284 -3.3253 -3.3225 -3.2962 -3.2960 -3.2918 -3.2874 -3.2595 -3.2471 -3.2376 -3.2235 -3.2078 -3.2057 0.2087 0.2103 0.2131 0.2149 2.0648 2.0653 3.0163 3.0189 3.2279 3.2364 3.3042 3.3095 3.3443 3.3685 4.3979 4.4036 4.5019 4.5557 4.6362 4.6656 5.3451 5.3731 5.3874 5.5088 5.5398 5.5804 5.6415 5.6833 5.7011 5.7213 7.5798 7.6000 8.0429 8.1383 8.1421 8.2136 8.5979 8.6082 8.6987 8.7175 9.2536 9.3016 9.3505 9.3688 9.4077 9.4473 k = 0.3448-0.2438 0.6124 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9829 -5.9812 -5.7952 -5.7830 -5.7748 -5.7410 -5.7407 -5.7096 -5.5002 -5.4998 -5.4973 -5.4914 -5.4695 -5.4579 -5.4167 -5.4074 -5.4074 -5.3069 -5.2869 -5.2799 -3.3969 -3.3964 -3.3355 -3.3354 -3.3308 -3.3288 -3.3250 -3.3208 -3.2964 -3.2961 -3.2915 -3.2857 -3.2616 -3.2480 -3.2375 -3.2220 -3.2078 -3.2050 0.2292 0.2309 0.2340 0.2361 2.0575 2.0583 2.9616 2.9660 3.2349 3.2401 3.3148 3.3198 3.3637 3.3877 4.3844 4.3886 4.4804 4.5370 4.6457 4.6780 5.3087 5.3392 5.3483 5.4827 5.5310 5.5759 5.6258 5.6698 5.7050 5.7214 7.5925 7.6154 8.0457 8.1484 8.1722 8.2554 8.5781 8.5832 8.7072 8.7255 9.2550 9.3133 9.3556 9.3738 9.4286 9.4712 k = 0.3276-0.2316 0.6124 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9890 -5.9868 -5.8010 -5.7846 -5.7734 -5.7433 -5.7388 -5.7079 -5.5007 -5.4997 -5.4968 -5.4896 -5.4732 -5.4583 -5.4174 -5.4112 -5.4100 -5.3008 -5.2795 -5.2733 -3.3954 -3.3948 -3.3359 -3.3353 -3.3309 -3.3285 -3.3247 -3.3190 -3.2967 -3.2962 -3.2914 -3.2839 -3.2638 -3.2488 -3.2375 -3.2205 -3.2077 -3.2042 0.2519 0.2537 0.2569 0.2593 2.0477 2.0489 2.9072 2.9127 3.2415 3.2438 3.3277 3.3314 3.3856 3.4088 4.3675 4.3689 4.4575 4.5157 4.6557 4.6903 5.2692 5.3049 5.3050 5.4532 5.5198 5.5693 5.6101 5.6555 5.7117 5.7238 7.6061 7.6303 8.0484 8.1518 8.2117 8.3005 8.5563 8.5580 8.7188 8.7357 9.2559 9.3214 9.3619 9.3757 9.4502 9.4934 k = 0.3103-0.2194 0.6124 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9952 -5.9926 -5.8068 -5.7862 -5.7722 -5.7466 -5.7365 -5.7065 -5.5013 -5.4996 -5.4964 -5.4877 -5.4768 -5.4587 -5.4177 -5.4146 -5.4115 -5.2950 -5.2724 -5.2674 -3.3939 -3.3931 -3.3361 -3.3351 -3.3314 -3.3276 -3.3245 -3.3171 -3.2970 -3.2963 -3.2915 -3.2820 -3.2658 -3.2496 -3.2376 -3.2193 -3.2077 -3.2034 0.2767 0.2787 0.2816 0.2842 2.0347 2.0366 2.8544 2.8606 3.2473 3.2473 3.3430 3.3444 3.4097 3.4317 4.3447 4.3471 4.4334 4.4922 4.6659 4.7022 5.2261 5.2581 5.2717 5.4220 5.5061 5.5607 5.5938 5.6404 5.7206 5.7286 7.6201 7.6445 8.0507 8.1521 8.2554 8.3468 8.5292 8.5393 8.7338 8.7489 9.2565 9.3262 9.3683 9.3744 9.4721 9.5134 k = 0.2931-0.2073 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0016 -5.9986 -5.8124 -5.7878 -5.7711 -5.7504 -5.7340 -5.7055 -5.5021 -5.4995 -5.4959 -5.4858 -5.4799 -5.4590 -5.4186 -5.4178 -5.4110 -5.2893 -5.2656 -5.2620 -3.3923 -3.3914 -3.3362 -3.3348 -3.3320 -3.3265 -3.3244 -3.3152 -3.2973 -3.2964 -3.2917 -3.2801 -3.2677 -3.2503 -3.2377 -3.2182 -3.2078 -3.2026 0.3036 0.3057 0.3079 0.3109 2.0180 2.0207 2.8046 2.8110 3.2507 3.2524 3.3587 3.3607 3.4361 3.4563 4.3164 4.3230 4.4081 4.4667 4.6760 4.7136 5.1795 5.2084 5.2407 5.3904 5.4902 5.5505 5.5766 5.6247 5.7309 5.7353 7.6342 7.6577 8.0524 8.1494 8.2998 8.3884 8.5049 8.5273 8.7525 8.7656 9.2570 9.3294 9.3701 9.3724 9.4940 9.5317 k = 0.2759-0.1951 0.6124 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0079 -6.0046 -5.8178 -5.7893 -5.7702 -5.7549 -5.7315 -5.7048 -5.5031 -5.4995 -5.4955 -5.4842 -5.4820 -5.4591 -5.4208 -5.4201 -5.4087 -5.2839 -5.2592 -5.2573 -3.3906 -3.3896 -3.3361 -3.3347 -3.3324 -3.3252 -3.3243 -3.3133 -3.2976 -3.2965 -3.2920 -3.2783 -3.2695 -3.2509 -3.2379 -3.2173 -3.2079 -3.2020 0.3325 0.3345 0.3356 0.3391 1.9967 2.0005 2.7590 2.7653 3.2537 3.2568 3.3744 3.3805 3.4643 3.4826 4.2845 4.2953 4.3815 4.4399 4.6857 4.7242 5.1298 5.1565 5.2124 5.3594 5.4724 5.5389 5.5580 5.6085 5.7423 5.7436 7.6479 7.6698 8.0534 8.1440 8.3366 8.4118 8.4908 8.5346 8.7752 8.7866 9.2578 9.3325 9.3638 9.3728 9.5156 9.5488 k = 0.2586-0.1829 0.6124 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0142 -6.0107 -5.8229 -5.7907 -5.7696 -5.7598 -5.7290 -5.7044 -5.5042 -5.4995 -5.4951 -5.4850 -5.4814 -5.4590 -5.4235 -5.4217 -5.4052 -5.2789 -5.2532 -5.2531 -3.3888 -3.3878 -3.3358 -3.3348 -3.3324 -3.3243 -3.3238 -3.3115 -3.2980 -3.2966 -3.2925 -3.2767 -3.2710 -3.2513 -3.2382 -3.2166 -3.2080 -3.2014 0.3629 0.3646 0.3648 0.3690 1.9703 1.9753 2.7188 2.7246 3.2564 3.2604 3.3912 3.4023 3.4943 3.5104 4.2497 4.2640 4.3534 4.4121 4.6948 4.7341 5.0781 5.1033 5.1870 5.3298 5.4528 5.5260 5.5381 5.5920 5.7531 5.7543 7.6609 7.6808 8.0535 8.1362 8.3507 8.4090 8.5007 8.5682 8.8023 8.8129 9.2586 9.3362 9.3573 9.3691 9.5367 9.5655 k = 0.2414-0.1707 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0204 -6.0166 -5.8276 -5.7919 -5.7692 -5.7652 -5.7266 -5.7044 -5.5053 -5.4996 -5.4947 -5.4863 -5.4797 -5.4587 -5.4261 -5.4232 -5.4008 -5.2742 -5.2497 -5.2474 -3.3870 -3.3859 -3.3353 -3.3352 -3.3320 -3.3244 -3.3224 -3.3098 -3.2983 -3.2966 -3.2930 -3.2758 -3.2717 -3.2515 -3.2384 -3.2161 -3.2082 -3.2009 0.3931 0.3951 0.3969 0.4013 1.9384 1.9449 2.6846 2.6896 3.2587 3.2633 3.4093 3.4259 3.5258 3.5396 4.2126 4.2296 4.3239 4.3837 4.7029 4.7429 5.0253 5.0498 5.1646 5.3021 5.4315 5.5096 5.5193 5.5754 5.7634 5.7666 7.6727 7.6905 8.0527 8.1262 8.3391 8.3917 8.5365 8.6151 8.8337 8.8450 9.2590 9.3389 9.3528 9.3644 9.5572 9.5822 k = 0.2241-0.1585 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0265 -6.0225 -5.8319 -5.7930 -5.7711 -5.7689 -5.7244 -5.7046 -5.5064 -5.4999 -5.4943 -5.4872 -5.4779 -5.4581 -5.4285 -5.4246 -5.3955 -5.2701 -5.2467 -5.2421 -3.3851 -3.3841 -3.3359 -3.3345 -3.3313 -3.3245 -3.3210 -3.3082 -3.2987 -3.2967 -3.2935 -3.2763 -3.2710 -3.2515 -3.2388 -3.2159 -3.2084 -3.2005 0.4232 0.4255 0.4314 0.4358 1.9011 1.9090 2.6567 2.6608 3.2605 3.2655 3.4285 3.4511 3.5588 3.5700 4.1741 4.1926 4.2929 4.3547 4.7096 4.7502 4.9728 4.9971 5.1451 5.2765 5.4087 5.4867 5.5048 5.5589 5.7743 5.7790 7.6830 7.6989 8.0507 8.1145 8.3152 8.3694 8.5833 8.6648 8.8692 8.8834 9.2586 9.3342 9.3525 9.3668 9.5769 9.5988 k = 0.2069-0.1463 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0323 -6.0282 -5.8358 -5.7938 -5.7770 -5.7690 -5.7224 -5.7051 -5.5074 -5.5002 -5.4939 -5.4879 -5.4763 -5.4574 -5.4308 -5.4259 -5.3896 -5.2666 -5.2440 -5.2373 -3.3833 -3.3823 -3.3365 -3.3336 -3.3304 -3.3248 -3.3196 -3.3069 -3.2990 -3.2968 -3.2940 -3.2775 -3.2695 -3.2512 -3.2392 -3.2158 -3.2085 -3.2003 0.4534 0.4559 0.4676 0.4722 1.8588 1.8680 2.6351 2.6382 3.2619 3.2671 3.4488 3.4778 3.5928 3.6015 4.1349 4.1538 4.2604 4.3252 4.7137 4.7546 4.9227 4.9469 5.1285 5.2532 5.3847 5.4603 5.4921 5.5426 5.7854 5.7913 7.6918 7.7060 8.0478 8.1014 8.2874 8.3454 8.6322 8.7134 8.9072 8.9274 9.2577 9.3218 9.3583 9.3784 9.5959 9.6154 k = 0.1897-0.1341 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0377 -6.0337 -5.8392 -5.7945 -5.7831 -5.7694 -5.7205 -5.7057 -5.5082 -5.5007 -5.4935 -5.4883 -5.4747 -5.4564 -5.4330 -5.4271 -5.3830 -5.2639 -5.2415 -5.2329 -3.3814 -3.3805 -3.3370 -3.3327 -3.3295 -3.3251 -3.3182 -3.3057 -3.2994 -3.2971 -3.2944 -3.2789 -3.2677 -3.2507 -3.2396 -3.2159 -3.2087 -3.2003 0.4834 0.4860 0.5054 0.5103 1.8120 1.8224 2.6191 2.6213 3.2627 3.2679 3.4702 3.5058 3.6278 3.6339 4.0957 4.1142 4.2265 4.2952 4.7133 4.7523 4.8795 4.9018 5.1144 5.2322 5.3597 5.4319 5.4801 5.5269 5.7966 5.8033 7.6988 7.7117 8.0437 8.0874 8.2594 8.3212 8.6798 8.7594 8.9453 8.9751 9.2578 9.3074 9.3702 9.3955 9.6140 9.6318 k = 0.1724-0.1219 0.6124 ( 8384 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0429 -6.0389 -5.8420 -5.7949 -5.7893 -5.7699 -5.7188 -5.7064 -5.5088 -5.5012 -5.4931 -5.4886 -5.4731 -5.4553 -5.4351 -5.4282 -5.3760 -5.2622 -5.2391 -5.2291 -3.3795 -3.3789 -3.3376 -3.3316 -3.3284 -3.3254 -3.3168 -3.3049 -3.2997 -3.2976 -3.2945 -3.2804 -3.2658 -3.2499 -3.2401 -3.2163 -3.2089 -3.2004 0.5128 0.5154 0.5445 0.5498 1.7617 1.7731 2.6082 2.6096 3.2629 3.2680 3.4926 3.5350 3.6635 3.6669 4.0575 4.0748 4.1915 4.2646 4.7045 4.7357 4.8515 4.8662 5.1028 5.2134 5.3340 5.4020 5.4688 5.5117 5.8077 5.8148 7.7040 7.7159 8.0386 8.0729 8.2328 8.2976 8.7255 8.8031 8.9800 9.0227 9.2614 9.2949 9.3875 9.4166 9.6314 9.6479 k = 0.1552-0.1097 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0477 -6.0438 -5.8444 -5.7956 -5.7950 -5.7708 -5.7174 -5.7072 -5.5092 -5.5018 -5.4927 -5.4887 -5.4716 -5.4540 -5.4371 -5.4293 -5.3685 -5.2617 -5.2366 -5.2257 -3.3777 -3.3773 -3.3380 -3.3306 -3.3273 -3.3257 -3.3155 -3.3043 -3.2999 -3.2982 -3.2945 -3.2818 -3.2639 -3.2489 -3.2407 -3.2168 -3.2091 -3.2007 0.5412 0.5438 0.5848 0.5904 1.7090 1.7211 2.6014 2.6021 3.2626 3.2674 3.5160 3.5653 3.6994 3.7002 4.0209 4.0364 4.1557 4.2333 4.6836 4.7018 4.8421 4.8444 5.0934 5.1968 5.3081 5.3711 5.4583 5.4973 5.8184 5.8257 7.7076 7.7186 8.0325 8.0583 8.2086 8.2749 8.7697 8.8449 9.0081 9.0649 9.2704 9.2883 9.4089 9.4404 9.6478 9.6637 k = 0.1379-0.0975 0.6124 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0520 -6.0484 -5.8462 -5.8017 -5.7949 -5.7719 -5.7161 -5.7079 -5.5094 -5.5024 -5.4923 -5.4888 -5.4700 -5.4527 -5.4391 -5.4303 -5.3607 -5.2622 -5.2340 -5.2229 -3.3760 -3.3758 -3.3384 -3.3299 -3.3261 -3.3257 -3.3143 -3.3040 -3.3001 -3.2988 -3.2943 -3.2832 -3.2619 -3.2476 -3.2413 -3.2176 -3.2092 -3.2011 0.5682 0.5707 0.6260 0.6320 1.6549 1.6674 2.5979 2.5981 3.2617 3.2662 3.5403 3.5964 3.7331 3.7353 3.9867 3.9999 4.1194 4.2015 4.6513 4.6585 4.8360 4.8443 5.0860 5.1820 5.2824 5.3397 5.4487 5.4838 5.8285 5.8357 7.7098 7.7201 8.0254 8.0440 8.1877 8.2535 8.8128 8.8849 9.0287 9.0952 9.2848 9.2921 9.4328 9.4659 9.6635 9.6794 k = 0.1207-0.0853 0.6124 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0559 -6.0525 -5.8475 -5.8077 -5.7945 -5.7732 -5.7150 -5.7086 -5.5095 -5.5031 -5.4920 -5.4889 -5.4684 -5.4513 -5.4410 -5.4313 -5.3527 -5.2639 -5.2314 -5.2205 -3.3745 -3.3744 -3.3386 -3.3297 -3.3253 -3.3250 -3.3133 -3.3040 -3.3002 -3.2995 -3.2940 -3.2845 -3.2599 -3.2461 -3.2420 -3.2187 -3.2092 -3.2017 0.5934 0.5958 0.6678 0.6740 1.6004 1.6130 2.5967 2.5968 3.2603 3.2644 3.5657 3.6283 3.7650 3.7704 3.9557 3.9662 4.0834 4.1692 4.6125 4.6126 4.8366 4.8515 5.0804 5.1691 5.2575 5.3082 5.4401 5.4713 5.8380 5.8449 7.7108 7.7203 8.0174 8.0303 8.1704 8.2335 8.8552 8.9225 9.0438 9.1103 9.3018 9.3079 9.4579 9.4913 9.6783 9.6949 k = 0.1034-0.0731 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0592 -6.0563 -5.8481 -5.8135 -5.7939 -5.7747 -5.7141 -5.7092 -5.5095 -5.5038 -5.4916 -5.4889 -5.4668 -5.4500 -5.4428 -5.4323 -5.3446 -5.2665 -5.2287 -5.2186 -3.3732 -3.3729 -3.3387 -3.3301 -3.3245 -3.3238 -3.3123 -3.3043 -3.3003 -3.3001 -3.2936 -3.2857 -3.2580 -3.2444 -3.2427 -3.2199 -3.2092 -3.2023 0.6164 0.6185 0.7095 0.7160 1.5467 1.5591 2.5971 2.5974 3.2586 3.2622 3.5921 3.6606 3.7944 3.8038 3.9286 3.9359 4.0486 4.1368 4.5676 4.5717 4.8423 4.8609 5.0764 5.1576 5.2340 5.2774 5.4328 5.4598 5.8466 5.8529 7.7110 7.7196 8.0090 8.0176 8.1569 8.2152 8.8965 8.9554 9.0579 9.1134 9.3179 9.3311 9.4825 9.5147 9.6924 9.7100 k = 0.0862-0.0610 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0621 -6.0595 -5.8482 -5.8189 -5.7930 -5.7763 -5.7134 -5.7098 -5.5093 -5.5045 -5.4912 -5.4890 -5.4651 -5.4491 -5.4441 -5.4334 -5.3364 -5.2700 -5.2262 -5.2173 -3.3721 -3.3717 -3.3386 -3.3308 -3.3235 -3.3227 -3.3115 -3.3047 -3.3006 -3.3004 -3.2932 -3.2868 -3.2561 -3.2435 -3.2426 -3.2214 -3.2091 -3.2031 0.6367 0.6386 0.7506 0.7571 1.4951 1.5069 2.5987 2.5991 3.2566 3.2597 3.6195 3.6932 3.8186 3.8341 3.9068 3.9099 4.0170 4.1047 4.5252 4.5318 4.8505 4.8710 5.0741 5.1474 5.2126 5.2479 5.4267 5.4496 5.8543 5.8598 7.7106 7.7182 8.0006 8.0062 8.1471 8.1985 8.9356 8.9801 9.0767 9.1114 9.3298 9.3540 9.5055 9.5346 9.7055 9.7243 k = 0.0690-0.0488 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0644 -6.0623 -5.8478 -5.8240 -5.7919 -5.7781 -5.7128 -5.7102 -5.5091 -5.5051 -5.4909 -5.4891 -5.4634 -5.4492 -5.4444 -5.4345 -5.3283 -5.2743 -5.2239 -5.2164 -3.3712 -3.3707 -3.3384 -3.3317 -3.3225 -3.3217 -3.3108 -3.3052 -3.3010 -3.3006 -3.2927 -3.2878 -3.2543 -3.2444 -3.2405 -3.2230 -3.2088 -3.2039 0.6540 0.6556 0.7898 0.7961 1.4472 1.4579 2.6009 2.6012 3.2546 3.2571 3.6479 3.7254 3.8325 3.8571 3.8911 3.8919 3.9921 4.0740 4.4870 4.4946 4.8601 4.8806 5.0736 5.1380 5.1940 5.2206 5.4221 5.4406 5.8608 5.8655 7.7100 7.7164 7.9928 7.9964 8.1408 8.1837 8.9701 8.9950 9.1025 9.1105 9.3356 9.3706 9.5259 9.5500 9.7176 9.7365 k = 0.0517-0.0366 0.6124 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0662 -6.0645 -5.8467 -5.8287 -5.7906 -5.7800 -5.7123 -5.7106 -5.5088 -5.5058 -5.4905 -5.4892 -5.4616 -5.4505 -5.4435 -5.4357 -5.3203 -5.2793 -5.2217 -5.2159 -3.3704 -3.3699 -3.3380 -3.3327 -3.3216 -3.3209 -3.3101 -3.3058 -3.3013 -3.3008 -3.2922 -3.2886 -3.2527 -3.2453 -3.2383 -3.2249 -3.2085 -3.2047 0.6679 0.6691 0.8256 0.8313 1.4050 1.4141 2.6031 2.6034 3.2528 3.2547 3.6771 3.7564 3.8314 3.8585 3.8831 3.8913 3.9795 4.0462 4.4546 4.4620 4.8702 4.8886 5.0751 5.1289 5.1790 5.1968 5.4190 5.4330 5.8662 5.8698 7.7094 7.7144 7.9861 7.9884 8.1377 8.1708 8.9958 9.0029 9.1161 9.1315 9.3359 9.3773 9.5431 9.5609 