Program PWSCF v.5.1.1 starts on 13Oct2015 at 22: 6:57 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: ./CaBiAu.save/ file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 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 48 21 6 3196 909 140 Max 49 22 7 3209 932 147 Sum 2347 1027 301 153895 44183 6851 bravais-lattice index = 14 lattice parameter (alat) = 8.9841 a.u. unit-cell volume = 1044.8610 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 424.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.984135 celldm(2)= 1.000000 celldm(3)= 1.663792 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 1.663792 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.601037 ) PseudoPot. # 1 for Bi read from file: /home/autes/Pseudo/Bi_MT_PBE.UPF MD5 check sum: b574f8a1102dd4d1778b4090b55884d0 Pseudo is Norm-conserving, Zval = 5.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1283 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Ca read from file: /home/autes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1169 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Au read from file: /home/autes/Pseudo/Au.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d39daeb1f194fdf5670f47ad6d8ea3dd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1279 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 Bi 5.00 208.98040 Bi( 1.00) Ca 10.00 40.07800 Ca( 1.00) Au 11.00 196.96660 Au( 1.00) 12 Sym. Ops. (no inversion) found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 3 60 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 3) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 4 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 4) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 5 120 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 6) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 9) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 10 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8318960 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_6v (6mm) there are 9 classes and 3 irreducible representations the character table: E -E C2 2C3 -2C3 2C6 -2C6 3s_v 3s_d -C2 -3s_v -3s_d G_7 2.00 -2.00 0.00 1.00 -1.00 1.73 -1.73 0.00 0.00 G_8 2.00 -2.00 0.00 1.00 -1.00 -1.73 1.73 0.00 0.00 G_9 2.00 -2.00 0.00 -2.00 2.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C6 3 4 2C3 5 6 3s_v-3s_v 7 -7 9 10 -10 -9 3s_d-3s_d 8 -8 12 -11 11 -12 -E -1 -2C6 -3 -4 -2C3 -5 -6 Cartesian axes number of k points= 283 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 2) = ( 0.0128205 0.0074019 -0.0000000), wk = 0.0035336 k( 3) = ( 0.0256410 0.0148039 -0.0000000), wk = 0.0035336 k( 4) = ( 0.0384615 0.0222058 -0.0000000), wk = 0.0035336 k( 5) = ( 0.0512821 0.0296077 -0.0000000), wk = 0.0035336 k( 6) = ( 0.0641026 0.0370096 -0.0000000), wk = 0.0035336 k( 7) = ( 0.0769231 0.0444116 -0.0000000), wk = 0.0035336 k( 8) = ( 0.0897436 0.0518135 -0.0000000), wk = 0.0035336 k( 9) = ( 0.1025641 0.0592154 -0.0000000), wk = 0.0035336 k( 10) = ( 0.1153846 0.0666173 -0.0000000), wk = 0.0035336 k( 11) = ( 0.1282051 0.0740193 -0.0000000), wk = 0.0035336 k( 12) = ( 0.1410256 0.0814212 -0.0000000), wk = 0.0035336 k( 13) = ( 0.1538461 0.0888231 -0.0000000), wk = 0.0035336 k( 14) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0035336 k( 15) = ( 0.1794872 0.1036270 -0.0000000), wk = 0.0035336 k( 16) = ( 0.1923077 0.1110289 -0.0000000), wk = 0.0035336 k( 17) = ( 0.2051282 0.1184308 -0.0000000), wk = 0.0035336 k( 18) = ( 0.2179487 0.1258328 -0.0000000), wk = 0.0035336 k( 19) = ( 0.2307692 0.1332347 -0.0000000), wk = 0.0035336 k( 20) = ( 0.2435897 0.1406366 -0.0000000), wk = 0.0035336 k( 21) = ( 0.2564103 0.1480385 -0.0000000), wk = 0.0035336 k( 22) = ( 0.2692308 0.1554405 -0.0000000), wk = 0.0035336 k( 23) = ( 0.2820513 0.1628424 -0.0000000), wk = 0.0035336 k( 24) = ( 0.2948718 0.1702443 -0.0000000), wk = 0.0035336 k( 25) = ( 0.3076923 0.1776462 -0.0000000), wk = 0.0035336 k( 26) = ( 0.3205128 0.1850482 -0.0000000), wk = 0.0035336 k( 27) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0035336 k( 28) = ( 0.3461538 0.1998520 -0.0000000), wk = 0.0035336 k( 29) = ( 0.3589744 0.2072539 -0.0000000), wk = 0.0035336 k( 30) = ( 0.3717949 0.2146559 -0.0000000), wk = 0.0035336 k( 31) = ( 0.3846154 0.2220578 -0.0000000), wk = 0.0035336 k( 32) = ( 0.3974359 0.2294597 -0.0000000), wk = 0.0035336 k( 33) = ( 0.4102564 0.2368616 -0.0000000), wk = 0.0035336 k( 34) = ( 0.4230769 0.2442636 -0.0000000), wk = 0.0035336 k( 35) = ( 0.4358974 0.2516655 -0.0000000), wk = 0.0035336 k( 36) = ( 0.4487179 0.2590674 -0.0000000), wk = 0.0035336 k( 37) = ( 0.4615385 0.2664694 -0.0000000), wk = 0.0035336 k( 38) = ( 0.4743590 0.2738713 -0.0000000), wk = 0.0035336 k( 39) = ( 0.4871795 0.2812732 -0.0000000), wk = 0.0035336 k( 40) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035336 k( 41) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035336 k( 42) = ( 0.4927536 0.3012262 -0.0000000), wk = 0.0035336 k( 43) = ( 0.4855073 0.3137773 -0.0000000), wk = 0.0035336 k( 44) = ( 0.4782609 0.3263284 -0.0000000), wk = 0.0035336 k( 45) = ( 0.4710145 0.3388795 -0.0000000), wk = 0.0035336 k( 46) = ( 0.4637681 0.3514306 -0.0000000), wk = 0.0035336 k( 47) = ( 0.4565217 0.3639817 -0.0000000), wk = 0.0035336 k( 48) = ( 0.4492754 0.3765328 -0.0000000), wk = 0.0035336 k( 49) = ( 0.4420290 0.3890839 -0.0000000), wk = 0.0035336 k( 50) = ( 0.4347826 0.4016350 -0.0000000), wk = 0.0035336 k( 51) = ( 0.4275362 0.4141861 -0.0000000), wk = 0.0035336 k( 52) = ( 0.4202899 0.4267372 -0.0000000), wk = 0.0035336 k( 53) = ( 0.4130435 0.4392882 -0.0000000), wk = 0.0035336 k( 54) = ( 0.4057971 0.4518393 -0.0000000), wk = 0.0035336 k( 55) = ( 0.3985507 0.4643904 -0.0000000), wk = 0.0035336 k( 56) = ( 0.3913044 0.4769415 -0.0000000), wk = 0.0035336 k( 57) = ( 0.3840580 0.4894926 -0.0000000), wk = 0.0035336 k( 58) = ( 0.3768116 0.5020437 -0.0000000), wk = 0.0035336 k( 59) = ( 0.3695652 0.5145948 -0.0000000), wk = 0.0035336 k( 60) = ( 0.3623188 0.5271459 -0.0000000), wk = 0.0035336 k( 61) = ( 0.3550725 0.5396970 -0.0000000), wk = 0.0035336 k( 62) = ( 0.3478261 0.5522481 -0.0000000), wk = 0.0035336 k( 63) = ( 0.3405797 0.5647992 -0.0000000), wk = 0.0035336 k( 64) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035336 k( 65) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035336 k( 66) = ( 0.3259259 0.5645203 -0.0000000), wk = 0.0035336 k( 67) = ( 0.3185185 0.5516903 -0.0000000), wk = 0.0035336 k( 68) = ( 0.3111111 0.5388602 -0.0000000), wk = 0.0035336 k( 69) = ( 0.3037037 0.5260302 -0.0000000), wk = 0.0035336 k( 70) = ( 0.2962963 0.5132002 -0.0000000), wk = 0.0035336 k( 71) = ( 0.2888889 0.5003702 -0.0000000), wk = 0.0035336 k( 72) = ( 0.2814815 0.4875402 -0.0000000), wk = 0.0035336 k( 73) = ( 0.2740741 0.4747102 -0.0000000), wk = 0.0035336 k( 74) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0035336 k( 75) = ( 0.2592593 0.4490502 -0.0000000), wk = 0.0035336 k( 76) = ( 0.2518518 0.4362202 -0.0000000), wk = 0.0035336 k( 