9.7284 9.7454 k = 0.0345-0.0244 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0673 -6.0662 -5.8450 -5.8330 -5.7891 -5.7819 -5.7120 -5.7109 -5.5084 -5.5064 -5.4902 -5.4893 -5.4597 -5.4522 -5.4422 -5.4369 -5.3125 -5.2849 -5.2199 -5.2159 -3.3697 -3.3694 -3.3374 -3.3337 -3.3209 -3.3204 -3.3094 -3.3065 -3.3014 -3.3010 -3.2917 -3.2894 -3.2512 -3.2463 -3.2360 -3.2269 -3.2081 -3.2055 0.6781 0.6789 0.8554 0.8598 1.3714 1.3782 2.6049 2.6051 3.2514 3.2527 3.7070 3.7837 3.8189 3.8470 3.8765 3.8980 3.9806 4.0237 4.4299 4.4358 4.8797 4.8938 5.0793 5.1190 5.1681 5.1781 5.4174 5.4268 5.8703 5.8728 7.7091 7.7126 7.9811 7.9825 8.1374 8.1599 9.0076 9.0096 9.1310 9.1565 9.3341 9.3733 9.5564 9.5678 9.7376 9.7503 k = 0.0172-0.0122 0.6124 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0679 -6.0674 -5.8428 -5.8368 -5.7875 -5.7838 -5.7117 -5.7112 -5.5079 -5.5069 -5.4900 -5.4895 -5.4578 -5.4541 -5.4409 -5.4382 -5.3050 -5.2911 -5.2183 -5.2163 -3.3693 -3.3691 -3.3366 -3.3348 -3.3203 -3.3201 -3.3087 -3.3073 -3.3015 -3.3012 -3.2912 -3.2900 -3.2498 -3.2474 -3.2337 -3.2291 -3.2076 -3.2062 0.6844 0.6848 0.8761 0.8786 1.3499 1.3536 2.6062 2.6063 3.2506 3.2513 3.7370 3.7903 3.8133 3.8362 3.8758 3.8950 3.9887 4.0084 4.4148 4.4181 4.8877 4.8955 5.0866 5.1080 5.1620 5.1661 5.4174 5.4221 5.8730 5.8743 7.7092 7.7110 7.9781 7.9788 8.1396 8.1510 9.0109 9.0140 9.1508 9.1697 9.3362 9.3611 9.5655 9.5711 9.7447 9.7515 k = 0.0000 0.0000 0.6124 ( 8366 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0679 -6.0679 -5.8401 -5.8401 -5.7857 -5.7857 -5.7114 -5.7114 -5.5075 -5.5075 -5.4897 -5.4897 -5.4559 -5.4559 -5.4395 -5.4395 -5.2978 -5.2978 -5.2172 -5.2172 -3.3691 -3.3691 -3.3357 -3.3357 -3.3201 -3.3201 -3.3080 -3.3080 -3.3014 -3.3014 -3.2906 -3.2906 -3.2486 -3.2486 -3.2313 -3.2313 -3.2069 -3.2069 0.6867 0.6867 0.8844 0.8844 1.3436 1.3436 2.6067 2.6067 3.2506 3.2506 3.7660 3.7660 3.8258 3.8258 3.8843 3.8843 3.9981 3.9981 4.4107 4.4107 4.8933 4.8933 5.0965 5.0965 5.1611 5.1611 5.4189 5.4189 5.8744 5.8744 7.7099 7.7099 7.9773 7.9773 8.1442 8.1442 9.0134 9.0134 9.1666 9.1666 9.3463 9.3463 9.5704 9.5704 9.7495 9.7495 k = 0.0000 0.0000 0.6124 ( 8366 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0679 -6.0679 -5.8401 -5.8401 -5.7857 -5.7857 -5.7114 -5.7114 -5.5075 -5.5075 -5.4897 -5.4897 -5.4559 -5.4559 -5.4395 -5.4395 -5.2978 -5.2978 -5.2172 -5.2172 -3.3691 -3.3691 -3.3357 -3.3357 -3.3201 -3.3201 -3.3080 -3.3080 -3.3014 -3.3014 -3.2906 -3.2906 -3.2486 -3.2486 -3.2313 -3.2313 -3.2069 -3.2069 0.6867 0.6867 0.8844 0.8844 1.3436 1.3436 2.6067 2.6067 3.2506 3.2506 3.7660 3.7660 3.8258 3.8258 3.8843 3.8843 3.9981 3.9981 4.4107 4.4107 4.8933 4.8933 5.0965 5.0965 5.1611 5.1611 5.4189 5.4189 5.8744 5.8744 7.7099 7.7099 7.9773 7.9773 8.1442 8.1442 9.0134 9.0134 9.1666 9.1666 9.3463 9.3463 9.5704 9.5704 9.7495 9.7495 k = 0.0000 0.0000 0.5913 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0705 -6.0676 -5.8451 -5.8340 -5.7870 -5.7845 -5.7189 -5.7038 -5.5080 -5.5070 -5.4916 -5.4878 -5.4564 -5.4562 -5.4459 -5.4316 -5.3022 -5.2934 -5.2224 -5.2117 -3.3692 -3.3689 -3.3367 -3.3352 -3.3203 -3.3202 -3.3085 -3.3068 -3.3017 -3.3007 -3.2912 -3.2898 -3.2502 -3.2469 -3.2316 -3.2311 -3.2073 -3.2064 0.6879 0.6881 0.8853 0.8858 1.3432 1.3446 2.6083 2.6084 3.2489 3.2509 3.7662 3.7677 3.8123 3.8322 3.8718 3.8927 4.0015 4.0053 4.4093 4.4104 4.8880 4.8925 5.0520 5.1035 5.1464 5.2044 5.4150 5.4164 5.8601 5.8805 7.6912 7.7353 7.9704 7.9870 8.1380 8.1492 9.0080 9.0186 9.1352 9.2073 9.3415 9.3526 9.5572 9.5914 9.7408 9.7517 k = 0.0000 0.0000 0.5701 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0751 -6.0697 -5.8490 -5.8270 -5.7884 -5.7834 -5.7263 -5.6963 -5.5086 -5.5065 -5.4934 -5.4859 -5.4595 -5.4564 -5.4490 -5.4231 -5.3063 -5.2888 -5.2273 -5.2062 -3.3694 -3.3688 -3.3380 -3.3354 -3.3210 -3.3205 -3.3083 -3.3052 -3.3014 -3.2998 -3.2917 -3.2889 -3.2518 -3.2452 -3.2318 -3.2308 -3.2077 -3.2059 0.6917 0.6921 0.8887 0.8897 1.3437 1.3465 2.6132 2.6134 3.2461 3.2500 3.7688 3.7692 3.7960 3.8254 3.8626 3.8970 4.0139 4.0211 4.4061 4.4082 4.8764 4.8851 5.0039 5.0538 5.1810 5.2415 5.4041 5.4087 5.8380 5.8783 7.6801 7.7666 7.9668 7.9991 8.1311 8.1535 9.0043 9.0221 9.1109 9.2579 9.3378 9.3610 9.5516 9.6201 9.7256 9.7480 k = 0.0000 0.0000 0.5490 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0815 -6.0741 -5.8515 -5.8195 -5.7900 -5.7825 -5.7335 -5.6889 -5.5092 -5.5062 -5.4952 -5.4841 -5.4649 -5.4566 -5.4487 -5.4140 -5.3101 -5.2842 -5.2318 -5.2006 -3.3697 -3.3687 -3.3394 -3.3364 -3.3223 -3.3201 -3.3080 -3.3036 -3.3003 -3.2985 -3.2920 -3.2878 -3.2533 -3.2436 -3.2319 -3.2304 -3.2080 -3.2053 0.6981 0.6986 0.8944 0.8960 1.3449 1.3491 2.6214 2.6217 3.2423 3.2478 3.7596 3.7736 3.7889 3.8050 3.8603 3.8993 4.0321 4.0417 4.4011 4.4041 4.8572 4.8692 4.9554 5.0018 5.2130 5.2676 5.3861 5.3987 5.8086 5.8681 7.6770 7.8032 7.9666 8.0126 8.1248 8.1579 9.0035 9.0231 9.0916 9.3170 9.3349 9.3725 9.5529 9.6544 9.7040 9.7402 k = 0.0000 0.0000 0.5279 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0896 -6.0806 -5.8528 -5.8118 -5.7916 -5.7818 -5.7404 -5.6818 -5.5098 -5.5059 -5.4969 -5.4825 -5.4705 -5.4567 -5.4470 -5.4046 -5.3136 -5.2796 -5.2359 -5.1950 -3.3699 -3.3686 -3.3409 -3.3380 -3.3239 -3.3192 -3.3079 -3.3022 -3.2985 -3.2968 -3.2921 -3.2866 -3.2547 -3.2419 -3.2321 -3.2299 -3.2082 -3.2047 0.7071 0.7078 0.9026 0.9047 1.3468 1.3523 2.6328 2.6333 3.2377 3.2447 3.7371 3.7769 3.7821 3.7938 3.8601 3.9015 4.0533 4.0644 4.3944 4.3980 4.8276 4.8412 4.9103 4.9546 5.2394 5.2768 5.3613 5.3920 5.7725 5.8501 7.6825 7.8443 7.9698 8.0265 8.1211 8.1637 9.0046 9.0214 9.0764 9.3329 9.3733 9.3955 9.5612 9.6763 9.6847 9.7372 k = 0.0000 0.0000 0.5068 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0989 -6.0891 -5.8529 -5.8041 -5.7931 -5.7812 -5.7469 -5.6751 -5.5104 -5.5058 -5.4986 -5.4819 -5.4749 -5.4567 -5.4445 -5.3950 -5.3167 -5.2749 -5.2396 -5.1896 -3.3701 -3.3686 -3.3425 -3.3401 -3.3253 -3.3180 -3.3079 -3.3009 -3.2964 -3.2949 -3.2920 -3.2853 -3.2560 -3.2403 -3.2323 -3.2294 -3.2083 -3.2041 0.7186 0.7194 0.9130 0.9158 1.3494 1.3563 2.6474 2.6481 3.2327 3.2409 3.7108 3.7491 3.7892 3.8012 3.8602 3.9047 4.0758 4.0874 4.3858 4.3898 4.7859 4.7982 4.8713 4.9162 5.2592 5.2648 5.3306 5.3930 5.7305 5.8249 7.6968 7.8892 7.9764 8.0394 8.1226 8.1721 9.0039 9.0169 9.0674 9.3317 9.3954 9.4553 9.5783 9.6432 9.6833 9.7661 k = 0.0000 0.0000 0.4857 ( 8390 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1093 -6.0992 -5.8521 -5.7981 -5.7933 -5.7808 -5.7530 -5.6690 -5.5110 -5.5058 -5.5002 -5.4844 -5.4757 -5.4566 -5.4413 -5.3851 -5.3192 -5.2704 -5.2427 -5.1845 -3.3704 -3.3686 -3.3442 -3.3424 -3.3266 -3.3165 -3.3080 -3.2999 -3.2944 -3.2927 -3.2912 -3.2839 -3.2572 -3.2387 -3.2325 -3.2288 -3.2084 -3.2034 0.7325 0.7335 0.9258 0.9291 1.3528 1.3609 2.6649 2.6660 3.2276 3.2367 3.6834 3.7191 3.7978 3.8085 3.8609 3.9098 4.0985 4.1099 4.3754 4.3792 4.7345 4.7430 4.8368 4.8850 5.2352 5.2663 5.3003 5.3983 5.6838 5.7934 7.7197 7.9373 7.9864 8.0502 8.1313 8.1841 8.9951 9.0094 9.0690 9.3311 9.4123 9.5111 9.6064 9.6097 9.6616 9.8143 k = 0.0000 0.0000 0.4646 ( 8392 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.1207 -6.1106 -5.8505 -5.7981 -5.7877 -5.7807 -5.7586 -5.6637 -5.5115 -5.5060 -5.5017 -5.4886 -5.4744 -5.4564 -5.4375 -5.3751 -5.3212 -5.2659 -5.2453 -5.1797 -3.3707 -3.3686 -3.3459 -3.3448 -3.3275 -3.3149 -3.3081 -3.2989 -3.2935 -3.2905 -3.2891 -3.2825 -3.2582 -3.2372 -3.2327 -3.2281 -3.2083 -3.2028 0.7489 0.7500 0.9408 0.9447 1.3568 1.3661 2.6854 2.6870 3.2227 3.2325 3.6557 3.6888 3.8051 3.8142 3.8636 3.9174 4.1206 4.1312 4.3631 4.3663 4.6781 4.6810 4.8030 4.8562 5.1940 5.2370 5.2945 5.4027 5.6335 5.7565 7.7507 7.9868 8.0006 8.0599 8.1471 8.2006 8.9773 8.9991 9.0806 9.3307 9.4287 9.5369 9.5777 9.6337 9.6583 9.8671 k = 0.0000 0.0000 0.4434 ( 8380 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1326 -6.1230 -5.8484 -5.7998 -5.7810 -5.7809 -5.7634 -5.6593 -5.5121 -5.5064 -5.5032 -5.4927 -5.4726 -5.4562 -5.4331 -5.3651 -5.3224 -5.2614 -5.2473 -5.1752 -3.3710 -3.3687 -3.3476 -3.3473 -3.3281 -3.3133 -3.3081 -3.2979 -3.2931 -3.2882 -3.2864 -3.2810 -3.2590 -3.2357 -3.2329 -3.2273 -3.2082 -3.2021 0.7677 0.7687 0.9580 0.9625 1.3614 1.3719 2.7087 2.7109 3.2183 3.2285 3.6281 3.6585 3.8090 3.8172 3.8698 3.9279 4.1415 4.1509 4.3488 4.3507 4.6159 4.6199 4.7678 4.8269 5.1447 5.1884 5.2971 5.4036 5.5810 5.7155 7.7890 8.0141 8.0415 8.0707 8.1688 8.2220 8.9537 8.9858 9.0979 9.3295 9.4423 9.5081 9.5903 9.6034 9.7102 9.9203 k = 0.0000 0.0000 0.4223 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1451 -6.1362 -5.8458 -5.8017 -5.7819 -5.7744 -5.7673 -5.6560 -5.5126 -5.5069 -5.5046 -5.4966 -5.4706 -5.4559 -5.4279 -5.3552 -5.3229 -5.2571 -5.2489 -5.1713 -3.3713 -3.3689 -3.3497 -3.3495 -3.3282 -3.3117 -3.3081 -3.2970 -3.2929 -3.2860 -3.2835 -3.2794 -3.2596 -3.2343 -3.2332 -3.2264 -3.2081 -3.2016 0.7886 0.7897 0.9773 0.9825 1.3666 1.3781 2.7346 2.7376 3.2148 3.2251 3.6010 3.6286 3.8086 3.8174 3.8800 3.9411 4.1606 4.1686 4.3324 4.3325 4.5497 4.5615 4.7304 4.7957 5.0890 5.1324 5.2968 5.4004 5.5280 5.6717 7.8332 8.0332 8.0842 8.0941 8.1948 8.2486 8.9263 8.9696 9.1181 9.3258 9.4354 9.4816 9.5733 9.6131 9.7531 9.9720 k = 0.0000 0.0000 0.4012 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1579 -6.1498 -5.8430 -5.8038 -5.7838 -5.7698 -5.7685 -5.6538 -5.5131 -5.5075 -5.5059 -5.5000 -5.4686 -5.4556 -5.4221 -5.3454 -5.3226 -5.2530 -5.2499 -5.1679 -3.3716 -3.3690 -3.3521 -3.3514 -3.3278 -3.3102 -3.3079 -3.2960 -3.2927 -3.2839 -3.2807 -3.2779 -3.2600 -3.2335 -3.2330 -3.2255 -3.2078 -3.2011 0.8116 0.8127 0.9986 1.0044 1.3723 1.3847 2.7629 2.7670 3.2122 3.2225 3.5748 3.5993 3.8043 3.8147 3.8933 3.9564 4.1773 4.1841 4.3115 4.3140 4.4835 4.5044 4.6907 4.7623 5.0281 5.0708 5.2929 5.3933 5.4761 5.6266 7.8818 8.0546 8.1016 8.1462 8.2247 8.2807 8.8962 8.9509 9.1398 9.3175 9.3906 9.4874 9.5464 9.6370 9.7865 10.0202 k = 0.0000 0.0000 0.3801 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1708 -6.1637 -5.8400 -5.8058 -5.7865 -5.7712 -5.7631 -5.6527 -5.5135 -5.5082 -5.5071 -5.5030 -5.4666 -5.4553 -5.4156 -5.3357 -5.3215 -5.2505 -5.2490 -5.1652 -3.3719 -3.3693 -3.3545 -3.3533 -3.3270 -3.3089 -3.3077 -3.2950 -3.2925 -3.2819 -3.2779 -3.2764 -3.2601 -3.2338 -3.2318 -3.2246 -3.2075 -3.2006 0.8365 0.8376 1.0218 1.0283 1.3784 1.3917 2.7935 2.7988 3.2110 3.2210 3.5496 3.5708 3.7969 3.8093 3.9084 3.9730 4.1905 4.1970 4.2884 4.2935 4.4182 4.4494 4.6488 4.7264 4.9626 5.0041 5.2858 5.3827 5.4267 5.5814 7.9328 8.0781 8.1233 8.1962 8.2583 8.3184 8.8641 8.9297 9.1619 9.3024 9.3357 9.4992 9.5254 9.6617 9.8148 10.0635 k = 0.0000 0.0000 0.3590 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1838 -6.1776 -5.8369 -5.8079 -5.7896 -5.7716 -5.7584 -5.6529 -5.5140 -5.5091 -5.5083 -5.5055 -5.4646 -5.4549 -5.4084 -5.3264 -5.3196 -5.2506 -5.2452 -5.1631 -3.3722 -3.3695 -3.3567 -3.3552 -3.3257 -3.3077 -3.3073 -3.2938 -3.2922 -3.2801 -3.2752 -3.2747 -3.2600 -3.2341 -3.2307 -3.2235 -3.2072 -3.2003 0.8632 0.8641 1.0468 1.0541 1.3849 1.3989 2.8261 2.8328 3.2113 3.2209 3.5257 3.5434 3.7871 3.8015 3.9241 3.9904 4.1969 4.2068 4.2658 4.2710 4.3541 4.3976 4.6050 4.6884 4.8934 4.9332 5.2759 5.3695 5.3813 5.5375 7.9840 8.1034 8.1491 8.2431 8.2959 8.3613 8.8307 8.9065 9.1826 9.2782 9.2810 9.5111 9.5122 9.6869 9.8413 10.1009 k = 0.0000 0.0000 0.3379 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1967 -6.1914 -5.8338 -5.8099 -5.7927 -5.7716 -5.7543 -5.6543 -5.5144 -5.5100 -5.5094 -5.5076 -5.4627 -5.4546 -5.4007 -5.3173 -5.3170 -5.2504 -5.2417 -5.1616 -3.3725 -3.3698 -3.3588 -3.3571 -3.3241 -3.3069 -3.3067 -3.2926 -3.2920 -3.2785 -3.2731 -3.2728 -3.2596 -3.2344 -3.2298 -3.2225 -3.2068 -3.2001 0.8913 0.8921 1.0736 1.0815 1.3917 1.4063 2.8605 2.8689 3.2132 3.2223 3.5032 3.5172 3.7749 3.7912 3.9395 4.0078 4.1889 4.2126 4.2474 4.2514 4.2920 4.3495 4.5599 4.6485 4.8211 4.8587 5.2638 5.3411 5.3542 5.4958 8.0330 8.1301 8.1790 8.2866 8.3377 8.4077 8.7966 8.8815 9.1958 9.2200 9.2604 9.5062 9.5230 9.7121 9.8679 10.1316 k = 0.0000 0.0000 0.3167 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2094 -6.2049 -5.8309 -5.8120 -5.7955 -5.7712 -5.7508 -5.6568 -5.5148 -5.5109 -5.5104 -5.5093 -5.4610 -5.4542 -5.3923 -5.3136 -5.3086 -5.2497 -5.2384 -5.1609 -3.3728 -3.3702 -3.3608 -3.3589 -3.3220 -3.3064 -3.3059 -3.2917 -3.2913 -3.2772 -3.2714 -3.2705 -3.2589 -3.2347 -3.2291 -3.2214 -3.2063 -3.2000 0.9206 0.9213 1.1019 1.1104 1.3988 1.4138 2.8964 2.9069 3.2170 3.2253 3.4824 3.4925 3.7605 3.7786 3.9536 4.0248 4.1637 4.2072 4.2273 4.2344 4.2483 4.3056 4.5140 4.6073 4.7468 4.7817 5.2498 5.3067 5.3376 5.4571 8.0782 8.1576 8.2121 8.3273 8.3835 8.4554 8.7626 8.8552 9.1623 9.1833 9.2612 9.5060 9.5353 9.7369 9.8953 10.1562 k = 0.0000 0.0000 0.2956 ( 8372 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2217 -6.2180 -5.8282 -5.8139 -5.7977 -5.7706 -5.7479 -5.6603 -5.5151 -5.5119 -5.5113 -5.5106 -5.4593 -5.4539 -5.3835 -5.3096 -5.3003 -5.2489 -5.2354 -5.1610 -3.3731 -3.3706 -3.3627 -3.3607 -3.3196 -3.3059 -3.3053 -3.2913 -3.2900 -3.2760 -3.2697 -3.2686 -3.2579 -3.2350 -3.2286 -3.2204 -3.2059 -3.2000 0.9508 0.9514 1.1316 1.1407 1.4061 1.4212 2.9335 2.9463 3.2228 3.2301 3.4635 3.4696 3.7439 3.7634 3.9649 4.0409 4.1306 4.1715 4.1863 4.2249 4.2448 4.2695 4.4673 4.5652 4.6717 4.7039 5.2341 5.2788 5.3203 5.4217 8.1189 8.1853 8.2474 8.3659 8.4323 8.5019 8.7296 8.8278 9.1065 9.1499 9.2815 9.5097 9.5489 9.7607 9.9239 10.1755 k = 0.0000 0.0000 0.2745 ( 8377 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2336 -6.2306 -5.8259 -5.8158 -5.7993 -5.7698 -5.7455 -5.6647 -5.5155 -5.5129 -5.5122 -5.5117 -5.4579 -5.4535 -5.3741 -5.3050 -5.2925 -5.2477 -5.2328 -5.1618 -3.3734 -3.3710 -3.3644 -3.3624 -3.3169 -3.3054 -3.3047 -3.2908 -3.2886 -3.2751 -3.2680 -3.2668 -3.2567 -3.2353 -3.2282 -3.2194 -3.2053 -3.2001 0.9816 0.9821 1.1625 1.1721 1.4134 1.4286 2.9714 2.9870 3.2306 3.2367 3.4466 3.4485 3.7252 3.7457 3.9711 4.0555 4.0971 4.1180 4.1551 4.2181 4.2205 4.2592 4.4199 4.5225 4.5976 4.6273 5.2176 5.2568 5.3029 5.3899 8.1553 8.2127 8.2832 8.4024 8.4815 8.5451 8.6994 8.7996 9.0538 9.1110 9.3083 9.5164 9.5644 9.7827 9.9541 10.1910 k = 0.0000 0.0000 0.2534 ( 8379 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2450 -6.2426 -5.8242 -5.8177 -5.7999 -5.7688 -5.7438 -5.6698 -5.5158 -5.5137 -5.5130 -5.5126 -5.4566 -5.4532 -5.3644 -5.3000 -5.2852 -5.2464 -5.2305 -5.1635 -3.3736 -3.3714 -3.3660 -3.3640 -3.3139 -3.3049 -3.3043 -3.2902 -3.2872 -3.2743 -3.2664 -3.2653 -3.2553 -3.2356 -3.2281 -3.2186 -3.2048 -3.2003 1.0126 1.0130 1.1944 1.2043 1.4207 1.4358 3.0097 3.0286 3.2405 3.2450 3.4297 3.4320 3.7044 3.7256 3.9681 4.0616 4.0684 4.0731 4.1224 4.1834 4.2123 4.2583 4.3706 4.4788 4.5274 4.5553 5.2016 5.2396 5.2859 5.3615 8.1883 8.2394 8.3179 8.4365 8.5252 8.5833 8.6765 8.7708 9.0057 9.0715 9.3384 9.5256 9.5821 9.8024 9.9861 10.2040 k = 0.0000 0.0000 0.2323 ( 8399 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2558 -6.2539 -5.8234 -5.8194 -5.7993 -5.7677 -5.7425 -5.6755 -5.5161 -5.5145 -5.5138 -5.5134 -5.4554 -5.4529 -5.3543 -5.2946 -5.2784 -5.2450 -5.2285 -5.1659 -3.3739 -3.3718 -3.3675 -3.3656 -3.3107 -3.3044 -3.3040 -3.2894 -3.2858 -3.2736 -3.2649 -3.2640 -3.2538 -3.2359 -3.2280 -3.2180 -3.2042 -3.2006 1.0434 1.0437 1.2269 1.2371 1.4280 1.4427 3.0482 3.0707 3.2527 3.2551 3.4134 3.4198 3.6817 3.7030 3.9524 4.0163 4.0467 4.0805 4.0883 4.1523 4.1977 4.2570 4.3171 4.4331 4.4648 4.4929 5.1874 5.2256 5.2698 5.3362 8.2187 8.2649 8.3501 8.4676 8.5509 8.6153 8.6720 8.7419 8.9636 9.0336 9.3712 9.5373 9.6022 9.8194 10.0201 10.2155 k = 0.0000 0.0000 0.2112 ( 8395 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2659 -6.2645 -5.8233 -5.8211 -5.7975 -5.7665 -5.7416 -5.6817 -5.5163 -5.5151 -5.5144 -5.5141 -5.4545 -5.4526 -5.3439 -5.2890 -5.2721 -5.2436 -5.2270 -5.1690 -3.3741 -3.3722 -3.3689 -3.3670 -3.3076 -3.3038 -3.3038 -3.2886 -3.2844 -3.2732 -3.2634 -3.2628 -3.2522 -3.2361 -3.2281 -3.2177 -3.2036 -3.2008 1.0736 1.0738 1.2597 1.2701 1.4350 1.4493 3.0862 3.1128 3.2666 3.2670 3.4002 3.4101 3.6574 3.6783 3.9267 3.9711 4.0262 4.0529 4.0889 4.1293 4.1740 4.2528 4.2591 4.3865 4.4133 4.4436 5.1759 5.2140 5.2549 5.3137 8.2471 8.2887 8.3790 8.4945 8.5487 8.6392 8.6941 8.7150 8.9287 8.9984 9.4063 9.5515 9.6242 9.8332 10.0561 10.2264 k = 0.0000 0.0000 0.1900 ( 8395 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2752 -6.2742 -5.8238 -5.8226 -5.7948 -5.7651 -5.7412 -5.6882 -5.5166 -5.5156 -5.5150 -5.5148 -5.4536 -5.4523 -5.3332 -5.2833 -5.2663 -5.2422 -5.2259 -5.1730 -3.3743 -3.3726 -3.3701 -3.3683 -3.3050 -3.3037 -3.3025 -3.2875 -3.2831 -3.2728 -3.2621 -3.2617 -3.2507 -3.2362 -3.2284 -3.2178 -3.2031 -3.2010 1.1027 1.1028 1.2923 1.3027 1.4419 1.4554 3.1234 3.1544 3.2792 3.2835 3.3906 3.4033 3.6320 3.6518 3.8969 3.9293 3.9996 4.0168 4.0940 4.1161 4.1384 4.1920 4.2513 4.3465 4.3735 4.4050 5.1670 5.2044 5.2414 5.2935 8.2740 8.3105 8.4036 8.5158 8.5312 8.6468 8.6997 8.7290 8.9014 8.9667 9.4432 9.5688 9.6474 9.8435 10.0941 10.2375 k = 0.0000 0.0000 0.1689 ( 8413 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.2838 -6.2830 -5.8246 -5.8240 -5.7914 -5.7637 -5.7412 -5.6950 -5.5168 -5.5160 -5.5156 -5.5153 -5.4530 -5.4520 -5.3225 -5.2775 -5.2610 -5.2408 -5.2253 -5.1776 -3.3745 -3.3729 -3.3712 -3.3695 -3.3041 -3.3036 -3.2997 -3.2864 -3.2819 -3.2727 -3.2610 -3.2607 -3.2491 -3.2363 -3.2288 -3.2183 -3.2025 -3.2011 1.1303 1.1304 1.3243 1.3344 1.4484 1.4610 3.1592 3.1947 3.2924 3.3019 3.3855 3.3993 3.6060 3.6240 3.8670 3.8911 3.9667 3.9805 4.0838 4.1035 4.1090 4.1250 4.2478 4.3182 4.3433 4.3731 5.1608 5.1964 5.2293 5.2754 8.2993 8.3298 8.4233 8.5104 8.5304 8.6291 8.7073 8.7642 8.8813 8.9391 9.4815 9.5891 9.6709 9.8502 10.1336 10.2494 k = 0.0000 0.0000 0.1478 ( 8393 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2914 -6.2910 -5.8256 -5.8253 -5.7874 -5.7621 -5.7415 -5.7020 -5.5170 -5.5164 -5.5160 -5.5158 -5.4524 -5.4518 -5.3116 -5.2717 -5.2563 -5.2395 -5.2251 -5.1830 -3.3747 -3.3733 -3.3721 -3.3706 -3.3038 -3.3035 -3.2963 -3.2852 -3.2807 -3.2726 -3.2599 -3.2598 -3.2475 -3.2363 -3.2292 -3.2192 -3.2019 -3.2011 1.1560 1.1560 1.3551 1.3647 1.4544 1.4660 3.1933 3.2326 3.3057 3.3218 3.3859 3.3985 3.5801 3.5955 3.8386 3.8568 3.9303 3.9442 4.0321 4.0567 4.1003 4.1059 4.2451 4.3000 4.3202 4.3461 5.1570 5.1899 5.2188 5.2590 8.3231 8.3464 8.4373 8.4918 8.5380 8.6022 8.7247 8.7949 8.8672 8.9158 9.5202 9.6125 9.6936 9.8530 10.1737 10.2623 k = 0.0000 0.0000 0.1267 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2982 -6.2979 -5.8265 -5.8264 -5.7830 -5.7605 -5.7421 -5.7090 -5.5171 -5.5167 -5.5164 -5.5163 -5.4520 -5.4516 -5.3007 -5.2661 -5.2522 -5.2384 -5.2255 -5.1891 -3.3748 -3.3736 -3.3729 -3.3716 -3.3036 -3.3035 -3.2930 -3.2839 -3.2798 -3.2728 -3.2591 -3.2590 -3.2459 -3.2362 -3.2297 -3.2206 -3.2014 -3.2009 1.1793 1.1793 1.3840 1.3928 1.4600 1.4703 3.2252 3.2659 3.3197 3.3424 3.3924 3.4010 3.5549 3.5672 3.8126 3.8262 3.8928 3.9085 3.9757 3.9930 4.0979 4.1014 4.2439 4.2886 4.3024 4.3233 5.1553 5.1849 5.2096 5.2442 8.3449 8.3599 8.4437 8.4794 8.5391 8.5751 8.7444 8.8195 8.8575 8.8966 9.5585 9.6381 9.7145 9.8519 10.2133 10.2766 k = 0.0000 0.0000 0.1056 ( 8399 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3040 -6.3038 -5.8274 -5.8273 -5.7783 -5.7587 -5.7429 -5.7161 -5.5172 -5.5169 -5.5168 -5.5166 -5.4516 -5.4514 -5.2898 -5.2606 -5.2485 -5.2375 -5.2263 -5.1959 -3.3749 -3.3739 -3.3736 -3.3725 -3.3035 -3.3034 -3.2898 -3.2826 -3.2789 -3.2731 -3.2583 -3.2583 -3.2442 -3.2361 -3.2304 -3.2223 -3.2010 -3.2007 1.1999 1.1999 1.4102 1.4181 1.4651 1.4739 3.2547 3.2913 3.3370 3.3624 3.4045 3.4074 3.5314 3.5401 3.7895 3.7995 3.8552 3.8730 3.9225 3.9354 4.0940 4.0961 4.2444 4.2811 4.2885 4.3043 5.1556 5.1812 5.2018 5.2306 8.3634 8.3701 8.4420 8.4761 8.5348 8.5514 8.7647 8.8377 8.8508 8.8812 9.5960 9.6649 9.7326 9.8467 10.2510 10.2921 k = 0.0000 0.0000 0.0845 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3088 -6.3087 -5.8282 -5.8281 -5.7732 -5.7570 -5.7440 -5.7231 -5.5174 -5.5171 -5.5170 -5.5169 -5.4513 -5.4512 -5.2790 -5.2554 -5.2454 -5.2369 -5.2277 -5.2032 -3.3750 -3.3742 -3.3741 -3.3732 -3.3035 -3.3034 -3.2868 -3.2814 -3.2782 -3.2736 -3.2577 -3.2577 -3.2424 -3.2358 -3.2310 -3.2243 -3.2006 -3.2005 1.2173 1.2173 1.4332 1.4399 1.4695 1.4767 3.2812 3.3075 3.3582 3.3793 3.4185 3.4206 3.5103 3.5152 3.7693 3.7766 3.8182 3.8364 3.8778 3.8868 4.0891 4.0902 4.2465 4.2758 4.2778 4.2890 5.1576 5.1787 5.1952 5.2183 8.3766 8.3768 8.4403 8.4774 8.5240 8.5346 8.7844 8.8464 8.8494 8.8692 9.6323 9.6910 9.7471 9.8373 10.2849 10.3083 k = 0.0000 0.0000 0.0633 ( 8405 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3125 -6.3125 -5.8288 -5.8287 -5.7678 -5.7552 -5.7453 -5.7301 -5.5174 -5.5173 -5.5172 -5.5172 -5.4511 -5.4511 -5.2684 -5.2505 -5.2428 -5.2366 -5.2295 -5.2112 -3.3750 -3.3744 -3.3744 -3.3738 -3.3035 -3.3034 -3.2841 -3.2802 -3.2778 -3.2743 -3.2573 -3.2573 -3.2404 -3.2354 -3.2317 -3.2265 -3.2003 -3.2003 1.2312 1.2312 1.4522 1.4574 1.4732 1.4787 3.3042 3.3188 3.3784 3.3913 3.4337 3.4383 3.4927 3.4943 3.7523 3.7574 3.7829 3.7988 3.8451 3.8497 4.0839 4.0844 4.2496 4.2697 4.2717 4.2772 5.1611 5.1773 5.1897 5.2070 8.3805 8.3822 8.4456 8.4792 8.5099 8.5234 8.8029 8.8437 8.8554 8.8601 9.6671 9.7146 9.7575 9.8237 10.3133 10.3240 k = 0.0000 0.0000 0.0422 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3152 -6.3152 -5.8292 -5.8292 -5.7621 -5.7534 -5.7467 -5.7369 -5.5175 -5.5174 -5.5174 -5.5173 -5.4510 -5.4510 -5.2580 -5.2459 -5.2407 -5.2366 -5.2318 -5.2197 -3.3750 -3.3747 -3.3746 -3.3742 -3.3034 -3.3034 -3.2817 -3.2793 -3.2776 -3.2753 -3.2570 -3.2570 -3.2383 -3.2349 -3.2324 -3.2289 -3.2001 -3.2001 1.2414 1.2414 1.4665 1.4701 1.4761 1.4799 3.3226 3.3282 3.3930 3.3981 3.4501 3.4547 3.4793 3.4797 3.7390 3.7424 3.7527 3.7645 3.8232 3.8247 4.0795 4.0796 4.2533 4.2642 4.2681 4.2687 5.1660 5.1770 5.1852 5.1967 8.3817 8.3827 8.4572 8.4808 8.4985 8.5120 8.8195 8.8426 8.8530 8.8563 9.7002 9.7345 9.7632 9.8061 10.3343 10.3377 k = 0.0000 0.0000 0.0211 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3168 -6.3168 -5.8295 -5.8295 -5.7561 -5.7516 -5.7483 -5.7435 -5.5175 -5.5175 -5.5174 -5.5174 -5.4509 -5.4509 -5.2479 -5.2417 -5.2390 -5.2370 -5.2347 -5.2286 -3.3749 -3.3748 -3.3747 -3.3746 -3.3034 -3.3034 -3.2797 -3.2785 -3.2776 -3.2765 -3.2568 -3.2568 -3.2361 -3.2344 -3.2331 -3.2313 -3.1999 -3.1999 1.2476 1.2476 1.4757 1.4776 1.4783 1.4802 3.3348 3.3356 3.3998 3.4007 3.4634 3.4663 3.4714 3.4722 3.7305 3.7322 3.7329 3.7394 3.8104 3.8105 4.0764 4.0764 4.2571 4.2613 4.2633 4.2646 5.1720 5.1776 5.1818 5.1875 8.3817 8.3818 8.4713 8.4828 8.4907 8.4994 8.8336 8.8429 8.8481 8.8525 9.7311 9.7496 9.7639 9.7845 10.3469 10.3474 k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3174 -6.3174 -5.8296 -5.8296 -5.7499 -5.7499 -5.7499 -5.7499 -5.5175 -5.5175 -5.5175 -5.5175 -5.4509 -5.4509 -5.2381 -5.2381 -5.2381 -5.2381 -5.2377 -5.2377 -3.3748 -3.3748 -3.3748 -3.3748 -3.3034 -3.3034 -3.2779 -3.2779 -3.2779 -3.2779 -3.2567 -3.2567 -3.2338 -3.2338 -3.2338 -3.2338 -3.1999 -3.1999 1.2496 1.2496 1.4796 1.4796 1.4796 1.4796 3.3389 3.3389 3.4012 3.4012 3.4696 3.4696 3.4696 3.4696 3.7281 3.7281 3.7281 3.7281 3.8060 3.8060 4.0753 4.0753 4.2609 4.2609 4.2609 4.2609 5.1792 5.1792 5.1792 5.1792 8.3814 8.3814 8.4857 8.4857 8.4857 8.4857 8.8447 8.8447 8.8447 8.8447 9.7594 9.7594 9.7594 9.7594 10.3510 10.3510 k = 0.0000 0.0000 0.0000 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3174 -6.3174 -5.8296 -5.8296 -5.7499 -5.7499 -5.7499 -5.7499 -5.5175 -5.5175 -5.5175 -5.5175 -5.4509 -5.4509 -5.2381 -5.2381 -5.2381 -5.2381 -5.2377 -5.2377 -3.3748 -3.3748 -3.3748 -3.3748 -3.3034 -3.3034 -3.2779 -3.2779 -3.2779 -3.2779 -3.2567 -3.2567 -3.2338 -3.2338 -3.2338 -3.2338 -3.1999 -3.1999 1.2496 1.2496 1.4796 1.4796 1.4796 1.4796 3.3389 3.3389 3.4012 3.4012 3.4696 3.4696 3.4696 3.4696 3.7281 3.7281 3.7281 3.7281 3.8060 3.8060 4.0753 4.0753 4.2609 4.2609 4.2609 4.2609 5.1792 5.1792 5.1792 5.1792 8.3814 8.3814 8.4857 8.4857 8.4857 8.4857 8.8447 8.8447 8.8447 8.8447 9.7594 9.7594 9.7594 9.7594 10.3510 10.3510 k = 0.0071 0.0101 0.0175 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3168 -6.3168 -5.8295 -5.8295 -5.7564 -5.7500 -5.7500 -5.7432 -5.5175 -5.5175 -5.5175 -5.5174 -5.4509 -5.4509 -5.2483 -5.2401 -5.2401 -5.2362 -5.2362 -5.2282 -3.3749 -3.3747 -3.3747 -3.3746 -3.3034 -3.3034 -3.2798 -3.2780 -3.2780 -3.2764 -3.2568 -3.2568 -3.2362 -3.2337 -3.2337 -3.2312 -3.1999 -3.1999 1.2475 1.2475 1.4764 1.4779 1.4779 1.4795 3.3351 3.3351 3.4002 3.4002 3.4629 3.4661 3.4721 3.4721 3.7310 3.7310 3.7334 3.7402 3.8106 3.8106 4.0765 4.0765 4.2568 4.2625 4.2625 4.2646 5.1717 5.1797 5.1797 5.1879 8.3817 8.3817 8.4704 8.4869 8.4869 8.5001 8.8329 8.8457 8.8457 8.8527 9.7300 9.7566 9.7566 9.7858 10.3471 10.3471 k = 0.0143 0.0202 0.0350 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3151 -6.3151 -5.8292 -5.8292 -5.7626 -5.7501 -5.7501 -5.7362 -5.5175 -5.5174 -5.5174 -5.5173 -5.4510 -5.4510 -5.2589 -5.2427 -5.2427 -5.2349 -5.2349 -5.2188 -3.3749 -3.3746 -3.3746 -3.3742 -3.3034 -3.3034 -3.2819 -3.2784 -3.2784 -3.2751 -3.2570 -3.2570 -3.2386 -3.2337 -3.2337 -3.2287 -3.2001 -3.2001 1.2411 1.2411 1.4699 1.4729 1.4729 1.4761 3.3250 3.3250 3.3953 3.3953 3.4487 3.4538 3.4808 3.4808 3.7389 3.7389 3.7551 3.7673 3.8246 3.8246 4.0796 4.0796 4.2523 4.2672 4.2672 4.2679 5.1653 5.1811 5.1811 5.1976 8.3822 8.3822 8.4541 8.4907 8.4907 8.5132 8.8176 8.8487 8.8487 8.8560 9.6989 9.7481 9.7481 9.8081 10.3356 10.3356 k = 0.0214 0.0303 0.0525 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3123 -6.3123 -5.8287 -5.8287 -5.7686 -5.7504 -5.7504 -5.7290 -5.5174 -5.5172 -5.5172 -5.5172 -5.4511 -5.4511 -5.2697 -5.2457 -5.2457 -5.2341 -5.2341 -5.2099 -3.3749 -3.3744 -3.3744 -3.3738 -3.3034 -3.3034 -3.2844 -3.2791 -3.2791 -3.2741 -3.2573 -3.2573 -3.2407 -3.2336 -3.2336 -3.2262 -3.2003 -3.2003 1.2308 1.2308 1.4605 1.4647 1.4647 1.4696 3.3106 3.3106 3.3846 3.3846 3.4305 3.4361 3.4972 3.4972 3.7499 3.7499 3.7895 3.8053 3.8486 3.8486 4.0840 4.0840 4.2474 4.2708 4.2754 4.2754 5.1602 