77) = ( 0.2444444 0.4233902 -0.0000000), wk = 0.0035336 k( 78) = ( 0.2370370 0.4105602 -0.0000000), wk = 0.0035336 k( 79) = ( 0.2296296 0.3977302 -0.0000000), wk = 0.0035336 k( 80) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0035336 k( 81) = ( 0.2148148 0.3720702 -0.0000000), wk = 0.0035336 k( 82) = ( 0.2074074 0.3592402 -0.0000000), wk = 0.0035336 k( 83) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0035336 k( 84) = ( 0.1925926 0.3335802 -0.0000000), wk = 0.0035336 k( 85) = ( 0.1851852 0.3207502 -0.0000000), wk = 0.0035336 k( 86) = ( 0.1777778 0.3079201 -0.0000000), wk = 0.0035336 k( 87) = ( 0.1703704 0.2950901 -0.0000000), wk = 0.0035336 k( 88) = ( 0.1629630 0.2822601 -0.0000000), wk = 0.0035336 k( 89) = ( 0.1555556 0.2694301 -0.0000000), wk = 0.0035336 k( 90) = ( 0.1481482 0.2566001 -0.0000000), wk = 0.0035336 k( 91) = ( 0.1407407 0.2437701 -0.0000000), wk = 0.0035336 k( 92) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0035336 k( 93) = ( 0.1259259 0.2181101 -0.0000000), wk = 0.0035336 k( 94) = ( 0.1185185 0.2052801 -0.0000000), wk = 0.0035336 k( 95) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0035336 k( 96) = ( 0.1037037 0.1796201 -0.0000000), wk = 0.0035336 k( 97) = ( 0.0962963 0.1667901 -0.0000000), wk = 0.0035336 k( 98) = ( 0.0888889 0.1539601 -0.0000000), wk = 0.0035336 k( 99) = ( 0.0814815 0.1411301 -0.0000000), wk = 0.0035336 k( 100) = ( 0.0740741 0.1283001 -0.0000000), wk = 0.0035336 k( 101) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0035336 k( 102) = ( 0.0592593 0.1026400 -0.0000000), wk = 0.0035336 k( 103) = ( 0.0518518 0.0898100 -0.0000000), wk = 0.0035336 k( 104) = ( 0.0444444 0.0769800 -0.0000000), wk = 0.0035336 k( 105) = ( 0.0370370 0.0641500 -0.0000000), wk = 0.0035336 k( 106) = ( 0.0296296 0.0513200 -0.0000000), wk = 0.0035336 k( 107) = ( 0.0222222 0.0384900 -0.0000000), wk = 0.0035336 k( 108) = ( 0.0148148 0.0256600 -0.0000000), wk = 0.0035336 k( 109) = ( 0.0074074 0.0128300 -0.0000000), wk = 0.0035336 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 112) = ( 0.0000000 0.0000000 0.0150259), wk = 0.0035336 k( 113) = ( 0.0000000 0.0000000 0.0300518), wk = 0.0035336 k( 114) = ( 0.0000000 0.0000000 0.0450777), wk = 0.0035336 k( 115) = ( 0.0000000 0.0000000 0.0601037), wk = 0.0035336 k( 116) = ( 0.0000000 0.0000000 0.0751296), wk = 0.0035336 k( 117) = ( 0.0000000 0.0000000 0.0901555), wk = 0.0035336 k( 118) = ( 0.0000000 0.0000000 0.1051814), wk = 0.0035336 k( 119) = ( 0.0000000 0.0000000 0.1202073), wk = 0.0035336 k( 120) = ( 0.0000000 0.0000000 0.1352332), wk = 0.0035336 k( 121) = ( 0.0000000 0.0000000 0.1502592), wk = 0.0035336 k( 122) = ( 0.0000000 0.0000000 0.1652851), wk = 0.0035336 k( 123) = ( 0.0000000 0.0000000 0.1803110), wk = 0.0035336 k( 124) = ( 0.0000000 0.0000000 0.1953369), wk = 0.0035336 k( 125) = ( 0.0000000 0.0000000 0.2103628), wk = 0.0035336 k( 126) = ( 0.0000000 0.0000000 0.2253887), wk = 0.0035336 k( 127) = ( 0.0000000 0.0000000 0.2404147), wk = 0.0035336 k( 128) = ( 0.0000000 0.0000000 0.2554406), wk = 0.0035336 k( 129) = ( 0.0000000 0.0000000 0.2704665), wk = 0.0035336 k( 130) = ( 0.0000000 0.0000000 0.2854924), wk = 0.0035336 k( 131) = ( 0.0000000 0.0000000 0.3005183), wk = 0.0035336 k( 132) = ( 0.0000000 0.0000000 0.3005183), wk = 0.0035336 k( 133) = ( 0.0128205 0.0074019 0.3005183), wk = 0.0035336 k( 134) = ( 0.0256410 0.0148039 0.3005183), wk = 0.0035336 k( 135) = ( 0.0384615 0.0222058 0.3005183), wk = 0.0035336 k( 136) = ( 0.0512821 0.0296077 0.3005183), wk = 0.0035336 k( 137) = ( 0.0641026 0.0370096 0.3005183), wk = 0.0035336 k( 138) = ( 0.0769231 0.0444116 0.3005183), wk = 0.0035336 k( 139) = ( 0.0897436 0.0518135 0.3005183), wk = 0.0035336 k( 140) = ( 0.1025641 0.0592154 0.3005183), wk = 0.0035336 k( 141) = ( 0.1153846 0.0666173 0.3005183), wk = 0.0035336 k( 142) = ( 0.1282051 0.0740193 0.3005183), wk = 0.0035336 k( 143) = ( 0.1410256 0.0814212 0.3005183), wk = 0.0035336 k( 144) = ( 0.1538461 0.0888231 0.3005183), wk = 0.0035336 k( 145) = ( 0.1666667 0.0962250 0.3005183), wk = 0.0035336 k( 146) = ( 0.1794872 0.1036270 0.3005183), wk = 0.0035336 k( 147) = ( 0.1923077 0.1110289 0.3005183), wk = 0.0035336 k( 148) = ( 0.2051282 0.1184308 0.3005183), wk = 0.0035336 k( 149) = ( 0.2179487 0.1258328 0.3005183), wk = 0.0035336 k( 150) = ( 0.2307692 0.1332347 0.3005183), wk = 0.0035336 k( 151) = ( 0.2435897 0.1406366 0.3005183), wk = 0.0035336 k( 152) = ( 0.2564103 0.1480385 0.3005183), wk = 0.0035336 k( 153) = ( 0.2692308 0.1554405 0.3005183), wk = 0.0035336 k( 154) = ( 0.2820513 0.1628424 0.3005183), wk = 0.0035336 k( 155) = ( 0.2948718 0.1702443 0.3005183), wk = 0.0035336 k( 156) = ( 0.3076923 0.1776462 0.3005183), wk = 0.0035336 k( 157) = ( 0.3205128 0.1850482 0.3005183), wk = 0.0035336 k( 158) = ( 0.3333333 0.1924501 0.3005183), wk = 0.0035336 k( 159) = ( 0.3461538 0.1998520 0.3005183), wk = 0.0035336 k( 160) = ( 0.3589744 0.2072539 0.3005183), wk = 0.0035336 k( 161) = ( 0.3717949 0.2146559 0.3005183), wk = 0.0035336 k( 162) = ( 0.3846154 0.2220578 0.3005183), wk = 0.0035336 k( 163) = ( 0.3974359 0.2294597 0.3005183), wk = 0.0035336 k( 164) = ( 0.4102564 0.2368616 0.3005183), wk = 0.0035336 k( 165) = ( 0.4230769 0.2442636 0.3005183), wk = 0.0035336 k( 166) = ( 0.4358974 0.2516655 0.3005183), wk = 0.0035336 k( 167) = ( 0.4487179 0.2590674 0.3005183), wk = 0.0035336 k( 168) = ( 0.4615385 0.2664694 0.3005183), wk = 0.0035336 k( 169) = ( 0.4743590 0.2738713 0.3005183), wk = 0.0035336 k( 170) = ( 0.4871795 0.2812732 0.3005183), wk = 0.0035336 k( 171) = ( 0.5000000 0.2886751 0.3005183), wk = 0.0035336 k( 172) = ( 0.5000000 0.2886751 0.3005183), wk = 0.0035336 k( 173) = ( 0.4927536 0.3012262 0.3005183), wk = 0.0035336 k( 174) = ( 0.4855073 0.3137773 0.3005183), wk = 0.0035336 k( 175) = ( 0.4782609 0.3263284 0.3005183), wk = 0.0035336 k( 176) = ( 0.4710145 0.3388795 0.3005183), wk = 0.0035336 k( 177) = ( 0.4637681 0.3514306 0.3005183), wk = 0.0035336 k( 178) = ( 0.4565217 0.3639817 0.3005183), wk = 0.0035336 k( 179) = ( 0.4492754 0.3765328 0.3005183), wk = 0.0035336 k( 180) = ( 0.4420290 0.3890839 0.3005183), wk = 0.0035336 k( 181) = ( 0.4347826 0.4016350 0.3005183), wk = 0.0035336 k( 182) = ( 0.4275362 0.4141861 0.3005183), wk = 0.0035336 k( 183) = ( 0.4202899 0.4267372 0.3005183), wk = 0.0035336 k( 184) = ( 0.4130435 0.4392882 0.3005183), wk = 0.0035336 k( 185) = ( 0.4057971 0.4518393 0.3005183), wk = 0.0035336 k( 186) = ( 0.3985507 0.4643904 0.3005183), wk = 0.0035336 k( 187) = ( 0.3913044 0.4769415 0.3005183), wk = 0.0035336 k( 188) = ( 0.3840580 0.4894926 0.3005183), wk = 0.0035336 k( 189) = ( 0.3768116 0.5020437 0.3005183), wk = 0.0035336 k( 190) = ( 0.3695652 0.5145948 0.3005183), wk = 0.0035336 k( 191) = ( 0.3623188 0.5271459 0.3005183), wk = 0.0035336 k( 192) = ( 0.3550725 0.5396970 0.3005183), wk = 0.0035336 k( 193) = ( 0.3478261 0.5522481 0.3005183), wk = 0.0035336 k( 194) = ( 0.3405797 0.5647992 0.3005183), wk = 0.0035336 k( 195) = ( 0.3333333 0.5773503 0.3005183), wk = 0.0035336 k( 196) = ( 0.3333333 