5.1836 5.1836 5.2083 8.3815 8.3815 8.4370 8.4981 8.4981 8.5249 8.7996 8.8537 8.8537 8.8540 9.6677 9.7342 9.7342 9.8256 10.3177 10.3177 k = 0.0286 0.0404 0.0700 ( 8409 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.3085 -6.3085 -5.8281 -5.8281 -5.7741 -5.7507 -5.7507 -5.7217 -5.5173 -5.5171 -5.5170 -5.5170 -5.4513 -5.4513 -5.2807 -5.2492 -5.2492 -5.2338 -5.2338 -5.2015 -3.3747 -3.3741 -3.3741 -3.3733 -3.3035 -3.3035 -3.2872 -3.2799 -3.2799 -3.2733 -3.2578 -3.2578 -3.2427 -3.2335 -3.2335 -3.2238 -3.2006 -3.2006 1.2168 1.2168 1.4482 1.4535 1.4535 1.4600 3.2931 3.2931 3.3692 3.3692 3.4113 3.4164 3.5205 3.5205 3.7625 3.7625 3.8328 3.8508 3.8820 3.8820 4.0890 4.0890 4.2423 4.2734 4.2875 4.2875 5.1565 5.1871 5.1871 5.2201 8.3781 8.3781 8.4190 8.5101 8.5101 8.5347 8.7792 8.8457 8.8610 8.8610 9.6383 9.7153 9.7153 9.8380 10.2952 10.2952 k = 0.0357 0.0505 0.0875 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.3035 -6.3035 -5.8273 -5.8273 -5.7794 -5.7511 -5.7511 -5.7144 -5.5172 -5.5168 -5.5167 -5.5167 -5.4515 -5.4515 -5.2918 -5.2531 -5.2531 -5.2339 -5.2339 -5.1938 -3.3744 -3.3738 -3.3738 -3.3727 -3.3035 -3.3035 -3.2902 -3.2809 -3.2809 -3.2727 -3.2584 -3.2584 -3.2444 -3.2334 -3.2334 -3.2215 -3.2009 -3.2009 1.1995 1.1995 1.4334 1.4396 1.4396 1.4477 3.2728 3.2728 3.3513 3.3513 3.3926 3.3967 3.5491 3.5491 3.7767 3.7767 3.8826 3.9014 3.9235 3.9235 4.0935 4.0935 4.2370 4.2757 4.3039 4.3039 5.1544 5.1919 5.1919 5.2330 8.3710 8.3710 8.4000 8.5267 8.5267 8.5422 8.7571 8.8308 8.8708 8.8708 9.6122 9.6919 9.6919 9.8455 10.2696 10.2696 k = 0.0429 0.0606 0.1050 ( 8397 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2975 -6.2975 -5.8264 -5.8264 -5.7843 -5.7517 -5.7517 -5.7070 -5.5171 -5.5166 -5.5163 -5.5163 -5.4518 -5.4518 -5.3029 -5.2573 -5.2573 -5.2345 -5.2345 -5.1867 -3.3741 -3.3733 -3.3733 -3.3720 -3.3036 -3.3036 -3.2935 -3.2820 -3.2820 -3.2723 -3.2591 -3.2591 -3.2459 -3.2334 -3.2334 -3.2195 -3.2013 -3.2013 1.1795 1.1795 1.4163 1.4233 1.4233 1.4329 3.2496 3.2496 3.3334 3.3334 3.3754 3.3781 3.5818 3.5818 3.7926 3.7926 3.9368 3.9554 3.9712 3.9712 4.0972 4.0972 4.2317 4.2781 4.3248 4.3248 5.1542 5.1979 5.1979 5.2471 8.3597 8.3597 8.3797 8.5466 8.5472 8.5472 8.7338 8.8089 8.8838 8.8838 9.5909 9.6649 9.6649 9.8484 10.2423 10.2423 k = 0.0500 0.0707 0.1225 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2904 -6.2904 -5.8253 -5.8253 -5.7888 -5.7523 -5.7523 -5.6998 -5.5169 -5.5162 -5.5159 -5.5159 -5.4521 -5.4521 -5.3139 -5.2619 -5.2619 -5.2355 -5.2355 -5.1803 -3.3736 -3.3728 -3.3728 -3.3712 -3.3037 -3.3037 -3.2968 -3.2832 -3.2832 -3.2720 -3.2600 -3.2600 -3.2473 -3.2334 -3.2334 -3.2178 -3.2018 -3.2018 1.1571 1.1571 1.3975 1.4050 1.4050 1.4160 3.2232 3.2232 3.3172 3.3172 3.3600 3.3612 3.6172 3.6172 3.8105 3.8105 3.9940 4.0107 4.0232 4.0232 4.0999 4.0999 4.2267 4.2814 4.3503 4.3503 5.1559 5.2054 5.2054 5.2626 8.3444 8.3444 8.3579 8.5467 8.5700 8.5700 8.7105 8.7804 8.9006 8.9006 9.5751 9.6352 9.6352 9.8476 10.2145 10.2145 k = 0.0571 0.0808 0.1400 ( 8400 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2825 -6.2825 -5.8241 -5.8241 -5.7930 -5.7531 -5.7531 -5.6928 -5.5167 -5.5158 -5.5155 -5.5155 -5.4525 -5.4525 -5.3247 -5.2667 -5.2667 -5.2369 -5.2369 -5.1746 -3.3730 -3.3722 -3.3722 -3.3703 -3.3038 -3.3038 -3.3003 -3.2845 -3.2845 -3.2718 -3.2610 -3.2610 -3.2484 -3.2336 -3.2336 -3.2163 -3.2022 -3.2022 1.1331 1.1331 1.3771 1.3850 1.3850 1.3973 3.1940 3.1940 3.3035 3.3035 3.3463 3.3466 3.6541 3.6541 3.8306 3.8306 4.0520 4.0648 4.0745 4.0745 4.1055 4.1055 4.2233 4.2870 4.3806 4.3806 5.1599 5.2145 5.2145 5.2794 8.3252 8.3252 8.3341 8.5409 8.5930 8.5930 8.6889 8.7465 8.9221 8.9221 9.5652 9.6040 9.6040 9.8438 10.1870 10.1870 k = 0.0643 0.0909 0.1575 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2735 -6.2735 -5.8228 -5.8228 -5.7968 -5.7539 -5.7539 -5.6860 -5.5164 -5.5154 -5.5149 -5.5149 -5.4530 -5.4530 -5.3352 -5.2719 -5.2719 -5.2387 -5.2387 -5.1696 -3.3724 -3.3715 -3.3715 -3.3693 -3.3040 -3.3040 -3.3037 -3.2858 -3.2858 -3.2717 -3.2621 -3.2621 -3.2495 -3.2339 -3.2339 -3.2151 -3.2027 -3.2027 1.1078 1.1078 1.3556 1.3638 1.3638 1.3772 3.1627 3.1627 3.2924 3.2924 3.3334 3.3351 3.6912 3.6912 3.8528 3.8528 4.0926 4.0926 4.1066 4.1137 4.1455 4.1455 4.2249 4.2982 4.4157 4.4157 5.1663 5.2253 5.2253 5.2976 8.3024 8.3024 8.3078 8.5272 8.6143 8.6143 8.6709 8.7087 8.9491 8.9491 9.5609 9.5723 9.5724 9.8380 10.1602 10.1602 k = 0.0714 0.1010 0.1750 ( 8373 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2638 -6.2638 -5.8215 -5.8215 -5.8003 -5.7549 -5.7549 -5.6798 -5.5161 -5.5148 -5.5143 -5.5143 -5.4535 -5.4535 -5.3452 -5.2773 -5.2773 -5.2409 -5.2409 -5.1655 -3.3716 -3.3707 -3.3707 -3.3683 -3.3070 -3.3043 -3.3043 -3.2870 -3.2870 -3.2717 -3.2634 -3.2634 -3.2504 -3.2343 -3.2343 -3.2143 -3.2032 -3.2032 1.0818 1.0818 1.3334 1.3416 1.3416 1.3561 3.1300 3.1300 3.2837 3.2837 3.3223 3.3255 3.7275 3.7275 3.8769 3.8769 4.0921 4.0921 4.1462 4.1515 4.2045 4.2045 4.2421 4.3202 4.4556 4.4556 5.1753 5.2379 5.2379 5.3175 8.2762 8.2762 8.2784 8.5049 8.6322 8.6322 8.6577 8.6690 8.9821 8.9821 9.5414 9.5414 9.5616 9.8311 10.1344 10.1344 k = 0.0786 0.1111 0.1925 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2532 -6.2532 -5.8201 -5.8201 -5.8034 -5.7559 -5.7559 -5.6741 -5.5158 -5.5141 -5.5136 -5.5136 -5.4541 -5.4541 -5.3545 -5.2830 -5.2830 -5.2433 -5.2433 -5.1622 -3.3708 -3.3698 -3.3698 -3.3672 -3.3101 -3.3047 -3.3047 -3.2881 -3.2881 -3.2718 -3.2647 -3.2647 -3.2512 -3.2349 -3.2349 -3.2138 -3.2036 -3.2036 1.0554 1.0554 1.3107 1.3188 1.3188 1.3343 3.0969 3.0969 3.2771 3.2771 3.3131 3.3177 3.7621 3.7621 3.9024 3.9024 4.0893 4.0893 4.1599 4.1734 4.2657 4.2657 4.2852 4.3566 4.5004 4.5004 5.1869 5.2523 5.2523 5.3389 8.2455 8.2470 8.2470 8.4750 8.6297 8.6459 8.6459 8.6486 9.0207 9.0207 9.5122 9.5122 9.5666 9.8236 10.1097 10.1097 k = 0.0857 0.1212 0.2100 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2419 -6.2419 -5.8187 -5.8187 -5.8061 -5.7570 -5.7570 -5.6692 -5.5154 -5.5133 -5.5128 -5.5128 -5.4549 -5.4549 -5.3631 -5.2888 -5.2888 -5.2461 -5.2461 -5.1596 -3.3699 -3.3688 -3.3688 -3.3661 -3.3131 -3.3052 -3.3052 -3.2891 -3.2891 -3.2720 -3.2662 -3.2662 -3.2520 -3.2357 -3.2357 -3.2137 -3.2040 -3.2040 1.0292 1.0292 1.2879 1.2957 1.2958 1.3121 3.0640 3.0640 3.2723 3.2723 3.3056 3.3115 3.7943 3.7943 3.9286 3.9286 4.0858 4.0858 4.1588 4.1817 4.3271 4.3271 4.3424 4.4048 4.5502 4.5502 5.2011 5.2685 5.2685 5.3618 8.2090 8.2152 8.2152 8.4393 8.5925 8.6424 8.6550 8.6550 9.0637 9.0637 9.4853 9.4853 9.5751 9.8161 10.0861 10.0861 k = 0.0929 0.1313 0.2275 ( 8373 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2299 -6.2299 -5.8173 -5.8173 -5.8085 -5.7583 -5.7582 -5.6652 -5.5151 -5.5124 -5.5119 -5.5119 -5.4557 -5.4557 -5.3708 -5.2948 -5.2948 -5.2491 -5.2491 -5.1580 -3.3689 -3.3678 -3.3678 -3.3649 -3.3157 -3.3059 -3.3059 -3.2900 -3.2900 -3.2722 -3.2677 -3.2677 -3.2527 -3.2366 -3.2366 -3.2138 -3.2045 -3.2045 1.0035 1.0035 1.2652 1.2727 1.2727 1.2898 3.0317 3.0317 3.2692 3.2692 3.2996 3.3068 3.8237 3.8237 3.9544 3.9544 4.0826 4.0826 4.1523 4.1813 4.3878 4.3878 4.4036 4.4591 4.6047 4.6047 5.2179 5.2864 5.2864 5.3860 8.1692 8.1817 8.1817 8.4002 8.5587 8.6378 8.6601 8.6601 9.1091 9.1091 9.4615 9.4615 9.5862 9.8089 10.0635 10.0635 k = 0.1000 0.1414 0.2449 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2174 -6.2174 -5.8160 -5.8160 -5.8106 -5.7595 -5.7595 -5.6623 -5.5147 -5.5114 -5.5110 -5.5110 -5.4565 -5.4565 -5.3773 -5.3009 -5.3009 -5.2522 -5.2522 -5.1571 -3.3679 -3.3666 -3.3666 -3.3637 -3.3180 -3.3067 -3.3067 -3.2907 -3.2907 -3.2725 -3.2693 -3.2693 -3.2534 -3.2376 -3.2376 -3.2143 -3.2049 -3.2049 0.9785 0.9785 1.2430 1.2500 1.2500 1.2676 3.0006 3.0006 3.2674 3.2674 3.2949 3.3034 3.8499 3.8499 3.9781 3.9781 4.0816 4.0816 4.1435 4.1758 4.4469 4.4469 4.4650 4.5154 4.6635 4.6635 5.2369 5.3057 5.3057 5.4111 8.1273 8.1472 8.1472 8.3593 8.5291 8.6340 8.6617 8.6617 9.1542 9.1542 9.4411 9.4411 9.5993 9.8020 10.0420 10.0420 k = 0.1071 0.1515 0.2624 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.2044 -6.2044 -5.8148 -5.8148 -5.8124 -5.7608 -5.7608 -5.6607 -5.5142 -5.5103 -5.5099 -5.5099 -5.4575 -5.4575 -5.3825 -5.3072 -5.3072 -5.2555 -5.2555 -5.1571 -3.3667 -3.3654 -3.3654 -3.3625 -3.3198 -3.3076 -3.3076 -3.2913 -3.2913 -3.2729 -3.2710 -3.2710 -3.2541 -3.2388 -3.2388 -3.2151 -3.2053 -3.2053 0.9547 0.9547 1.2213 1.2278 1.2278 1.2459 2.9709 2.9709 3.2668 3.2668 3.2915 3.3011 3.8726 3.8726 3.9967 3.9967 4.0859 4.0859 4.1334 4.1670 4.5040 4.5040 4.5252 4.5715 4.7262 4.7262 5.2576 5.3258 5.3258 5.4367 8.0849 8.1129 8.1129 8.3182 8.5036 8.6307 8.6608 8.6608 9.1954 9.1954 9.4249 9.4249 9.6137 9.7952 10.0216 10.0216 k = 0.1143 0.1616 0.2799 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1910 -6.1910 -5.8139 -5.8138 -5.8138 -5.7621 -5.7621 -5.6604 -5.5138 -5.5091 -5.5088 -5.5088 -5.4586 -5.4586 -5.3863 -5.3135 -5.3135 -5.2589 -5.2589 -5.1579 -3.3655 -3.3641 -3.3641 -3.3613 -3.3213 -3.3086 -3.3086 -3.2918 -3.2918 -3.2734 -3.2727 -3.2727 -3.2547 -3.2400 -3.2400 -3.2162 -3.2057 -3.2057 0.9322 0.9322 1.2004 1.2062 1.2062 1.2248 2.9430 2.9430 3.2672 3.2672 3.2890 3.2998 3.8914 3.8914 4.0067 4.0067 4.0995 4.0995 4.1224 4.1559 4.5586 4.5586 4.5834 4.6261 4.7919 4.7919 5.2795 5.3463 5.3463 5.4619 8.0440 8.0801 8.0801 8.2785 8.4820 8.6277 8.6579 8.6579 9.2285 9.2285 9.4142 9.4142 9.6289 9.7882 10.0024 10.0024 k = 0.1214 0.1717 0.2974 ( 8379 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1773 -6.1773 -5.8150 -5.8129 -5.8129 -5.7633 -5.7633 -5.6615 -5.5133 -5.5080 -5.5076 -5.5076 -5.4597 -5.4597 -5.3886 -5.3198 -5.3198 -5.2622 -5.2622 -5.1596 -3.3643 -3.3627 -3.3627 -3.3601 -3.3223 -3.3096 -3.3096 -3.2923 -3.2923 -3.2744 -3.2744 -3.2739 -3.2554 -3.2413 -3.2413 -3.2175 -3.2061 -3.2061 0.9113 0.9113 1.1804 1.1855 1.1855 1.2044 2.9171 2.9171 3.2684 3.2684 3.2876 3.2994 3.9063 3.9063 4.0084 4.0084 4.1108 4.1226 4.1226 4.1432 4.6103 4.6103 4.6391 4.6785 4.8596 4.8596 5.3017 5.3663 5.3663 5.4859 8.0068 8.0501 8.0501 8.2415 8.4638 8.6252 8.6538 8.6538 9.2487 9.2487 9.4104 9.4104 9.6444 9.7808 9.9846 9.9846 k = 0.1286 0.1818 0.3149 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1635 -6.1635 -5.8159 -5.8123 -5.8123 -5.7645 -5.7645 -5.6640 -5.5127 -5.5068 -5.5064 -5.5064 -5.4610 -5.4610 -5.3893 -5.3261 -5.3261 -5.2656 -5.2656 -5.1620 -3.3630 -3.3612 -3.3612 -3.3589 -3.3228 -3.3107 -3.3107 -3.2927 -3.2927 -3.2761 -3.2761 -3.2745 -3.2560 -3.2426 -3.2426 -3.2191 -3.2065 -3.2065 0.8921 0.8921 1.1614 1.1657 1.1657 1.1848 2.8934 2.8934 3.2703 3.2703 3.2868 3.2997 3.9169 3.9169 4.0050 4.0050 4.0988 4.1293 4.1524 4.1524 4.6589 4.6589 4.6920 4.7285 4.9283 4.9283 5.3231 5.3850 5.3850 5.5075 7.9754 8.0243 8.0243 8.2084 8.4484 8.6232 8.6490 8.6490 9.2538 9.2538 9.4127 9.4127 9.6597 9.7725 9.9686 9.9686 k = 0.1357 0.1919 0.3324 ( 8397 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1497 -6.1497 -5.8165 -5.8118 -5.8118 -5.7657 -5.7657 -5.6678 -5.5122 -5.5058 -5.5050 -5.5050 -5.4622 -5.4622 -5.3885 -5.3324 -5.3324 -5.2688 -5.2688 -5.1652 -3.3616 -3.3597 -3.3597 -3.3577 -3.3228 -3.3118 -3.3118 -3.2932 -3.2932 -3.2778 -3.2778 -3.2752 -3.2566 -3.2439 -3.2439 -3.2208 -3.2070 -3.2070 0.8749 0.8749 1.1435 1.1469 1.1469 1.1662 2.8720 2.8720 3.2727 3.2727 3.2868 3.3005 3.9236 3.9236 3.9993 3.9993 4.0864 4.1145 4.1864 4.1864 4.7044 4.7044 4.7419 4.7757 4.9967 4.9967 5.3427 5.4016 5.4016 5.5256 7.9516 8.0040 8.0040 8.1804 8.4355 8.6219 8.6439 8.6439 9.2458 9.2458 9.4169 9.4169 9.6746 9.7630 9.9547 9.9547 k = 0.1429 0.2020 0.3499 ( 8379 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1360 -6.1360 -5.8168 -5.8116 -5.8116 -5.7667 -5.7667 -5.6728 -5.5116 -5.5049 -5.5036 -5.5036 -5.4635 -5.4635 -5.3862 -5.3385 -5.3385 -5.2719 -5.2719 -5.1691 -3.3601 -3.3580 -3.3580 -3.3565 -3.3223 -3.3129 -3.3129 -3.2936 -3.2936 -3.2795 -3.2795 -3.2759 -3.2573 -3.2452 -3.2452 -3.2228 -3.2075 -3.2075 0.8598 0.8598 1.1267 1.1292 1.1292 1.1486 2.8530 2.8530 3.2756 3.2756 3.2872 3.3018 3.9264 3.9264 3.9928 3.9928 4.0738 4.0992 4.2233 4.2233 4.7469 4.7469 4.7889 4.8203 5.0634 5.0634 5.3595 5.4153 5.4153 5.5390 7.9372 7.9904 7.9904 8.1584 8.4247 8.6216 8.6390 8.6390 9.2286 9.2286 9.4183 9.4183 9.6887 9.7520 9.9425 9.9425 k = 0.1500 0.2121 0.3674 ( 8397 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.1225 -6.1225 -5.8168 -5.8116 -5.8116 -5.7676 -5.7676 -5.6789 -5.5110 -5.5041 -5.5022 -5.5022 -5.4648 -5.4648 -5.3826 -5.3446 -5.3446 -5.2749 -5.2749 -5.1738 -3.3587 -3.3564 -3.3564 -3.3554 -3.3214 -3.3140 -3.3140 -3.2942 -3.2942 -3.2811 -3.2811 -3.2767 -3.2579 -3.2464 -3.2464 -3.2249 -3.2081 -3.2081 0.8469 0.8469 1.1110 1.1126 1.1126 1.1319 2.8365 2.8365 3.2787 3.2787 3.2881 3.3034 3.9257 3.9257 3.9862 3.9862 4.0611 4.0835 4.2625 4.2625 4.7864 4.7864 4.8329 4.8623 5.1269 5.1269 5.3724 5.4258 5.4258 5.5467 7.9332 7.9842 7.9842 8.1430 8.4157 8.6225 8.6346 8.6346 9.2052 9.2052 9.4146 9.4146 9.7018 9.7396 9.9309 9.9309 k = 0.1571 0.2222 0.3849 ( 8412 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -6.1094 -6.1094 -5.8166 -5.8117 -5.8117 -5.7684 -5.7684 -5.6858 -5.5103 -5.5035 -5.5008 -5.5008 -5.4659 -5.4659 -5.3779 -5.3505 -5.3505 -5.2776 -5.2776 -5.1791 -3.3572 -3.3546 -3.3546 -3.3542 -3.3200 -3.3150 -3.3150 -3.2948 -3.2948 -3.2827 -3.2827 -3.2776 -3.2585 -3.2475 -3.2475 -3.2271 -3.2086 -3.2086 0.8363 0.8363 1.0964 1.0971 1.0971 1.1163 2.8225 2.8225 3.2820 3.2820 3.2893 3.3052 3.9222 3.9222 3.9798 3.9798 4.0484 4.0677 4.3035 4.3035 4.8230 4.8230 4.8740 4.9018 5.1853 5.1853 5.3809 5.4333 5.4333 5.5482 7.9402 7.9860 7.9860 8.1346 8.4086 8.6250 8.6311 8.6311 9.1775 9.1775 9.4057 9.4057 9.7135 9.7259 9.9186 9.9186 k = 0.1643 0.2323 0.4024 ( 8424 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -6.0969 -6.0969 -5.8162 -5.8120 -5.8120 -5.7691 -5.7691 -5.6935 -5.5097 -5.5030 -5.4994 -5.4994 -5.4669 -5.4669 -5.3723 -5.3562 -5.3562 -5.2801 -5.2801 -5.1850 -3.3556 -3.3531 -3.3528 -3.3528 -3.3183 -3.3161 -3.3161 -3.2956 -3.2956 -3.2841 -3.2841 -3.2786 -3.2591 -3.2486 -3.2486 -3.2293 -3.2092 -3.2092 0.8282 0.8282 1.0826 1.0826 1.0829 1.1016 2.8109 2.8109 3.2853 3.2853 3.2907 3.3070 3.9166 3.9166 3.9736 3.9736 4.0359 4.0520 4.3458 4.3458 4.8566 4.8566 4.9123 4.9387 5.2362 5.2362 5.3846 5.4391 5.4391 5.5432 7.9585 7.9956 7.9956 8.1330 8.4034 8.6289 8.6289 8.6294 9.1471 9.1471 9.3924 9.3924 9.7111 9.7238 9.9043 9.9043 k = 0.1714 0.2424 0.4199 ( 8418 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -6.0851 -6.0851 -5.8156 -5.8122 -5.8122 -5.7698 -5.7698 -5.7018 -5.5090 -5.5025 -5.4981 -5.4981 -5.4677 -5.4677 -5.3658 -5.3616 -5.3616 -5.2824 -5.2824 -5.1915 -3.3541 -3.3519 -3.3510 -3.3510 -3.3171 -3.3171 -3.3162 -3.2964 -3.2964 -3.2854 -3.2854 -3.2796 -3.2597 -3.2495 -3.2495 -3.2316 -3.2099 -3.2099 0.8226 0.8226 1.0691 1.0691 1.0703 1.0879 2.8017 2.8017 3.2886 3.2886 3.2923 3.3088 3.9095 3.9095 3.9675 3.9675 4.0237 4.0367 4.3894 4.3894 4.8871 4.8871 4.9476 4.9730 5.2761 5.2761 5.3836 5.4459 5.4459 5.5320 7.9872 8.0127 8.0127 8.1377 8.4003 8.6283 8.6283 8.6359 9.1156 9.1156 9.3754 9.3754 9.6960 9.7326 9.8872 9.8872 k = 0.1786 0.2525 0.4374 ( 8424 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -6.0741 -6.0741 -5.8147 -5.8123 -5.8123 -5.7704 -5.7704 -5.7105 -5.5082 -5.5021 -5.4971 -5.4971 -5.4682 -5.4682 -5.3668 -5.3668 -5.3589 -5.2843 -5.2843 -5.1985 -3.3525 -3.3506 -3.3492 -3.3492 -3.3181 -3.3181 -3.3139 -3.2973 -3.2973 -3.2866 -3.2866 -3.2807 -3.2603 -3.2503 -3.2503 -3.2340 -3.2105 -3.2105 0.8196 0.8196 1.0564 1.0564 1.0587 1.0749 2.7947 2.7947 3.2918 3.2918 3.2940 3.3105 3.9015 3.9015 3.9613 3.9613 4.0117 4.0219 4.4337 4.4337 4.9142 4.9143 4.9798 5.0041 5.3016 5.3016 5.3786 5.4570 5.4570 5.5154 8.0249 8.0363 8.0363 8.1476 8.3998 8.6298 8.6298 8.6449 9.0844 9.0844 9.3551 9.3551 9.6812 9.7398 9.8672 9.8672 k = 0.1857 0.2626 0.4549 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0641 -6.0641 -5.8137 -5.8122 -5.8122 -5.7710 -5.7710 -5.7195 -5.5075 -5.5018 -5.4963 -5.4963 -5.4683 -5.4683 -5.3716 -5.3716 -5.3515 -5.2860 -5.2860 -5.2060 -3.3509 -3.3493 -3.3473 -3.3473 -3.3192 -3.3192 -3.3113 -3.2982 -3.2982 -3.2877 -3.2877 -3.2818 -3.2608 -3.2510 -3.2510 -3.2363 -3.2111 -3.2111 0.8193 0.8193 1.0445 1.0445 1.0478 1.0625 2.7898 2.7898 3.2949 3.2949 3.2958 3.3119 3.8932 3.8932 3.9553 3.9553 4.0002 4.0077 4.4787 4.4787 4.9375 4.9375 5.0086 5.0316 5.3120 5.3120 5.3707 5.4734 5.4734 5.4948 8.0650 8.0650 8.0693 8.1615 8.4031 8.6341 8.6341 8.6565 9.0547 9.0548 9.3312 9.3312 9.6678 9.7456 9.8452 9.8452 k = 0.1929 0.2727 0.4724 ( 8415 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -6.0552 -6.0552 -5.8124 -5.8118 -5.8118 -5.7717 -5.7717 -5.7286 -5.5067 -5.5015 -5.4959 -5.4959 -5.4679 -5.4679 -5.3761 -5.3761 -5.3438 -5.2874 -5.2874 -5.2139 -3.3492 -3.3480 -3.3455 -3.3455 -3.3204 -3.3204 -3.3086 -3.2991 -3.2991 -3.2887 -3.2887 -3.2830 -3.2612 -3.2517 -3.2517 -3.2386 -3.2118 -3.2118 0.8218 0.8218 1.0332 1.0332 1.0375 1.0508 2.7868 2.7868 3.2975 3.2977 3.2977 3.3131 3.8848 3.8848 3.9495 3.9495 3.9892 3.9945 4.5239 4.5239 4.9562 4.9562 5.0331 5.0542 5.3117 5.3117 5.3619 5.4720 5.4918 5.4918 8.0969 8.0969 8.1168 8.1779 8.4120 8.6415 8.6415 8.6709 9.0277 9.0277 9.3028 9.3028 9.6567 9.7500 9.8224 9.8224 k = 0.2000 0.2828 0.4899 ( 8433 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -6.0475 -6.0475 -5.8110 -5.8110 -5.8110 -5.7725 -5.7725 -5.7377 -5.5059 -5.5012 -5.4958 -5.4958 -5.4671 -5.4671 -5.3802 -5.3802 -5.3361 -5.2884 -5.2884 -5.2221 -3.3476 -3.3467 -3.3437 -3.3437 -3.3217 -3.3217 -3.3058 -3.2999 -3.2999 -3.2895 -3.2895 -3.2842 -3.2614 -3.2522 -3.2522 -3.2408 -3.2124 -3.2124 0.8271 0.8271 1.0223 1.0224 1.0277 1.0394 2.7854 2.7854 3.2992 3.3003 3.3003 3.3139 3.8766 3.8766 3.9440 3.9440 3.9789 3.9821 4.5690 4.5690 4.9695 4.9695 5.0525 5.0705 5.3067 5.3067 5.3545 5.4493 5.5077 5.5077 8.1301 8.1301 8.1626 8.1951 8.4297 8.6530 8.6530 8.6877 9.0041 9.0041 9.2687 9.2688 9.6493 9.7532 9.8007 9.8007 k = 0.2071 0.2929 0.5074 ( 8409 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0409 -6.0409 -5.8098 -5.8098 -5.8094 -5.7733 -5.7733 -5.7468 -5.5051 -5.5010 -5.4960 -5.4960 -5.4660 -5.4660 -5.3837 -5.3837 -5.3283 -5.2891 -5.2891 -5.2307 -3.3460 -3.3452 -3.3420 -3.3420 -3.3232 -3.3232 -3.3031 -3.3004 -3.3004 -3.2903 -3.2903 -3.2855 -3.2615 -3.2527 -3.2527 -3.2430 -3.2130 -3.2130 0.8353 0.8353 1.0118 1.0118 1.0181 1.0282 2.7854 2.7854 3.3009 3.3026 3.3026 3.3144 3.8689 3.8689 3.9390 3.9390 3.9692 3.9709 4.6134 4.6134 4.9766 4.9766 5.0653 5.0786 5.3017 5.3017 5.3514 5.4294 5.5183 5.5183 8.1625 8.1625 8.2011 8.2119 8.4597 8.6691 8.6691 8.7065 8.9842 8.9842 9.2281 9.2281 9.6466 9.7554 9.7822 9.7822 k = 0.2143 0.3030 0.5249 ( 8403 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0357 -6.0357 -5.8081 -5.8081 -5.8076 -5.7742 -5.7742 -5.7558 -5.5042 -5.5007 -5.4964 -5.4964 -5.4647 -5.4647 -5.3868 -5.3868 -5.3206 -5.2895 -5.2895 -5.2395 -3.3444 -3.3438 -3.3404 -3.3404 -3.3248 -3.3248 -3.3008 -3.3008 -3.3004 -3.2910 -3.2910 -3.2867 -3.2614 -3.2531 -3.2531 -3.2451 -3.2136 -3.2136 0.8464 0.8464 1.0013 1.0013 1.0086 1.0170 2.7864 2.7864 3.3025 3.3046 3.3046 3.3144 3.8618 3.8618 3.9348 3.9348 3.9602 3.9608 4.6566 4.6566 4.9775 4.9775 5.0701 5.0778 5.2998 5.2998 5.3544 5.4148 5.5218 5.5218 8.1921 8.1921 8.2269 8.2287 8.5038 8.6902 8.6902 8.7264 8.9679 8.9679 9.1801 9.1801 9.6496 9.7569 9.7688 9.7688 k = 0.2214 0.3131 0.5424 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0316 -6.0316 -5.8061 -5.8061 -5.8056 -5.7752 -5.7752 -5.7645 -5.5033 -5.5005 -5.4970 -5.4970 -5.4633 -5.4633 -5.3892 -5.3892 -5.3131 -5.2895 -5.2895 -5.2486 -3.3428 -3.3423 -3.3389 -3.3389 -3.3266 -3.3266 -3.3010 -3.3010 -3.2980 -3.2916 -3.2916 -3.2880 -3.2609 -3.2534 -3.2534 -3.2472 -3.2140 -3.2140 0.8605 0.8605 0.9908 0.9908 0.9989 1.0056 2.7880 2.7880 3.3041 3.3063 3.3063 3.3141 3.8556 3.8556 3.9315 3.9315 3.9519 3.9521 4.6973 4.6973 4.9735 4.9735 5.0662 5.0684 5.3022 5.3022 5.3640 5.4074 5.5178 5.5178 8.2172 8.2172 8.2396 8.2458 8.5596 8.7166 8.7166 8.7464 8.9549 8.9549 9.1251 9.1251 9.6590 9.7578 9.7615 9.7615 k = 0.2286 0.3232 0.5599 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0286 -6.0286 -5.8037 -5.8037 -5.8035 -5.7761 -5.7761 -5.7730 -5.5024 -5.5002 -5.4976 -5.4976 -5.4621 -5.4621 -5.3911 -5.3911 -5.3058 -5.2891 -5.2891 -5.2578 -3.3412 -3.3409 -3.3375 -3.3375 -3.3285 -3.3285 -3.3010 -3.3010 -3.2960 -3.2921 -3.2921 -3.2892 -3.2600 -3.2538 -3.2538 -3.2492 -3.2144 -3.2144 0.8775 0.8775 0.9799 0.9799 0.9888 0.9938 2.7899 2.7899 3.3056 3.3077 3.3077 3.3134 3.8504 3.8504 3.9292 3.9292 3.9444 3.9450 4.7338 4.7338 4.9678 4.9678 5.0525 5.0541 5.3087 5.3087 5.3792 5.4078 5.5065 5.5065 8.2368 8.2368 8.2495 8.2553 8.6224 8.7477 8.7477 8.7656 8.9443 8.9443 9.0646 9.0646 9.6749 9.7582 9.7598 9.7598 k = 0.2357 0.3334 0.5774 ( 8364 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0267 -6.0267 -5.8012 -5.8011 -5.8011 -5.7811 -5.7770 -5.7770 -5.5015 -5.5000 -5.4983 -5.4983 -5.4611 -5.4611 -5.3924 -5.3924 -5.2988 -5.2884 -5.2884 -5.2671 -3.3396 -3.3394 -3.3364 -3.3364 -3.3304 -3.3304 -3.3009 -3.3009 -3.2943 -3.2924 -3.2924 -3.2903 -3.2587 -3.2541 -3.2541 -3.2511 -3.2147 -3.2147 0.8974 0.8974 0.9687 0.9687 0.9781 0.9814 2.7917 2.7917 3.3071 3.3088 3.3088 3.3125 3.8465 3.8465 3.9282 3.9282 3.9382 3.9388 4.7630 4.7630 4.9652 4.9652 5.0326 5.0356 5.3179 5.3179 5.3984 5.4150 5.4885 5.4885 8.2507 8.2507 8.2564 8.2600 8.6874 8.7817 8.7817 8.7830 8.9342 8.9342 9.0022 9.0022 9.6970 9.7580 9.7616 9.7616 k = 0.2429 0.3435 0.5949 ( 8337 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9976 -25.9976 -25.9976 -25.9976 -6.0256 -6.0256 -5.7987 -5.7985 -5.7985 -5.7888 -5.7777 -5.7777 -5.5006 -5.4998 -5.4990 -5.4990 -5.4605 -5.4605 -5.3931 -5.3931 -5.2921 -5.2873 -5.2873 -5.2764 -3.3380 -3.3379 -3.3358 -3.3358 -3.3322 -3.3322 -3.3007 -3.3007 -3.2931 -3.2925 -3.2925 -3.2914 -3.2570 -3.2545 -3.2545 -3.2530 -3.2149 -3.2149 0.9197 0.9197 0.9573 0.9573 0.9665 0.9681 2.7930 2.7930 3.3085 3.3095 3.3095 3.3112 3.8440 3.8440 3.9285 3.9285 3.9335 3.9339 4.7810 4.7810 4.9711 4.9711 5.0107 5.0130 5.3273 5.3273 5.4201 5.4273 5.4659 5.4659 8.2588 8.2588 8.2604 8.2617 8.7513 8.7983 8.8129 8.8129 8.9154 8.9154 8.9529 8.9529 9.7241 9.7568 9.7621 9.7621 k = 0.2500 0.3536 0.6124 ( 8328 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9976 -25.9976 -25.9976 -25.9976 -6.0253 -6.0253 -5.7961 -5.7961 -5.7961 -5.7961 -5.7779 -5.7779 -5.4996 -5.4996 -5.4996 -5.4996 -5.4603 -5.4603 -5.3933 -5.3933 -5.2858 -5.2858 -5.2858 -5.2858 -3.3364 -3.3364 -3.3364 -3.3364 -3.3329 -3.3329 -3.3007 -3.3007 -3.2924 -3.2924 -3.2924 -3.2924 -3.2548 -3.2548 -3.2548 -3.2548 -3.2149 -3.2149 0.9362 0.9362 0.9539 0.9539 0.9539 0.9539 2.7936 2.7936 3.3098 3.3098 3.3098 3.3098 3.8432 3.8432 3.9303 3.9303 3.9303 3.9303 4.7865 4.7865 4.9887 4.9887 4.9887 4.9887 5.3321 5.3321 5.4431 5.4431 5.4431 5.4432 8.2616 8.2616 8.2616 8.2616 8.8114 8.8114 8.8114 8.8114 8.8940 8.8940 8.9403 8.9403 9.7543 9.7543 9.7543 9.7543 k = 0.2500 0.3536 0.6124 ( 8328 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9976 -25.9976 -25.9976 -25.9976 -6.0253 -6.0253 -5.7961 -5.7961 -5.7961 -5.7961 -5.7779 -5.7779 -5.4996 -5.4996 -5.4996 -5.4996 -5.4603 -5.4603 -5.3933 -5.3933 -5.2858 -5.2858 -5.2858 -5.2858 -3.3364 -3.3364 -3.3364 -3.3364 -3.3329 -3.3329 -3.3007 -3.3007 -3.2924 -3.2924 -3.2924 -3.2924 -3.2548 -3.2548 -3.2548 -3.2548 -3.2149 -3.2149 0.9362 0.9362 0.9539 0.9539 0.9539 0.9539 2.7936 2.7936 3.3098 3.3098 3.3098 3.3098 3.8432 3.8432 3.9303 3.9303 3.9303 3.9303 4.7865 4.7865 4.9887 4.9887 4.9887 4.9887 5.3321 5.3321 5.4431 5.4431 5.4431 5.4432 8.2616 8.2616 8.2616 8.2616 8.8114 8.8114 8.8114 8.8114 8.8940 8.8940 8.9403 8.9403 9.7543 9.7543 9.7543 9.7543 k = 0.2571 0.3334 0.6124 ( 8340 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9976 -25.9976 -6.0256 -6.0256 -5.8029 -5.7942 -5.7942 -5.7933 -5.7776 -5.7776 -5.5001 -5.5001 -5.4994 -5.4986 -5.4605 -5.4605 -5.3932 -5.3932 -5.2952 -5.2840 -5.2840 -5.2800 -3.3384 -3.3384 -3.3350 -3.3349 -3.3325 -3.3325 -3.3007 -3.3007 -3.2933 -3.2921 -3.2920 -3.2920 -3.2565 -3.2551 -3.2551 -3.2522 -3.2149 -3.2149 0.9263 0.9263 0.9384 0.9400 0.9788 0.9788 2.7929 2.7929 3.3083 3.3097 3.3097 3.3111 3.8441 3.8441 3.9283 3.9287 3.9338 3.9338 4.7826 4.7826 4.9644 4.9679 5.0160 5.0160 5.3238 5.3238 5.4289 5.4289 5.4611 5.4668 8.2596 8.2596 8.2605 8.2606 8.7580 8.7580 8.8226 8.8660 8.9000 8.9000 8.9534 8.9534 9.7349 9.7349 9.7497 9.7853 k = 0.2643 0.3131 0.6124 ( 8373 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0263 -6.0263 -5.8093 -5.7931 -5.7931 -5.7904 -5.7764 -5.7764 -5.5006 -5.5006 -5.4992 -5.4976 -5.4611 -5.4611 -5.3927 -5.3927 -5.3045 -5.2818 -5.2818 -5.2747 -3.3407 -3.3407 -3.3336 -3.3334 -3.3320 -3.3320 -3.3010 -3.3010 -3.2941 -3.2922 -3.2915 -3.2915 -3.2583 -3.2553 -3.2553 -3.2494 -3.2147 -3.2147 0.9111 0.9111 0.9216 0.9246 1.0106 1.0106 2.7910 2.7910 3.3067 3.3090 3.3090 3.3121 3.8469 3.8469 3.9280 3.9289 3.9389 3.9389 4.7740 4.7740 4.9414 4.9492 5.0490 5.0490 5.2965 5.2965 5.4293 5.4293 5.4803 5.4905 8.2530 8.2530 8.2571 8.2589 8.6933 8.6933 8.8321 8.8964 8.8964 8.9139 8.9888 8.9888 9.7079 9.7079 9.7425 9.8142 k = 0.2714 0.2929 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0273 -6.0273 -5.8151 -5.7928 -5.7928 -5.7874 -5.7743 -5.7743 -5.5010 -5.5010 -5.4991 -5.4966 -5.4620 -5.4620 -5.3922 -5.3922 -5.3138 -5.2792 -5.2792 -5.2698 -3.3431 -3.3431 -3.3323 -3.3319 -3.3316 -3.3316 -3.3015 -3.3015 -3.2948 -3.2925 -3.2908 -3.2908 -3.2600 -3.2555 -3.2555 -3.2464 -3.2144 -3.2144 0.8940 0.8940 0.9032 0.9076 1.0459 1.0459 2.7875 2.7875 3.3050 3.3077 3.3077 3.3130 3.8517 3.8517 3.9299 3.9309 3.9458 3.9458 4.7644 4.7644 4.9205 4.9333 5.0845 5.0845 5.2560 5.2560 5.4395 5.4395 5.4999 5.5139 8.2420 8.2420 8.2518 8.2571 8.6298 8.6298 8.8403 8.8858 8.8858 8.9542 9.0315 9.0315 9.6782 9.6782 9.7321 9.8381 k = 0.2786 0.2727 0.6124 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0284 -6.0284 -5.8203 -5.7929 -5.7929 -5.7841 -5.7717 -5.7717 -5.5013 -5.5013 -5.4989 -5.4956 -5.4632 -5.4632 -5.3916 -5.3916 -5.3229 -5.2763 -5.2763 -5.2654 -3.3456 -3.3456 -3.3312 -3.3312 -3.3311 -3.3304 -3.3021 -3.3021 -3.2954 -3.2931 -3.2899 -3.2899 -3.2616 -3.2555 -3.2555 -3.2433 -3.2139 -3.2139 0.8752 0.8752 0.8833 0.8889 1.0842 1.0842 2.7824 2.7824 3.3034 3.3058 3.3058 3.3136 3.8587 3.8587 3.9341 3.9350 3.9542 3.9542 4.7558 4.7558 4.9025 4.9207 5.1193 5.1193 5.2099 5.2099 5.4536 5.4536 5.5196 5.5366 8.2263 8.2263 8.2452 8.2553 8.5709 8.5709 8.8476 8.8709 8.8709 8.9865 9.0756 9.0756 9.6491 9.6491 9.7186 9.8543 k = 0.2857 0.2525 0.6124 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0296 -6.0296 -5.8250 -5.7934 -5.7934 -5.7807 -5.7688 -5.7688 -5.5014 -5.5014 -5.4988 -5.4945 -5.4646 -5.4646 -5.3912 -5.3912 -5.3319 -5.2733 -5.2733 -5.2616 -3.3482 -3.3482 -3.3310 -3.3310 -3.3299 -3.3290 -3.3028 -3.3028 -3.2959 -3.2938 -3.2891 -3.2891 -3.2632 -3.2555 -3.2555 -3.2402 -3.2134 -3.2134 0.8546 0.8546 0.8616 0.8683 1.1255 1.1255 2.7757 2.7757 3.3018 3.3031 3.3031 3.3139 3.8680 3.8680 3.9410 3.9413 3.9639 3.9639 4.7494 4.7494 4.8876 4.9117 5.1355 5.1355 5.1785 5.1785 5.4692 5.4692 5.5389 5.5584 8.2058 8.2058 8.2373 8.2539 8.5187 8.5187 8.8524 8.8524 8.8539 9.0106 9.1191 9.1191 9.6221 9.6221 9.7022 9.8605 k = 0.2929 0.2323 0.6124 ( 8391 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0308 -6.0308 -5.8291 -5.7939 -5.7939 -5.7772 -5.7658 -5.7658 -5.5015 -5.5015 -5.4987 -5.4934 -5.4661 -5.4661 -5.3909 -5.3909 -5.3406 -5.2700 -5.2700 -5.2583 -3.3507 -3.3507 -3.3308 -3.3308 -3.3288 -3.3276 -3.3038 -3.3038 -3.2963 -3.2946 -3.2882 -3.2882 -3.2648 -3.2554 -3.2554 -3.2371 -3.2128 -3.2128 0.8323 0.8323 0.8383 0.8459 1.1696 1.1696 2.7675 2.7675 3.2997 3.2997 3.3003 3.3137 3.8796 3.8796 3.9499 3.9509 3.9743 3.9743 4.7459 4.7459 4.8761 4.9064 5.0936 5.0936 5.2030 5.2030 5.4849 5.4849 5.5576 5.5791 8.1802 8.1802 8.2287 8.2529 8.4743 8.4743 8.8304 8.8304 8.8593 9.0265 9.1609 9.1609 9.5981 9.5981 9.6839 9.8560 k = 0.3000 0.2121 0.6124 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0318 -6.0318 -5.8325 -5.7944 -5.7944 -5.7736 -5.7628 -5.7628 -5.5014 -5.5014 -5.4986 -5.4923 -5.4678 -5.4678 -5.3909 -5.3909 -5.3492 -5.2667 -5.2667 -5.2556 -3.3533 -3.3533 -3.3308 -3.3308 -3.3278 -3.3261 -3.3048 -3.3048 -3.2965 -3.2954 -3.2874 -3.2874 -3.2664 -3.2552 -3.2552 -3.2342 -3.2121 -3.2121 0.8082 0.8082 0.8133 0.8216 1.2164 1.2164 2.7579 2.7579 3.2955 3.2955 3.2988 3.3130 3.8936 3.8936 3.9610 3.9639 3.9850 3.9850 4.7454 4.7454 4.8680 4.9050 5.0410 5.0410 5.2371 5.2371 5.5004 5.5004 5.5755 5.5986 8.1502 8.1502 8.2197 8.2526 8.4382 8.4382 8.8051 8.8051 8.8635 9.0340 9.2004 9.2004 9.5774 9.5774 9.6647 9.8417 k = 0.3071 0.1919 0.6124 ( 8397 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0325 -6.0325 -5.8354 -5.7948 -5.7948 -5.7698 -5.7598 -5.7598 -5.5012 -5.5012 -5.4985 -5.4912 -5.4695 -5.4695 -5.3912 -5.3912 -5.3576 -5.2635 -5.2635 -5.2534 -3.3559 -3.3559 -3.3308 -3.3308 -3.3269 -3.3247 -3.3060 -3.3060 -3.2968 -3.2963 -3.2867 -3.2867 -3.2679 -3.2548 -3.2548 -3.2313 -3.2113 -3.2113 0.7824 0.7824 0.7866 0.7955 1.2657 1.2657 2.7474 2.7474 3.2907 3.2907 3.2973 3.3119 3.9099 3.9099 3.9747 3.9801 3.9950 3.9950 4.7479 4.7479 4.8635 4.9075 4.9885 4.9885 5.2712 5.2712 5.5151 5.5151 5.5924 5.6168 8.1167 8.1167 8.2106 8.2531 8.4097 8.4097 8.7772 8.7772 8.8661 9.0332 9.2369 9.2369 9.5600 9.5600 9.6460 9.8197 k = 0.3143 0.1717 0.6124 ( 8400 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0330 -6.0330 -5.8377 -5.7950 -5.7950 -5.7659 -5.7570 -5.7570 -5.5009 -5.5009 -5.4984 -5.4901 -5.4713 -5.4713 -5.3917 -5.3917 -5.3657 -5.2603 -5.2603 -5.2518 -3.3584 -3.3584 -3.3310 -3.3310 -3.3262 -3.3233 -3.3073 -3.3073 -3.2972 -3.2969 -3.2860 -3.2860 -3.2693 -3.2544 -3.2544 -3.2286 -3.2105 -3.2105 0.7550 0.7550 0.7583 0.7677 1.3172 1.3172 2.7361 2.7361 3.2853 3.2853 3.2958 3.3102 3.9278 3.9278 3.9911 3.9998 4.0038 4.0038 4.7530 4.7530 4.8623 4.9138 4.9389 4.9389 5.3044 5.3044 5.5289 5.5289 5.6083 5.6335 8.0813 8.0813 8.2016 8.2545 8.3874 8.3874 8.7473 8.7473 8.8667 9.0244 9.2701 9.2701 9.5453 9.5453 9.6288 9.7928 k = 0.3214 0.1515 0.6124 ( 8400 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0332 -6.0332 -5.8393 -5.7951 -5.7951 -5.7619 -5.7543 -5.7543 -5.5005 -5.5005 -5.4983 -5.4890 -5.4730 -5.4730 -5.3925 -5.3925 -5.3734 -5.2574 -5.2574 -5.2508 -3.3609 -3.3609 -3.3312 -3.3312 -3.3256 -3.3220 -3.3086 -3.3086 -3.2980 -3.2970 -3.2854 -3.2854 -3.2706 -3.2538 -3.2538 -3.2262 -3.2097 -3.2097 0.7261 0.7261 0.7287 0.7383 1.3708 1.3709 2.7244 2.7244 3.2795 3.2795 3.2943 3.3081 3.9463 3.9463 4.0101 4.0112 4.0112 4.0227 4.7596 4.7596 4.8645 4.8947 4.8947 4.9239 5.3363 5.3363 5.5416 5.5416 5.6229 5.6488 8.0455 8.0455 8.1929 8.2568 8.3698 8.3698 8.7165 8.7165 8.8647 9.0079 9.2996 9.2996 9.5327 9.5327 9.6139 9.7639 k = 0.3286 0.1313 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0329 -6.0329 -5.8403 -5.7949 -5.7949 -5.7579 -5.7517 -5.7517 -5.4999 -5.4999 -5.4983 -5.4879 -5.4747 -5.4747 -5.3935 -5.3935 -5.3809 -5.2548 -5.2548 -5.2503 -3.3634 -3.3634 -3.3314 -3.3314 -3.3252 -3.3206 -3.3100 -3.3100 -3.2987 -3.2971 -3.2848 -3.2848 -3.2718 -3.2532 -3.2532 -3.2239 -3.2089 -3.2089 0.6959 0.6959 0.6977 0.7075 1.4262 1.4262 2.7129 2.7129 3.2734 3.2734 3.2927 3.3057 3.9620 3.9620 4.0190 4.0190 4.0317 4.0489 4.7646 4.7646 4.8603 4.8603 4.8700 4.9376 5.3668 5.3668 5.5531 5.5531 5.6364 5.6625 8.0105 8.0105 8.1848 8.2601 8.3556 8.3556 8.6857 8.6857 8.8598 8.9846 9.3252 9.3252 9.5212 9.5212 9.6016 9.7353 k = 0.3357 0.1111 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0323 -6.0323 -5.8407 -5.7945 -5.7945 -5.7537 -5.7494 -5.7494 -5.4993 -5.4993 -5.4982 -5.4869 -5.4764 -5.4764 -5.3947 -5.3947 -5.3880 -5.2526 -5.2526 -5.2503 -3.3660 -3.3660 -3.3318 -3.3318 -3.3250 -3.3194 -3.3115 -3.3115 -3.2992 -3.2972 -3.2843 -3.2843 -3.2729 -3.2526 -3.2526 -3.2219 -3.2081 -3.2081 0.6645 0.6645 0.6657 0.6755 1.4829 1.4829 2.7020 2.7020 3.2672 3.2672 3.2912 3.3029 3.9684 3.9684 4.0321 4.0321 4.0557 4.0780 4.7613 4.7613 4.8436 4.8436 4.8787 4.9549 5.3958 5.3958 5.5635 5.5635 5.6487 5.6745 7.9768 7.9768 8.1772 8.2643 8.3436 8.3436 8.6562 8.6562 8.8515 8.9555 9.3470 9.3470 9.5101 9.5101 9.5918 9.7087 k = 0.3429 0.0909 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0312 -6.0312 -5.8406 -5.7939 -5.7939 -5.7496 -5.7473 -5.7473 -5.4985 -5.4985 -5.4982 -5.4859 -5.4780 -5.4780 -5.3961 -5.3961 -5.3947 -5.2509 -5.2509 -5.2509 -3.3685 -3.3685 -3.3322 -3.3322 -3.3250 -3.3181 -3.3129 -3.3129 -3.2997 -3.2974 -3.2840 -3.2840 -3.2738 -3.2519 -3.2519 -3.2201 -3.2074 -3.2074 0.6321 0.6321 0.6329 0.6425 1.5405 1.5406 2.6922 2.6922 3.2610 3.2610 3.2897 3.2999 3.9618 3.9618 4.0532 4.0532 4.0819 4.1097 4.7470 4.7470 4.8479 4.8479 4.8905 4.9756 5.4232 5.4232 5.5726 5.5726 5.6596 5.6849 7.9448 7.9448 8.1703 8.2694 8.3329 8.3329 8.6291 8.6291 8.8399 8.9218 9.3648 9.3648 9.4985 9.4985 9.5840 9.6852 k = 0.3500 0.0707 0.6124 ( 8376 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0296 -6.0296 -5.8398 -5.7932 -5.7932 -5.7454 -5.7454 -5.7454 -5.4982 -5.4976 -5.4976 -5.4850 -5.4795 -5.4795 -5.4010 -5.3976 -5.3976 -5.2521 -5.2496 -5.2496 -3.3709 -3.3709 -3.3326 -3.3326 -3.3251 -3.3170 -3.3144 -3.3144 -3.3000 -3.2976 -3.2836 -3.2836 -3.2745 -3.2512 -3.2512 -3.2186 -3.2068 -3.2068 0.5991 0.5991 0.5994 0.6087 1.5985 1.5985 2.6842 2.6842 3.2549 3.2549 3.2882 3.2968 3.9442 3.9442 4.0796 4.0796 4.1099 4.1436 4.7299 4.7299 4.8651 4.8651 4.9054 4.9997 5.4490 5.4490 5.5804 5.5804 5.6694 5.6937 7.9144 7.9144 8.1639 8.2751 8.3227 8.3227 8.6056 8.6056 8.8251 8.8849 9.3788 9.3788 9.4861 9.4861 9.5776 9.6654 k = 0.3571 0.0505 0.6124 ( 8409 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -6.0276 -6.0276 -5.8385 -5.7922 -5.7922 -5.7437 -5.7437 -5.7413 -5.4982 -5.4967 -5.4967 -5.4842 -5.4808 -5.4808 -5.4067 -5.3992 -5.3992 -5.2538 -5.2490 -5.2490 -3.3734 -3.3734 -3.3330 -3.3330 -3.3255 -3.3161 -3.3158 -3.3158 -3.3002 -3.2979 -3.2834 -3.2834 -3.2749 -3.2504 -3.2504 -3.2174 -3.2063 -3.2063 0.5655 0.5655 0.5656 0.5745 1.6562 1.6562 2.6787 2.6787 3.2491 3.2491 3.2867 3.2936 3.9179 3.9179 4.1085 4.1085 4.1396 4.1792 4.7157 4.7157 4.8892 4.8892 4.9233 5.0269 5.4733 5.4733 5.5870 5.5870 5.6779 5.7009 7.8855 7.8855 8.1579 8.2812 8.3125 8.3125 8.5865 8.5865 8.8076 8.8463 9.3886 9.3886 9.4731 9.4731 9.5719 9.6491 k = 0.3643 0.0303 0.6124 ( 8385 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0251 -6.0251 -5.8366 -5.7911 -5.7911 -5.7422 -5.7422 -5.7373 -5.4983 -5.4957 -5.4957 -5.4836 -5.4818 -5.4818 -5.4119 -5.4009 -5.4009 -5.2560 -5.2489 -5.2489 -3.3758 -3.3758 -3.3334 -3.3334 -3.3260 -3.3171 -3.3171 -3.3153 -3.3002 -3.2982 -3.2833 -3.2833 -3.2750 -3.2497 -3.2497 -3.2164 -3.2058 -3.2058 0.5314 0.5318 0.5318 0.5401 1.7128 1.7128 2.6765 2.6765 3.2437 3.2437 3.2853 3.2906 3.8847 3.8847 4.1386 4.1386 4.1705 4.2161 4.7056 4.7056 4.9180 4.9180 4.9442 5.0572 5.4961 5.4961 5.5923 5.5923 5.6852 5.7064 7.8576 7.8576 8.1522 8.2873 8.3017 8.3017 8.5724 8.5724 8.7882 8.8072 9.3937 9.3937 9.4604 9.4604 9.5662 9.6359 k = 0.3714 0.0101 0.6124 ( 8379 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0222 -6.0222 -5.8342 -5.7898 -5.7898 -5.7410 -5.7410 -5.7334 -5.4983 -5.4948 -5.4948 -5.4832 -5.4824 -5.4824 -5.4163 -5.4026 -5.4026 -5.2586 -5.2496 -5.2496 -3.3782 -3.3782 -3.3338 -3.3338 -3.3266 -3.3184 -3.3184 -3.3147 -3.3001 -3.2985 -3.2833 -3.2833 -3.2748 -3.2489 -3.2489 -3.2157 -3.2054 -3.2054 0.4974 0.4981 0.4981 0.5057 1.7675 1.7675 2.6784 2.6784 3.2387 3.2387 3.2839 3.2877 3.8459 3.8459 4.1691 4.1691 4.2022 4.2535 4.6992 4.6992 4.9505 4.9505 4.9681 5.0903 5.5172 5.5172 5.5965 5.5965 5.6915 5.7104 7.8306 7.8306 8.1465 8.2904 8.2904 8.2929 8.5636 8.5636 8.7679 8.7689 9.3931 9.3931 9.4496 9.4496 9.5599 9.6250 k = 0.3786-0.0101 0.6124 ( 8379 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0188 -6.0188 -5.8313 -5.7885 -5.7885 -5.7400 -5.7400 -5.7297 -5.4984 -5.4941 -5.4941 -5.4830 -5.4825 -5.4825 -5.4200 -5.4042 -5.4042 -5.2618 -5.2508 -5.2508 -3.3805 -3.3805 -3.3342 -3.3342 -3.3274 -3.3195 -3.3195 -3.3145 -3.2999 -3.2987 -3.2834 -3.2834 -3.2744 -3.2482 -3.2482 -3.2153 -3.2052 -3.2052 0.4638 0.4647 0.4647 0.4715 1.8192 1.8192 2.6852 2.6852 3.2341 3.2341 3.2827 3.2850 3.8032 3.8032 4.1994 4.1994 4.2345 4.2911 4.6955 4.6955 4.9862 4.9862 4.9950 5.1260 5.5368 5.5368 5.5998 5.5998 5.6968 5.7128 7.8040 7.8040 8.1405 8.2783 8.2783 8.2974 8.5598 8.5598 8.7327 8.7476 9.3864 9.3864 9.4418 9.4418 9.5526 9.6153 k = 0.3857-0.0303 0.6124 ( 8373 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0150 -6.0150 -5.8279 -5.7871 -5.7871 -5.7393 -5.7393 -5.7262 -5.4985 -5.4939 -5.4939 -5.4832 -5.4819 -5.4819 -5.4228 -5.4057 -5.4057 -5.2655 -5.2528 -5.2528 -3.3828 -3.3828 -3.3345 -3.3345 -3.3281 -3.3206 -3.3206 -3.3145 -3.2997 -3.2989 -3.2835 -3.2835 -3.2737 -3.2475 -3.2475 -3.2151 -3.2050 -3.2050 0.4308 0.4317 0.4318 0.4380 1.8671 1.8671 2.6979 2.6979 3.2301 3.2301 3.2815 3.2825 3.7578 3.7578 4.2289 4.2289 4.2668 4.3280 4.6934 4.6934 5.0247 5.0248 5.0248 5.1641 5.5546 5.5546 5.6023 5.6023 5.7011 5.7138 7.7777 7.7777 8.1340 8.2656 8.2656 8.2997 8.5606 8.5606 8.7000 8.7284 9.3751 9.3751 9.4362 9.4362 9.5437 9.6059 k = 0.3929-0.0505 0.6124 ( 8370 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0109 -6.0109 -5.8241 -5.7857 -5.7857 -5.7388 -5.7388 -5.7231 -5.4986 -5.4940 -5.4940 -5.4838 -5.4806 -5.4806 -5.4246 -5.4071 -5.4071 -5.2696 -5.2555 -5.2555 -3.3850 -3.3850 -3.3348 -3.3348 -3.3290 -3.3216 -3.3216 -3.3149 -3.2993 -3.2989 -3.2838 -3.2838 -3.2727 -3.2468 -3.2468 -3.2153 -3.2050 -3.2050 0.3985 0.3996 0.3996 0.4052 1.9101 1.9101 2.7171 2.7171 3.2265 3.2265 3.2803 3.2805 3.7109 3.7109 4.2573 4.2573 4.2988 4.3639 4.6919 4.6919 5.0572 5.0657 5.0657 5.2042 5.5702 5.5702 5.6048 5.6048 5.7047 5.7135 7.7518 7.7518 8.1267 8.2523 8.2523 8.2991 8.5653 8.5653 8.6719 8.7113 9.3620 9.3620 9.4308 9.4308 9.5331 9.5956 k = 0.4000-0.0707 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0064 -6.0064 -5.8198 -5.7843 -5.7843 -5.7386 -5.7386 -5.7203 -5.4987 -5.4944 -5.4944 -5.4847 -5.4786 -5.4786 -5.4255 -5.4083 -5.4083 -5.2741 -5.2588 -5.2588 -3.3871 -3.3871 -3.3349 -3.3349 -3.3298 -3.3225 -3.3225 -3.3156 -3.2990 -3.2988 -3.2843 -3.2843 -3.2715 -3.2461 -3.2461 -3.2156 -3.2051 -3.2051 0.3673 0.3685 0.3685 0.3735 1.9476 1.9476 2.7432 2.7433 3.2233 3.2233 3.2784 3.2796 3.6637 3.6637 4.2841 4.2841 4.3303 4.3983 4.6902 4.6902 5.0921 5.1085 5.1085 5.2458 5.5820 5.5820 5.6090 5.6090 5.7077 5.7119 7.7263 7.7263 8.1184 8.2381 8.2381 8.2945 8.5733 8.5733 8.6497 8.6968 9.3489 9.3489 9.4245 9.4245 9.5206 9.5835 k = 0.4071-0.0909 0.6124 ( 8367 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0016 -6.0016 -5.8152 -5.7831 -5.7831 -5.7385 -5.7385 -5.7180 -5.4988 -5.4950 -5.4950 -5.4860 -5.4762 -5.4762 -5.4254 -5.4092 -5.4092 -5.2790 -5.2628 -5.2628 -3.3892 -3.3892 -3.3350 -3.3350 -3.3306 -3.3233 -3.3233 -3.3166 -3.2986 -3.2985 -3.2848 -3.2848 -3.2700 -3.2454 -3.2454 -3.2162 -3.2052 -3.2052 0.3374 0.3385 0.3385 0.3430 1.9792 1.9792 2.7763 2.7763 3.2206 3.2206 3.2768 3.2789 3.6169 3.6169 4.3092 4.3092 4.3610 4.4306 4.6875 4.6875 5.1292 5.1526 