0.5773503 0.3005183), wk = 0.0035336 k( 197) = ( 0.3259259 0.5645203 0.3005183), wk = 0.0035336 k( 198) = ( 0.3185185 0.5516903 0.3005183), wk = 0.0035336 k( 199) = ( 0.3111111 0.5388602 0.3005183), wk = 0.0035336 k( 200) = ( 0.3037037 0.5260302 0.3005183), wk = 0.0035336 k( 201) = ( 0.2962963 0.5132002 0.3005183), wk = 0.0035336 k( 202) = ( 0.2888889 0.5003702 0.3005183), wk = 0.0035336 k( 203) = ( 0.2814815 0.4875402 0.3005183), wk = 0.0035336 k( 204) = ( 0.2740741 0.4747102 0.3005183), wk = 0.0035336 k( 205) = ( 0.2666667 0.4618802 0.3005183), wk = 0.0035336 k( 206) = ( 0.2592593 0.4490502 0.3005183), wk = 0.0035336 k( 207) = ( 0.2518518 0.4362202 0.3005183), wk = 0.0035336 k( 208) = ( 0.2444444 0.4233902 0.3005183), wk = 0.0035336 k( 209) = ( 0.2370370 0.4105602 0.3005183), wk = 0.0035336 k( 210) = ( 0.2296296 0.3977302 0.3005183), wk = 0.0035336 k( 211) = ( 0.2222222 0.3849002 0.3005183), wk = 0.0035336 k( 212) = ( 0.2148148 0.3720702 0.3005183), wk = 0.0035336 k( 213) = ( 0.2074074 0.3592402 0.3005183), wk = 0.0035336 k( 214) = ( 0.2000000 0.3464102 0.3005183), wk = 0.0035336 k( 215) = ( 0.1925926 0.3335802 0.3005183), wk = 0.0035336 k( 216) = ( 0.1851852 0.3207502 0.3005183), wk = 0.0035336 k( 217) = ( 0.1777778 0.3079201 0.3005183), wk = 0.0035336 k( 218) = ( 0.1703704 0.2950901 0.3005183), wk = 0.0035336 k( 219) = ( 0.1629630 0.2822601 0.3005183), wk = 0.0035336 k( 220) = ( 0.1555556 0.2694301 0.3005183), wk = 0.0035336 k( 221) = ( 0.1481482 0.2566001 0.3005183), wk = 0.0035336 k( 222) = ( 0.1407407 0.2437701 0.3005183), wk = 0.0035336 k( 223) = ( 0.1333333 0.2309401 0.3005183), wk = 0.0035336 k( 224) = ( 0.1259259 0.2181101 0.3005183), wk = 0.0035336 k( 225) = ( 0.1185185 0.2052801 0.3005183), wk = 0.0035336 k( 226) = ( 0.1111111 0.1924501 0.3005183), wk = 0.0035336 k( 227) = ( 0.1037037 0.1796201 0.3005183), wk = 0.0035336 k( 228) = ( 0.0962963 0.1667901 0.3005183), wk = 0.0035336 k( 229) = ( 0.0888889 0.1539601 0.3005183), wk = 0.0035336 k( 230) = ( 0.0814815 0.1411301 0.3005183), wk = 0.0035336 k( 231) = ( 0.0740741 0.1283001 0.3005183), wk = 0.0035336 k( 232) = ( 0.0666667 0.1154701 0.3005183), wk = 0.0035336 k( 233) = ( 0.0592593 0.1026400 0.3005183), wk = 0.0035336 k( 234) = ( 0.0518518 0.0898100 0.3005183), wk = 0.0035336 k( 235) = ( 0.0444444 0.0769800 0.3005183), wk = 0.0035336 k( 236) = ( 0.0370370 0.0641500 0.3005183), wk = 0.0035336 k( 237) = ( 0.0296296 0.0513200 0.3005183), wk = 0.0035336 k( 238) = ( 0.0222222 0.0384900 0.3005183), wk = 0.0035336 k( 239) = ( 0.0148148 0.0256600 0.3005183), wk = 0.0035336 k( 240) = ( 0.0074074 0.0128300 0.3005183), wk = 0.0035336 k( 241) = ( 0.0000000 0.0000000 0.3005183), wk = 0.0035336 k( 242) = ( 0.5000000 0.2886751 0.3005183), wk = 0.0035336 k( 243) = ( 0.5000000 0.2886751 0.2854924), wk = 0.0035336 k( 244) = ( 0.5000000 0.2886751 0.2704665), wk = 0.0035336 k( 245) = ( 0.5000000 0.2886751 0.2554406), wk = 0.0035336 k( 246) = ( 0.5000000 0.2886751 0.2404147), wk = 0.0035336 k( 247) = ( 0.5000000 0.2886751 0.2253887), wk = 0.0035336 k( 248) = ( 0.5000000 0.2886751 0.2103628), wk = 0.0035336 k( 249) = ( 0.5000000 0.2886751 0.1953369), wk = 0.0035336 k( 250) = ( 0.5000000 0.2886751 0.1803110), wk = 0.0035336 k( 251) = ( 0.5000000 0.2886751 0.1652851), wk = 0.0035336 k( 252) = ( 0.5000000 0.2886751 0.1502592), wk = 0.0035336 k( 253) = ( 0.5000000 0.2886751 0.1352332), wk = 0.0035336 k( 254) = ( 0.5000000 0.2886751 0.1202073), wk = 0.0035336 k( 255) = ( 0.5000000 0.2886751 0.1051814), wk = 0.0035336 k( 256) = ( 0.5000000 0.2886751 0.0901555), wk = 0.0035336 k( 257) = ( 0.5000000 0.2886751 0.0751296), wk = 0.0035336 k( 258) = ( 0.5000000 0.2886751 0.0601037), wk = 0.0035336 k( 259) = ( 0.5000000 0.2886751 0.0450777), wk = 0.0035336 k( 260) = ( 0.5000000 0.2886751 0.0300518), wk = 0.0035336 k( 261) = ( 0.5000000 0.2886751 0.0150259), wk = 0.0035336 k( 262) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0035336 k( 263) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0035336 k( 264) = ( 0.3333333 0.5773503 0.0150259), wk = 0.0035336 k( 265) = ( 0.3333333 0.5773503 0.0300518), wk = 0.0035336 k( 266) = ( 0.3333333 0.5773503 0.0450777), wk = 0.0035336 k( 267) = ( 0.3333333 0.5773503 0.0601037), wk = 0.0035336 k( 268) = ( 0.3333333 0.5773503 0.0751296), wk = 0.0035336 k( 269) = ( 0.3333333 0.5773503 0.0901555), wk = 0.0035336 k( 270) = ( 0.3333333 0.5773503 0.1051814), wk = 0.0035336 k( 271) = ( 0.3333333 0.5773503 0.1202073), wk = 0.0035336 k( 272) = ( 0.3333333 0.5773503 0.1352332), wk = 0.0035336 k( 273) = ( 0.3333333 0.5773503 0.1502592), wk = 0.0035336 k( 274) = ( 0.3333333 0.5773503 0.1652851), wk = 0.0035336 k( 275) = ( 0.3333333 0.5773503 0.1803110), wk = 0.0035336 k( 276) = ( 0.3333333 0.5773503 0.1953369), wk = 0.0035336 k( 277) = ( 0.3333333 0.5773503 0.2103628), wk = 0.0035336 k( 278) = ( 0.3333333 0.5773503 0.2253887), wk = 0.0035336 k( 279) = ( 0.3333333 0.5773503 0.2404147), wk = 0.0035336 k( 280) = ( 0.3333333 0.5773503 0.2554406), wk = 0.0035336 k( 281) = ( 0.3333333 0.5773503 0.2704665), wk = 0.0035336 k( 282) = ( 0.3333333 0.5773503 0.2854924), wk = 0.0035336 k( 283) = ( 0.3333333 0.5773503 0.3005183), wk = 0.0035336 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 2) = ( 0.0128205 0.0000000 0.0000000), wk = 0.0035336 k( 3) = ( 0.0256410 0.0000000 0.0000000), wk = 0.0035336 k( 4) = ( 0.0384615 0.0000000 0.0000000), wk = 0.0035336 k( 5) = ( 0.0512821 0.0000000 0.0000000), wk = 0.0035336 k( 6) = ( 0.0641026 0.0000000 0.0000000), wk = 0.0035336 k( 7) = ( 0.0769231 0.0000000 0.0000000), wk = 0.0035336 k( 8) = ( 0.0897436 0.0000000 0.0000000), wk = 0.0035336 k( 9) = ( 0.1025641 0.0000000 0.0000000), wk = 0.0035336 k( 10) = ( 0.1153846 0.0000000 0.0000000), wk = 0.0035336 k( 11) = ( 0.1282051 0.0000000 0.0000000), wk = 0.0035336 k( 12) = ( 0.1410256 0.0000000 0.0000000), wk = 0.0035336 k( 13) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0035336 k( 14) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0035336 k( 15) = ( 0.1794872 0.0000000 0.0000000), wk = 0.0035336 k( 16) = ( 0.1923077 0.0000000 0.0000000), wk = 0.0035336 k( 17) = ( 0.2051282 0.0000000 0.0000000), wk = 0.0035336 k( 18) = ( 0.2179487 0.0000000 0.0000000), wk = 0.0035336 k( 19) = ( 0.2307692 0.0000000 0.0000000), wk = 0.0035336 k( 20) = ( 0.2435897 0.0000000 -0.0000000), wk = 0.0035336 k( 21) = ( 0.2564103 0.0000000 0.0000000), wk = 0.0035336 k( 22) = ( 0.2692308 0.0000000 0.0000000), wk = 0.0035336 k( 23) = ( 0.2820513 0.0000000 0.0000000), wk = 0.0035336 k( 24) = ( 0.2948718 -0.0000000 0.0000000), wk = 0.0035336 k( 25) = ( 0.3076923 -0.0000000 0.0000000), wk = 0.0035336 k( 26) = ( 0.3205128 0.0000000 0.0000000), wk = 0.0035336 k( 27) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0035336 k( 28) = ( 0.3461538 0.0000000 0.0000000), wk = 0.0035336 k( 29) = ( 0.3589744 0.0000000 0.0000000), wk = 0.0035336 k( 30) = ( 0.3717949 0.0000000 0.0000000), wk = 0.0035336 k( 31) = ( 0.3846154 0.0000000 0.0000000), wk = 0.0035336 k( 32) = ( 0.3974359 0.0000000 -0.0000000), wk = 0.0035336 k( 33) = ( 0.4102564 0.0000000 -0.0000000), wk = 0.0035336 k( 34) = ( 0.4230769 0.0000000 0.0000000), wk = 0.0035336 k( 35) = ( 0.4358974 0.0000000 0.0000000), wk = 0.0035336 k( 36) = ( 0.4487179 0.0000000 0.0000000), wk = 0.0035336 k( 37) = ( 0.4615385 0.0000000 0.0000000), wk = 0.0035336 k( 38) = ( 0.4743590 0.0000000 0.0000000), wk = 0.0035336 k( 39) = ( 0.4871795 0.0000000 0.0000000), wk = 0.0035336 k( 40) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035336 k( 41) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035336 k( 42) = ( 0.4927536 0.0144927 0.0000000), wk = 0.0035336 k( 43) = ( 0.4855073 0.0289855 0.0000000), wk = 0.0035336 k( 44) = ( 0.4782609 0.0434783 -0.0000000), wk = 0.0035336 k( 45) = ( 0.4710145 0.0579710 0.0000000), wk = 0.0035336 k( 46) = ( 0.4637681 0.0724638 0.0000000), wk = 0.0035336 k( 47) = ( 0.4565217 0.0869565 0.0000000), wk = 0.0035336 k( 48) = ( 0.4492754 0.1014493 -0.0000000), wk = 0.0035336 k( 49) = ( 0.4420290 0.1159420 0.0000000), wk = 0.0035336 k( 50) = ( 0.4347826 0.1304348 0.0000000), wk = 0.0035336 k( 51) = ( 0.4275362 0.1449275 0.0000000), wk = 0.0035336 k( 52) = ( 0.4202899 0.1594203 -0.0000000), wk = 0.0035336 k( 53) = ( 0.4130435 0.1739130 0.0000000), wk = 0.0035336 k( 54) = ( 0.4057971 0.1884058 -0.0000000), wk = 0.0035336 k( 55) = ( 0.3985507 0.2028985 0.0000000), wk = 0.0035336 k( 56) = ( 0.3913044 0.2173913 0.0000000), wk = 0.0035336 k( 57) = ( 0.3840580 0.2318841 -0.0000000), wk = 0.0035336 k( 58) = ( 0.3768116 0.2463768 0.0000000), wk = 0.0035336 k( 59) = ( 0.3695652 0.2608696 0.0000000), wk = 0.0035336 k( 60) = ( 0.3623188 0.2753623 -0.0000000), wk = 0.0035336 k( 61) = ( 0.3550725 0.2898551 -0.0000000), wk = 0.0035336 k( 62) = ( 0.3478261 0.3043478 -0.0000000), wk = 0.0035336 k( 63) = ( 0.3405797 0.3188406 0.0000000), wk = 0.0035336 k( 64) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035336 k( 65) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035336 k( 66) = ( 0.3259259 0.3259259 -0.0000000), wk = 0.0035336 k( 67) = ( 0.3185185 0.3185185 0.0000000), wk = 0.0035336 k( 68) = ( 0.3111111 0.3111111 0.0000000), wk = 0.0035336 k( 69) = ( 0.3037037 0.3037037 0.0000000), wk = 0.0035336 k( 70) = ( 0.2962963 0.2962963 0.0000000), wk = 0.0035336 k( 71) = ( 0.2888889 0.2888889 0.0000000), wk = 0.0035336 k( 72) = ( 0.2814815 0.2814815 0.0000000), wk = 0.0035336 k( 73) = ( 0.2740741 0.2740741 -0.0000000), wk = 0.0035336 k( 74) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0035336 k( 75) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0035336 k( 76) = ( 0.2518518 0.2518518 0.0000000), wk = 0.0035336 k( 77) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0035336 k( 78) = ( 0.2370370 0.2370370 -0.0000000), wk = 0.0035336 k( 79) = ( 0.2296296 0.2296296 -0.0000000), wk = 0.0035336 k( 80) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0035336 k( 81) = ( 0.2148148 0.2148148 0.0000000), wk = 0.0035336 k( 82) = ( 0.2074074 0.2074074 0.0000000), wk = 0.0035336 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0035336 k( 84) = ( 0.1925926 0.1925926 0.0000000), wk = 0.0035336 k( 85) = ( 0.1851852 0.1851852 -0.0000000), wk = 0.0035336 k( 86) = ( 0.1777778 0.1777778 0.0000000), wk = 0.0035336 k( 87) = ( 0.1703704 0.1703704 0.0000000), wk = 0.0035336 k( 88) = ( 0.1629630 0.1629630 -0.0000000), wk = 0.0035336 k( 89) = ( 0.1555556 0.1555556 -0.0000000), wk = 0.0035336 k( 90) = ( 0.1481482 0.1481481 0.0000000), wk = 0.0035336 k( 91) = ( 