5.1526 5.2885 5.5880 5.5880 5.6171 5.6171 5.7093 5.7103 7.7014 7.7014 8.1091 8.2231 8.2231 8.2855 8.5837 8.5837 8.6339 8.6855 9.3368 9.3368 9.4167 9.4167 9.5061 9.5690 k = 0.4143-0.1111 0.6124 ( 8361 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9967 -5.9967 -5.8102 -5.7820 -5.7820 -5.7386 -5.7386 -5.7161 -5.4989 -5.4957 -5.4957 -5.4874 -5.4735 -5.4735 -5.4244 -5.4097 -5.4097 -5.2843 -5.2675 -5.2675 -3.3911 -3.3911 -3.3350 -3.3350 -3.3314 -3.3240 -3.3240 -3.3178 -3.2982 -3.2982 -3.2855 -3.2855 -3.2683 -3.2448 -3.2448 -3.2171 -3.2054 -3.2054 0.3089 0.3100 0.3100 0.3139 2.0051 2.0051 2.8159 2.8159 3.2183 3.2183 3.2755 3.2782 3.5713 3.5713 4.3323 4.3323 4.3906 4.4607 4.6835 4.6836 5.1680 5.1974 5.1974 5.3317 5.5891 5.5891 5.6284 5.6284 5.7058 5.7126 7.6773 7.6773 8.0989 8.2070 8.2070 8.2721 8.5958 8.5958 8.6244 8.6776 9.3257 9.3257 9.4075 9.4075 9.4899 9.5517 k = 0.4214-0.1313 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9915 -5.9915 -5.8050 -5.7811 -5.7811 -5.7389 -5.7389 -5.7148 -5.4991 -5.4963 -5.4963 -5.4891 -5.4706 -5.4706 -5.4226 -5.4098 -5.4098 -5.2899 -5.2728 -5.2728 -3.3930 -3.3930 -3.3349 -3.3349 -3.3322 -3.3246 -3.3246 -3.3191 -3.2979 -3.2978 -3.2863 -3.2863 -3.2665 -3.2441 -3.2441 -3.2182 -3.2057 -3.2057 0.2820 0.2831 0.2831 0.2865 2.0257 2.0257 2.8609 2.8609 3.2162 3.2162 3.2745 3.2776 3.5276 3.5276 4.3531 4.3531 4.4189 4.4882 4.6780 4.6781 5.2080 5.2421 5.2421 5.3745 5.5877 5.5877 5.6407 5.6407 5.7017 5.7148 7.6544 7.6544 8.0880 8.1900 8.1900 8.2549 8.6091 8.6091 8.6207 8.6730 9.3157 9.3157 9.3972 9.3972 9.4720 9.5313 k = 0.4286-0.1515 0.6124 ( 8368 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9863 -5.9863 -5.7994 -5.7805 -5.7805 -5.7392 -5.7392 -5.7141 -5.4992 -5.4970 -5.4970 -5.4907 -5.4677 -5.4677 -5.4199 -5.4092 -5.4092 -5.2959 -5.2786 -5.2786 -3.3947 -3.3947 -3.3347 -3.3347 -3.3328 -3.3251 -3.3251 -3.3206 -3.2975 -3.2974 -3.2871 -3.2871 -3.2646 -3.2436 -3.2436 -3.2195 -3.2061 -3.2061 0.2569 0.2579 0.2580 0.2609 2.0415 2.0415 2.9102 2.9102 3.2145 3.2145 3.2737 3.2772 3.4864 3.4864 4.3715 4.3715 4.4457 4.5130 4.6710 4.6710 5.2484 5.2859 5.2859 5.4162 5.5851 5.5851 5.6532 5.6532 5.6973 5.7171 7.6330 7.6330 8.0770 8.1723 8.1723 8.2350 8.6216 8.6227 8.6227 8.6713 9.3060 9.3060 9.3864 9.3864 9.4529 9.5083 k = 0.4357-0.1717 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9811 -5.9811 -5.7937 -5.7802 -5.7802 -5.7396 -5.7396 -5.7140 -5.4994 -5.4975 -5.4975 -5.4924 -5.4649 -5.4649 -5.4166 -5.4079 -5.4079 -5.3021 -5.2850 -5.2850 -3.3963 -3.3963 -3.3344 -3.3344 -3.3334 -3.3255 -3.3255 -3.3221 -3.2971 -3.2971 -3.2881 -3.2881 -3.2625 -3.2430 -3.2430 -3.2209 -3.2064 -3.2064 0.2337 0.2347 0.2347 0.2372 2.0535 2.0535 2.9622 2.9622 3.2129 3.2129 3.2732 3.2768 3.4481 3.4481 4.3872 4.3872 4.4709 4.5350 4.6626 4.6626 5.2884 5.3280 5.3280 5.4557 5.5817 5.5817 5.6655 5.6655 5.6932 5.7198 7.6132 7.6132 8.0662 8.1540 8.1540 8.2133 8.6259 8.6360 8.6360 8.6722 9.2961 9.2961 9.3757 9.3757 9.4330 9.4831 k = 0.4429-0.1919 0.6124 ( 8377 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9759 -5.9759 -5.7878 -5.7801 -5.7801 -5.7399 -5.7399 -5.7145 -5.4996 -5.4981 -5.4981 -5.4939 -5.4623 -5.4623 -5.4127 -5.4057 -5.4057 -5.3087 -5.2918 -5.2918 -3.3977 -3.3977 -3.3341 -3.3341 -3.3339 -3.3258 -3.3258 -3.3236 -3.2968 -3.2967 -3.2892 -3.2892 -3.2602 -3.2425 -3.2425 -3.2226 -3.2068 -3.2068 0.2126 0.2136 0.2136 0.2157 2.0624 2.0624 3.0152 3.0152 3.2116 3.2116 3.2728 3.2764 3.4132 3.4132 4.4001 4.4001 4.4943 4.5542 4.6532 4.6532 5.3274 5.3675 5.3675 5.4916 5.5779 5.5779 5.6776 5.6776 5.6900 5.7229 7.5953 7.5953 8.0561 8.1358 8.1358 8.1908 8.6324 8.6485 8.6485 8.6749 9.2858 9.2858 9.3655 9.3655 9.4129 9.4565 k = 0.4500-0.2121 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9710 -5.9710 -5.7817 -5.7804 -5.7804 -5.7402 -5.7402 -5.7157 -5.4997 -5.4985 -5.4985 -5.4952 -5.4601 -5.4601 -5.4082 -5.4026 -5.4026 -5.3154 -5.2991 -5.2991 -3.3990 -3.3990 -3.3342 -3.3338 -3.3338 -3.3259 -3.3259 -3.3250 -3.2965 -3.2964 -3.2902 -3.2902 -3.2579 -3.2421 -3.2421 -3.2244 -3.2072 -3.2072 0.1937 0.1946 0.1946 0.1964 2.0688 2.0688 3.0673 3.0673 3.2105 3.2105 3.2727 3.2761 3.3822 3.3822 4.4100 4.4100 4.5159 4.5706 4.6434 4.6434 5.3645 5.4037 5.4037 5.5222 5.5738 5.5738 5.6889 5.6895 5.6895 5.7266 7.5795 7.5795 8.0473 8.1182 8.1182 8.1685 8.6402 8.6596 8.6596 8.6788 9.2752 9.2752 9.3560 9.3560 9.3930 9.4296 k = 0.4571-0.2323 0.6124 ( 8368 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -5.9664 -5.9664 -5.7810 -5.7810 -5.7756 -5.7404 -5.7404 -5.7176 -5.4998 -5.4989 -5.4989 -5.4964 -5.4582 -5.4582 -5.4031 -5.3986 -5.3986 -5.3223 -5.3067 -5.3067 -3.4002 -3.4002 -3.3344 -3.3336 -3.3336 -3.3264 -3.3259 -3.3259 -3.2962 -3.2961 -3.2913 -3.2913 -3.2555 -3.2416 -3.2416 -3.2264 -3.2075 -3.2075 0.1772 0.1780 0.1780 0.1794 2.0735 2.0735 3.1163 3.1164 3.2100 3.2100 3.2726 3.2758 3.3553 3.3553 4.4167 4.4167 4.5355 4.5840 4.6338 4.6338 5.3991 5.4360 5.4360 5.5456 5.5696 5.5696 5.6911 5.7010 5.7010 5.7307 7.5658 7.5658 8.0403 8.1016 8.1016 8.1467 8.6487 8.6690 8.6690 8.6832 9.2649 9.2649 9.3472 9.3472 9.3741 9.4035 k = 0.4643-0.2525 0.6124 ( 8374 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -5.9622 -5.9622 -5.7817 -5.7817 -5.7695 -5.7406 -5.7406 -5.7201 -5.5000 -5.4992 -5.4992 -5.4974 -5.4568 -5.4568 -5.3977 -5.3937 -5.3937 -5.3294 -5.3146 -5.3146 -3.4012 -3.4012 -3.3345 -3.3333 -3.3333 -3.3278 -3.3258 -3.3258 -3.2960 -3.2959 -3.2924 -3.2924 -3.2531 -3.2413 -3.2413 -3.2285 -3.2079 -3.2079 0.1631 0.1637 0.1637 0.1649 2.0767 2.0767 3.1585 3.1585 3.2123 3.2123 3.2727 3.2756 3.3331 3.3331 4.4204 4.4204 4.5530 4.5947 4.6252 4.6252 5.4306 5.4638 5.4638 5.5602 5.5653 5.5653 5.6976 5.7121 5.7121 5.7352 7.5542 7.5542 8.0353 8.0867 8.0867 8.1261 8.6572 8.6764 8.6764 8.6874 9.2556 9.2556 9.3389 9.3389 9.3567 9.3792 k = 0.4714-0.2727 0.6124 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -5.9586 -5.9586 -5.7825 -5.7825 -5.7634 -5.7406 -5.7406 -5.7232 -5.5001 -5.4995 -5.4995 -5.4983 -5.4558 -5.4558 -5.3918 -5.3879 -5.3879 -5.3366 -5.3227 -5.3227 -3.4020 -3.4020 -3.3345 -3.3332 -3.3332 -3.3290 -3.3255 -3.3255 -3.2958 -3.2957 -3.2934 -3.2934 -3.2506 -3.2410 -3.2410 -3.2307 -3.2082 -3.2082 0.1514 0.1520 0.1520 0.1528 2.0790 2.0790 3.1838 3.1838 3.2252 3.2252 3.2729 3.2753 3.3158 3.3158 4.4214 4.4214 4.5683 4.6025 4.6180 4.6180 5.4587 5.4869 5.4869 5.5611 5.5611 5.5663 5.7077 5.7224 5.7224 5.7397 7.5448 7.5448 8.0328 8.0738 8.0738 8.1069 8.6654 8.6819 8.6819 8.6908 9.2479 9.2479 9.3312 9.3312 9.3416 9.3578 k = 0.4786-0.2929 0.6124 ( 8410 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -5.9556 -5.9556 -5.7833 -5.7833 -5.7574 -5.7407 -5.7407 -5.7268 -5.5001 -5.4997 -5.4997 -5.4989 -5.4551 -5.4551 -5.3856 -5.3816 -5.3816 -5.3438 -5.3308 -5.3308 -3.4026 -3.4026 -3.3343 -3.3330 -3.3330 -3.3302 -3.3253 -3.3253 -3.2956 -3.2955 -3.2942 -3.2942 -3.2480 -3.2407 -3.2407 -3.2330 -3.2084 -3.2084 0.1423 0.1428 0.1428 0.1434 2.0805 2.0805 3.1898 3.1898 3.2492 3.2492 3.2732 3.2750 3.3040 3.3040 4.4205 4.4205 4.5814 4.6075 4.6126 4.6126 5.4833 5.5056 5.5056 5.5567 5.5568 5.5654 5.7193 5.7312 5.7312 5.7435 7.5376 7.5376 8.0329 8.0635 8.0635 8.0894 8.6730 8.6857 8.6857 8.6929 9.2422 9.2422 9.3245 9.3245 9.3293 9.3402 k = 0.4857-0.3131 0.6124 ( 8425 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9978 -25.9978 -5.9534 -5.9534 -5.7839 -5.7839 -5.7516 -5.7406 -5.7406 -5.7310 -5.5002 -5.4998 -5.4998 -5.4994 -5.4546 -5.4546 -5.3791 -5.3749 -5.3749 -5.3510 -5.3387 -5.3387 -3.4031 -3.4031 -3.3340 -3.3330 -3.3330 -3.3312 -3.3250 -3.3250 -3.2955 -3.2955 -3.2949 -3.2949 -3.2455 -3.2406 -3.2406 -3.2355 -3.2086 -3.2086 0.1358 0.1362 0.1362 0.1365 2.0814 2.0814 3.1899 3.1899 3.2675 3.2675 3.2735 3.2747 3.2999 3.2999 4.4187 4.4187 4.5921 4.6089 4.6089 4.6097 5.5045 5.5202 5.5202 5.5521 5.5521 5.5596 5.7301 5.7381 5.7381 5.7459 7.5325 7.5325 8.0357 8.0559 8.0559 8.0739 8.6797 8.6880 8.6880 8.6935 9.2384 9.2384 9.3191 9.3191 9.3203 9.3269 k = 0.4929-0.3334 0.6124 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9520 -5.9520 -5.7843 -5.7843 -5.7460 -5.7406 -5.7406 -5.7356 -5.5001 -5.4999 -5.4999 -5.4997 -5.4543 -5.4543 -5.3723 -5.3686 -5.3686 -5.3582 -5.3457 -5.3457 -3.4033 -3.4033 -3.3335 -3.3329 -3.3329 -3.3321 -3.3249 -3.3249 -3.2955 -3.2954 -3.2953 -3.2953 -3.2430 -3.2405 -3.2405 -3.2379 -3.2087 -3.2087 0.1320 0.1322 0.1322 0.1324 2.0819 2.0819 3.1892 3.1892 3.2735 3.2735 3.2738 3.2744 3.3037 3.3037 4.4170 4.4170 4.6004 4.6068 4.6068 4.6093 5.5226 5.5312 5.5312 5.5470 5.5470 5.5501 5.7386 5.7425 5.7425 5.7463 7.5294 7.5294 8.0414 8.0512 8.0512 8.0606 8.6853 8.6892 8.6892 8.6924 9.2363 9.2363 9.3152 9.3156 9.3156 9.3182 k = 0.5000-0.3536 0.6124 ( 8440 PWs) bands (ev): -61.8102 -61.8102 -34.6920 -34.6920 -25.9978 -25.9978 -25.9978 -25.9978 -5.9515 -5.9515 -5.7845 -5.7845 -5.7406 -5.7406 -5.7406 -5.7406 -5.5000 -5.5000 -5.5000 -5.5000 -5.4543 -5.4543 -5.3653 -5.3653 -5.3653 -5.3653 -5.3492 -5.3492 -3.4034 -3.4034 -3.3329 -3.3329 -3.3329 -3.3329 -3.3248 -3.3248 -3.2954 -3.2954 -3.2954 -3.2954 -3.2404 -3.2404 -3.2404 -3.2404 -3.2087 -3.2087 0.1308 0.1308 0.1308 0.1308 2.0821 2.0821 3.1888 3.1888 3.2741 3.2741 3.2741 3.2741 3.3066 3.3066 4.4164 4.4164 4.6061 4.6061 4.6061 4.6061 5.5377 5.5377 5.5377 5.5377 5.5424 5.5424 5.7440 5.7440 5.7440 5.7440 7.5284 7.5284 8.0497 8.0497 8.0497 8.0497 8.6896 8.6896 8.6896 8.6896 9.2356 9.2356 9.3144 9.3144 9.3144 9.3144 k = 0.2500 0.3536 0.6124 ( 8328 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9976 -25.9976 -25.9976 -25.9976 -6.0253 -6.0253 -5.7961 -5.7961 -5.7961 -5.7961 -5.7779 -5.7779 -5.4996 -5.4996 -5.4996 -5.4996 -5.4603 -5.4603 -5.3933 -5.3933 -5.2858 -5.2858 -5.2858 -5.2858 -3.3364 -3.3364 -3.3364 -3.3364 -3.3329 -3.3329 -3.3007 -3.3007 -3.2924 -3.2924 -3.2924 -3.2924 -3.2548 -3.2548 -3.2548 -3.2548 -3.2149 -3.2149 0.9362 0.9362 0.9539 0.9539 0.9539 0.9539 2.7936 2.7936 3.3098 3.3098 3.3098 3.3098 3.8432 3.8432 3.9303 3.9303 3.9303 3.9303 4.7865 4.7865 4.9887 4.9887 4.9887 4.9887 5.3321 5.3321 5.4431 5.4431 5.4431 5.4432 8.2616 8.2616 8.2616 8.2616 8.8114 8.8114 8.8114 8.8114 8.8940 8.8940 8.9403 8.9403 9.7543 9.7543 9.7543 9.7543 k = 0.2375 0.3359 0.6124 ( 8342 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9976 -25.9976 -6.0256 -6.0256 -5.8003 -5.8003 -5.7921 -5.7921 -5.7776 -5.7776 -5.5002 -5.5002 -5.4989 -5.4989 -5.4605 -5.4605 -5.3931 -5.3931 -5.2915 -5.2915 -5.2800 -5.2800 -3.3382 -3.3382 -3.3353 -3.3353 -3.3323 -3.3323 -3.3007 -3.3007 -3.2929 -3.2929 -3.2918 -3.2918 -3.2562 -3.2562 -3.2532 -3.2532 -3.2149 -3.2149 0.9216 0.9216 0.9482 0.9482 0.9745 0.9745 2.7930 2.7930 3.3086 3.3086 3.3107 3.3107 3.8440 3.8440 3.9283 3.9283 3.9340 3.9340 4.7817 4.7817 4.9683 4.9683 5.0144 5.0144 5.3257 5.3257 5.4247 5.4247 5.4664 5.4664 8.2584 8.2584 8.2615 8.2615 8.7606 8.7606 8.8319 8.8319 8.9107 8.9107 8.9527 8.9527 9.7328 9.7328 9.7695 9.7695 k = 0.2250 0.3182 0.6124 ( 8366 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0265 -6.0265 -5.8043 -5.8043 -5.7886 -5.7886 -5.7764 -5.7764 -5.5008 -5.5008 -5.4982 -5.4982 -5.4611 -5.4611 -5.3926 -5.3926 -5.2970 -5.2970 -5.2742 -5.2742 -3.3403 -3.3403 -3.3349 -3.3349 -3.3311 -3.3311 -3.3010 -3.3010 -3.2934 -3.2934 -3.2913 -3.2913 -3.2575 -3.2575 -3.2516 -3.2516 -3.2147 -3.2147 0.8997 0.8997 0.9465 0.9465 0.9992 0.9992 2.7911 2.7911 3.3071 3.3071 3.3118 3.3118 3.8461 3.8461 3.9270 3.9270 3.9404 3.9405 4.7677 4.7677 4.9546 4.9546 5.0436 5.0436 5.3092 5.3092 5.4083 5.4083 5.4942 5.4942 8.2490 8.2490 8.2609 8.2609 8.6983 8.6983 8.8282 8.8282 8.9336 8.9336 8.9921 8.9921 9.7079 9.7079 9.7793 9.7793 k = 0.2125 0.3005 0.6124 ( 8366 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0279 -6.0279 -5.8082 -5.8082 -5.7861 -5.7861 -5.7738 -5.7738 -5.5014 -5.5014 -5.4975 -5.4975 -5.4620 -5.4620 -5.3918 -5.3918 -5.3022 -5.3022 -5.2685 -5.2685 -3.3425 -3.3425 -3.3348 -3.3348 -3.3296 -3.3296 -3.3013 -3.3013 -3.2937 -3.2937 -3.2908 -3.2908 -3.2585 -3.2585 -3.2499 -3.2499 -3.2144 -3.2144 0.8778 0.8779 0.9443 0.9443 1.0248 1.0248 2.7878 2.7878 3.3051 3.3051 3.3139 3.3139 3.8484 3.8484 3.9258 3.9258 3.9508 3.9508 4.7462 4.7462 4.9474 4.9474 5.0746 5.0746 5.2880 5.2880 5.3906 5.3906 5.5249 5.5249 8.2336 8.2336 8.2597 8.2597 8.6325 8.6325 8.8181 8.8181 8.9523 8.9523 9.0437 9.0437 9.6833 9.6833 9.7861 9.7861 k = 0.2000 0.2828 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0299 -6.0299 -5.8119 -5.8119 -5.7848 -5.7848 -5.7700 -5.7700 -5.5020 -5.5020 -5.4967 -5.4967 -5.4633 -5.4633 -5.3911 -5.3911 -5.3069 -5.3069 -5.2630 -5.2630 -3.3449 -3.3449 -3.3347 -3.3347 -3.3282 -3.3282 -3.3018 -3.3018 -3.2939 -3.2939 -3.2905 -3.2905 -3.2593 -3.2593 -3.2482 -3.2482 -3.2140 -3.2140 0.8568 0.8568 0.9415 0.9415 1.0509 1.0510 2.7827 2.7827 3.3025 3.3025 3.3181 3.3181 3.8498 3.8498 3.9240 3.9240 3.9655 3.9655 4.7194 4.7194 4.9457 4.9457 5.1062 5.1062 5.2653 5.2653 5.3700 5.3700 5.5571 5.5571 8.2126 8.2126 8.2575 8.2575 8.5656 8.5656 8.8073 8.8073 8.9708 8.9708 9.0960 9.0960 9.6614 9.6614 9.7917 9.7917 k = 0.1875 0.2652 0.6124 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0322 -6.0322 -5.8154 -5.8154 -5.7842 -5.7842 -5.7654 -5.7654 -5.5025 -5.5025 -5.4958 -5.4958 -5.4646 -5.4646 -5.3906 -5.3906 -5.3108 -5.3108 -5.2576 -5.2576 -3.3472 -3.3472 -3.3347 -3.3347 -3.3269 -3.3269 -3.3023 -3.3023 -3.2941 -3.2941 -3.2904 -3.2904 -3.2596 -3.2596 -3.2466 -3.2466 -3.2135 -3.2135 0.8368 0.8368 0.9380 0.9380 1.0774 1.0774 2.7756 2.7756 3.2995 3.2995 3.3257 3.3257 3.8499 3.8499 3.9215 3.9215 3.9841 3.9841 4.6896 4.6896 4.9480 4.9480 5.1374 5.1374 5.2432 5.2432 5.3460 5.3460 5.5898 5.5898 8.1866 8.1866 8.2541 8.2541 8.4992 8.4992 8.7983 8.7983 8.9897 8.9897 9.1452 9.1452 9.6436 9.6436 9.7966 9.7966 k = 0.1750 0.2475 0.6124 ( 8386 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0350 -6.0350 -5.8186 -5.8186 -5.7840 -5.7840 -5.7603 -5.7603 -5.5030 -5.5030 -5.4949 -5.4949 -5.4660 -5.4660 -5.3905 -5.3905 -5.3139 -5.3139 -5.2524 -5.2524 -3.3496 -3.3496 -3.3347 -3.3347 -3.3258 -3.3258 -3.3028 -3.3028 -3.2941 -3.2941 -3.2905 -3.2905 -3.2596 -3.2596 -3.2450 -3.2450 -3.2129 -3.2129 0.8179 0.8179 0.9340 0.9340 1.1038 1.1038 2.7662 2.7662 3.2959 3.2959 3.3377 3.3377 3.8487 3.8487 3.9178 3.9178 4.0055 4.0055 4.6586 4.6586 4.9530 4.9530 5.1670 5.1670 5.2228 5.2228 5.3194 5.3194 5.6222 5.6222 8.1561 8.1561 8.2489 8.2489 8.4346 8.4346 8.7924 8.7924 9.0090 9.0090 9.1898 9.1899 9.6304 9.6304 9.8008 9.8008 k = 0.1625 0.2298 0.6124 ( 8390 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0380 -6.0380 -5.8216 -5.8216 -5.7840 -5.7840 -5.7550 -5.7550 -5.5034 -5.5034 -5.4940 -5.4940 -5.4673 -5.4673 -5.3913 -5.3913 -5.3159 -5.3159 -5.2476 -5.2476 -3.3519 -3.3519 -3.3347 -3.3347 -3.3248 -3.3248 -3.3034 -3.3034 -3.2941 -3.2941 -3.2908 -3.2908 -3.2593 -3.2593 -3.2434 -3.2434 -3.2123 -3.2123 0.8001 0.8002 0.9296 0.9296 1.1302 1.1302 2.7547 2.7547 3.2919 3.2919 3.3547 3.3547 3.8464 3.8464 3.9129 3.9129 4.0283 4.0283 4.6275 4.6275 4.9597 4.9597 5.1880 5.1880 5.2103 5.2103 5.2916 5.2916 5.6538 5.6538 8.1215 8.1215 8.2416 8.2416 8.3732 8.3732 8.7903 8.7903 9.0286 9.0286 9.2289 9.2289 9.6219 9.6219 9.8040 9.8040 k = 0.1500 0.2121 0.6124 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0412 -6.0412 -5.8243 -5.8243 -5.7841 -5.7841 -5.7498 -5.7498 -5.5039 -5.5039 -5.4931 -5.4931 -5.4685 -5.4685 -5.3929 -5.3929 -5.3168 -5.3168 -5.2430 -5.2430 -3.3541 -3.3541 -3.3347 -3.3347 -3.3240 -3.3240 -3.3040 -3.3040 -3.2942 -3.2942 -3.2912 -3.2912 -3.2586 -3.2586 -3.2419 -3.2419 -3.2116 -3.2116 0.7836 0.7836 0.9248 0.9248 1.1561 1.1561 2.7413 2.7413 3.2877 3.2877 3.3770 3.3770 3.8434 3.8434 3.9068 3.9068 4.0510 4.0510 4.5973 4.5973 4.9672 4.9672 5.1782 5.1782 5.2238 5.2238 5.2680 5.2680 5.6842 5.6842 8.0833 8.0833 8.2312 8.2312 8.3170 8.3170 8.7927 8.7927 9.0482 9.0482 9.2618 9.2618 9.6182 9.6182 9.8053 9.8053 k = 0.1375 0.1945 0.6124 ( 8394 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0445 -6.0445 -5.8268 -5.8268 -5.7842 -5.7842 -5.7446 -5.7446 -5.5044 -5.5044 -5.4922 -5.4922 -5.4694 -5.4694 -5.3954 -5.3954 -5.3166 -5.3166 -5.2388 -5.2388 -3.3563 -3.3563 -3.3348 -3.3348 -3.3233 -3.3233 -3.3045 -3.3045 -3.2945 -3.2945 -3.2916 -3.2916 -3.2577 -3.2577 -3.2405 -3.2405 -3.2109 -3.2109 0.7683 0.7683 0.9199 0.9199 1.1814 1.1814 2.7265 2.7265 3.2832 3.2832 3.4045 3.4045 3.8399 3.8399 3.8995 3.8995 4.0724 4.0724 4.5686 4.5686 4.9743 4.9743 5.1602 5.1602 5.2207 5.2207 5.2695 5.2695 5.7130 5.7130 8.0421 8.0421 8.2152 8.2152 8.2695 8.2695 8.7997 8.7997 9.0676 9.0676 9.2885 9.2885 9.6186 9.6186 9.8041 9.8041 k = 0.1250 0.1768 0.6124 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0479 -6.0479 -5.8291 -5.8291 -5.7844 -5.7844 -5.7395 -5.7395 -5.5048 -5.5048 -5.4914 -5.4914 -5.4700 -5.4700 -5.3988 -5.3988 -5.3155 -5.3155 -5.2350 -5.2350 -3.3583 -3.3583 -3.3349 -3.3349 -3.3227 -3.3227 -3.3051 -3.3051 -3.2951 -3.2951 -3.2918 -3.2918 -3.2566 -3.2566 -3.2391 -3.2391 -3.2103 -3.2103 0.7542 0.7542 0.9149 0.9149 1.2058 1.2059 2.7107 2.7107 3.2787 3.2787 3.4369 3.4369 3.8358 3.8358 3.8913 3.8913 4.0911 4.0911 4.5418 4.5418 4.9798 4.9798 5.1407 5.1407 5.2019 5.2019 5.2902 5.2902 5.7399 5.7399 7.9986 7.9986 8.1881 8.1881 8.2371 8.2371 8.8113 8.8113 9.0864 9.0864 9.3092 9.3092 9.6224 9.6224 9.7994 9.7994 k = 0.1125 0.1591 0.6124 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0512 -6.0512 -5.8312 -5.8312 -5.7846 -5.7846 -5.7347 -5.7347 -5.5052 -5.5052 -5.4907 -5.4907 -5.4702 -5.4702 -5.4028 -5.4028 -5.3137 -5.3137 -5.2315 -5.2315 -3.3603 -3.3603 -3.3350 -3.3350 -3.3222 -3.3222 -3.3055 -3.3055 -3.2959 -3.2959 -3.2917 -3.2917 -3.2554 -3.2554 -3.2378 -3.2378 -3.2097 -3.2097 0.7415 0.7415 0.9099 0.9099 1.2291 1.2291 2.6946 2.6946 3.2742 3.2742 3.4737 3.4737 3.8313 3.8313 3.8826 3.8826 4.1059 4.1059 4.5173 4.5173 4.9820 4.9820 5.1210 5.1210 5.1858 5.1858 5.3126 5.3126 5.7647 5.7647 7.9542 7.9542 8.1526 8.1526 8.2177 8.2177 8.8271 8.8271 9.1042 9.1042 9.3245 9.3245 9.6283 9.6283 9.7906 9.7906 k = 0.1000 0.1414 0.6124 ( 8404 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0543 -6.0543 -5.8330 -5.8330 -5.7848 -5.7848 -5.7302 -5.7302 -5.5056 -5.5056 -5.4902 -5.4902 -5.4699 -5.4699 -5.4073 -5.4073 -5.3115 -5.3115 -5.2284 -5.2284 -3.3620 -3.3620 -3.3351 -3.3351 -3.3218 -3.3218 -3.3060 -3.3060 -3.2968 -3.2968 -3.2916 -3.2916 -3.2542 -3.2542 -3.2366 -3.2366 -3.2091 -3.2091 0.7300 0.7300 0.9052 0.9052 1.2510 1.2510 2.6786 2.6786 3.2698 3.2698 3.5143 3.5143 3.8263 3.8263 3.8741 3.8741 4.1156 4.1156 4.4951 4.4951 4.9787 4.9787 5.1044 5.1044 5.1746 5.1746 5.3338 5.3338 5.7873 5.7873 7.9102 7.9102 8.1172 8.1172 8.2032 8.2032 8.8468 8.8468 9.1206 9.1206 9.3353 9.3353 9.6348 9.6348 9.7779 9.7779 k = 0.0875 0.1237 0.6124 ( 8398 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0572 -6.0572 -5.8347 -5.8347 -5.7850 -5.7850 -5.7261 -5.7261 -5.5060 -5.5060 -5.4899 -5.4899 -5.4691 -5.4691 -5.4121 -5.4121 -5.3090 -5.3090 -5.2257 -5.2257 -3.3636 -3.3636 -3.3352 -3.3352 -3.3214 -3.3214 -3.3064 -3.3064 -3.2977 -3.2977 -3.2914 -3.2914 -3.2530 -3.2530 -3.2355 -3.2355 -3.2086 -3.2086 0.7199 0.7199 0.9007 0.9007 1.2712 1.2712 2.6635 2.6635 3.2657 3.2657 3.5579 3.5579 3.8206 3.8206 3.8662 3.8662 4.1193 4.1193 4.4754 4.4754 4.9688 4.9688 5.0941 5.0941 5.1674 5.1674 5.3531 5.3531 5.8074 5.8074 7.8680 7.8680 8.0851 8.0851 8.1904 8.1904 8.8695 8.8695 9.1353 9.1353 9.3423 9.3423 9.6395 9.6395 9.7629 9.7629 k = 0.0750 0.1061 0.6124 ( 8396 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0599 -6.0599 -5.8361 -5.8361 -5.7851 -5.7851 -5.7224 -5.7224 -5.5064 -5.5064 -5.4896 -5.4896 -5.4678 -5.4678 -5.4171 -5.4171 -5.3065 -5.3065 -5.2234 -5.2234 -3.3650 -3.3650 -3.3353 -3.3353 -3.3211 -3.3211 -3.3068 -3.3068 -3.2986 -3.2986 -3.2913 -3.2913 -3.2519 -3.2519 -3.2345 -3.2345 -3.2081 -3.2081 0.7111 0.7111 0.8966 0.8966 1.2894 1.2894 2.6494 2.6494 3.2620 3.2620 3.6036 3.6036 3.8146 3.8146 3.8597 3.8597 4.1162 4.1162 4.4583 4.4583 4.9540 4.9540 5.0899 5.0899 5.1630 5.1630 5.3701 5.3701 5.8250 5.8250 7.8291 7.8291 8.0569 8.0569 8.1789 8.1789 8.8945 8.8945 9.1476 9.1476 9.3465 9.3465 9.6392 9.6392 9.7494 9.7495 k = 0.0625 0.0884 0.6124 ( 8390 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0623 -6.0623 -5.8373 -5.8373 -5.7853 -5.7853 -5.7191 -5.7191 -5.5067 -5.5067 -5.4896 -5.4896 -5.4660 -5.4660 -5.4220 -5.4220 -5.3041 -5.3041 -5.2215 -5.2215 -3.3662 -3.3662 -3.3354 -3.3354 -3.3208 -3.3208 -3.3071 -3.3071 -3.2994 -3.2994 -3.2911 -3.2911 -3.2510 -3.2510 -3.2336 -3.2336 -3.2078 -3.2078 0.7036 0.7036 0.8930 0.8930 1.3053 1.3053 2.6370 2.6370 3.2586 3.2586 3.6500 3.6500 3.8087 3.8087 3.8548 3.8548 4.1059 4.1059 4.4437 4.4437 4.9375 4.9375 5.0897 5.0897 5.1608 5.1608 5.3848 5.3848 5.8400 5.8400 7.7943 7.7943 8.0329 8.0329 8.1688 8.1688 8.9209 8.9209 9.1572 9.1572 9.3486 9.3486 9.6312 9.6312 9.7416 9.7416 k = 0.0500 0.0707 0.6124 ( 8402 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9978 -25.9978 -25.9977 -25.9977 -6.0643 -6.0643 -5.8383 -5.8383 -5.7854 -5.7854 -5.7164 -5.7164 -5.5070 -5.5070 -5.4896 -5.4896 -5.4638 -5.4638 -5.4269 -5.4269 -5.3020 -5.3020 -5.2199 -5.2199 -3.3673 -3.3673 -3.3355 -3.3355 -3.3205 -3.3205 -3.3074 -3.3074 -3.3001 -3.3001 -3.2909 -3.2909 -3.2501 -3.2501 -3.2328 -3.2328 -3.2075 -3.2075 0.6975 0.6975 0.8900 0.8900 1.3187 1.3187 2.6264 2.6264 3.2558 3.2558 3.6950 3.6950 3.8044 3.8044 3.8520 3.8520 4.0885 4.0885 4.4318 4.4318 4.9222 4.9222 5.0912 5.0912 5.1600 5.1600 5.3970 5.3970 5.8523 5.8523 7.7648 7.7648 8.0130 8.0130 8.1602 8.1602 8.9474 8.9474 9.1638 9.1638 9.3490 9.3490 9.6165 9.6165 9.7401 9.7401 k = 0.0375 0.0530 0.6124 ( 8388 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0659 -6.0659 -5.8391 -5.8391 -5.7855 -5.7855 -5.7142 -5.7142 -5.5072 -5.5072 -5.4896 -5.4896 -5.4614 -5.4614 -5.4314 -5.4314 -5.3002 -5.3002 -5.2187 -5.2187 -3.3680 -3.3680 -3.3356 -3.3356 -3.3203 -3.3203 -3.3077 -3.3077 -3.3007 -3.3007 -3.2908 -3.2908 -3.2494 -3.2494 -3.2322 -3.2322 -3.2072 -3.2072 0.6928 0.6928 0.8876 0.8876 1.3294 1.3295 2.6179 2.6179 3.2536 3.2536 3.7338 3.7338 3.8046 3.8046 3.8520 3.8520 4.0649 4.0649 4.4225 4.4225 4.9097 4.9097 5.0932 5.0932 5.1600 5.1600 5.4065 5.4065 5.8619 5.8619 7.7412 7.7412 7.9975 7.9975 8.1533 8.1533 8.9723 8.9723 9.1672 9.1672 9.3485 9.3485 9.5993 9.5993 9.7425 9.7425 k = 0.0250 0.0354 0.6124 ( 8378 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0670 -6.0670 -5.8396 -5.8396 -5.7856 -5.7856 -5.7127 -5.7127 -5.5073 -5.5073 -5.4897 -5.4897 -5.4589 -5.4589 -5.4353 -5.4353 -5.2989 -5.2989 -5.2178 -5.2178 -3.3686 -3.3686 -3.3357 -3.3357 -3.3202 -3.3202 -3.3078 -3.3078 -3.3011 -3.3011 -3.2907 -3.2907 -3.2490 -3.2490 -3.2317 -3.2317 -3.2071 -3.2071 0.6894 0.6894 0.8858 0.8858 1.3372 1.3372 2.6117 2.6117 3.2519 3.2519 3.7572 3.7572 3.8134 3.8134 3.8581 3.8581 4.0372 4.0372 4.4160 4.4160 4.9006 4.9006 5.0950 5.0950 5.1605 5.1605 5.4134 5.4134 5.8688 5.8688 7.7239 7.7239 7.9863 7.9863 8.1482 8.1482 8.9935 8.9935 9.1679 9.1679 9.3475 9.3475 9.5842 9.5842 9.7459 9.7459 k = 0.0125 0.0177 0.6124 ( 8382 PWs) bands (ev): -61.8102 -61.8102 -34.6919 -34.6919 -25.9977 -25.9977 -25.9977 -25.9977 -6.0677 -6.0677 -5.8400 -5.8400 -5.7857 -5.7857 -5.7117 -5.7117 -5.5074 -5.5074 -5.4897 -5.4897 -5.4568 -5.4568 -5.4383 -5.4383 -5.2981 -5.2981 -5.2173 -5.2173 -3.3690 -3.3690 -3.3357 -3.3357 -3.3201 -3.3201 -3.3080 -3.3080 -3.3013 -3.3013 -3.2906 -3.2906 -3.2487 -3.2487 -3.2314 -3.2314 -3.2070 -3.2070 0.6873 0.6873 0.8847 0.8847 1.3420 1.3420 2.6079 2.6079 3.2509 3.2509 3.7646 3.7646 3.8231 3.8231 3.8736 3.8736 4.0107 4.0107 4.4120 4.4120 4.8951 4.8951 5.0961 5.0961 5.1609 5.1609 5.4175 5.4175 5.8730 5.8730 7.7134 7.7134 7.9796 7.9796 8.1452 8.1452 9.0081 9.0081 9.1672 9.1672 9.3466 9.3466 9.5740 9.5740 9.7485 9.7485 k = 0.0000 0.0000 0.6124 ( 8366 PWs) bands (ev): -61.8102 -61.8102 -34.6918 -34.6918 -25.9977 -25.9977 -25.9977 -25.9977 -6.0679 -6.0679 -5.8401 -5.8401 -5.7857 -5.7857 -5.7114 -5.7114 -5.5075 -5.5075 -5.4897 -5.4897 -5.4559 -5.4559 -5.4395 -5.4395 -5.2978 -5.2978 -5.2172 -5.2172 -3.3691 -3.3691 -3.3357 -3.3357 -3.3201 -3.3201 -3.3080 -3.3080 -3.3014 -3.3014 -3.2906 -3.2906 -3.2486 -3.2486 -3.2313 -3.2313 -3.2069 -3.2069 0.6867 0.6867 0.8844 0.8844 1.3436 1.3436 2.6067 2.6067 3.2506 3.2506 3.7660 3.7660 3.8258 3.8258 3.8843 3.8843 3.9981 3.9981 4.4107 4.4107 4.8933 4.8933 5.0965 5.0965 5.1611 5.1611 5.4189 5.4189 5.8744 5.8744 7.7099 7.7099 7.9773 7.9773 8.1442 8.1442 9.0134 9.0134 9.1666 9.1666 9.3463 9.3463 9.5704 9.5704 9.7495 9.7495 Writing output data file TaTl3Se4.save init_run : 2.58s CPU 14.00s WALL ( 1 calls) electrons : 1188.86s CPU 1199.11s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.32s CPU 1.56s WALL ( 1 calls) Called by electrons: c_bands : 1188.82s CPU 1198.70s WALL ( 1 calls) v_of_rho : 0.10s CPU 1.03s WALL ( 1 calls) v_h : 0.01s CPU 0.12s WALL ( 1 calls) v_xc : 0.08s CPU 0.64s WALL ( 1 calls) newd : 0.42s CPU 0.67s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.12s WALL ( 194 calls) cegterg : 1118.61s CPU 1126.00s WALL ( 357 calls) Called by sum_band: Called by *egterg: h_psi : 542.62s CPU 547.69s WALL ( 4720 calls) s_psi : 38.50s CPU 38.57s WALL ( 4720 calls) g_psi : 1.17s CPU 1.17s WALL ( 4169 calls) cdiaghg : 386.88s CPU 386.62s WALL ( 4363 calls) cegterg:over : 97.98s CPU 97.67s WALL ( 4169 calls) cegterg:upda : 36.46s CPU 37.25s WALL ( 4169 calls) cegterg:last : 28.71s CPU 28.95s WALL ( 939 calls) Called by h_psi: h_psi:vloc : 464.45s CPU 467.92s WALL ( 4720 calls) h_psi:vnl : 77.34s CPU 78.55s WALL ( 4720 calls) add_vuspsi : 30.58s CPU 31.96s WALL ( 4720 calls) General routines calbec : 46.73s CPU 46.44s WALL ( 4720 calls) fft : 0.24s CPU 1.18s WALL ( 19 calls) ffts : 0.04s CPU 0.04s WALL ( 4 calls) fftw : 440.79s CPU 441.71s WALL ( 1080800 calls) interpolate : 0.06s CPU 0.07s WALL ( 4 calls) davcio : 0.03s CPU 1.81s WALL ( 388 calls) Parallel routines fft_scatter : 249.97s CPU 251.10s WALL ( 1080823 calls) PWSCF : 21m 2.09s CPU 23m14.48s WALL This run was terminated on: 7:38:53 1Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=