0.1407407 0.1407407 0.0000000), wk = 0.0035336 k( 92) = ( 0.1333333 0.1333333 0.0000000), wk = 0.0035336 k( 93) = ( 0.1259259 0.1259259 0.0000000), wk = 0.0035336 k( 94) = ( 0.1185185 0.1185185 -0.0000000), wk = 0.0035336 k( 95) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0035336 k( 96) = ( 0.1037037 0.1037037 -0.0000000), wk = 0.0035336 k( 97) = ( 0.0962963 0.0962963 0.0000000), wk = 0.0035336 k( 98) = ( 0.0888889 0.0888889 0.0000000), wk = 0.0035336 k( 99) = ( 0.0814815 0.0814815 -0.0000000), wk = 0.0035336 k( 100) = ( 0.0740741 0.0740741 0.0000000), wk = 0.0035336 k( 101) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0035336 k( 102) = ( 0.0592593 0.0592593 -0.0000000), wk = 0.0035336 k( 103) = ( 0.0518518 0.0518518 -0.0000000), wk = 0.0035336 k( 104) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0035336 k( 105) = ( 0.0370370 0.0370370 0.0000000), wk = 0.0035336 k( 106) = ( 0.0296296 0.0296296 -0.0000000), wk = 0.0035336 k( 107) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0035336 k( 108) = ( 0.0148148 0.0148148 0.0000000), wk = 0.0035336 k( 109) = ( 0.0074074 0.0074074 0.0000000), wk = 0.0035336 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 112) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0035336 k( 113) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0035336 k( 114) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0035336 k( 115) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0035336 k( 116) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0035336 k( 117) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0035336 k( 118) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0035336 k( 119) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0035336 k( 120) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0035336 k( 121) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0035336 k( 122) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0035336 k( 123) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0035336 k( 124) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0035336 k( 125) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0035336 k( 126) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0035336 k( 127) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0035336 k( 128) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0035336 k( 129) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0035336 k( 130) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0035336 k( 131) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035336 k( 132) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035336 k( 133) = ( 0.0128205 0.0000000 0.5000000), wk = 0.0035336 k( 134) = ( 0.0256410 0.0000000 0.5000000), wk = 0.0035336 k( 135) = ( 0.0384615 0.0000000 0.5000000), wk = 0.0035336 k( 136) = ( 0.0512821 0.0000000 0.5000000), wk = 0.0035336 k( 137) = ( 0.0641026 0.0000000 0.5000000), wk = 0.0035336 k( 138) = ( 0.0769231 0.0000000 0.5000000), wk = 0.0035336 k( 139) = ( 0.0897436 0.0000000 0.5000000), wk = 0.0035336 k( 140) = ( 0.1025641 0.0000000 0.5000000), wk = 0.0035336 k( 141) = ( 0.1153846 0.0000000 0.5000000), wk = 0.0035336 k( 142) = ( 0.1282051 0.0000000 0.5000000), wk = 0.0035336 k( 143) = ( 0.1410256 0.0000000 0.5000000), wk = 0.0035336 k( 144) = ( 0.1538461 -0.0000000 0.5000000), wk = 0.0035336 k( 145) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0035336 k( 146) = ( 0.1794872 0.0000000 0.5000000), wk = 0.0035336 k( 147) = ( 0.1923077 0.0000000 0.5000000), wk = 0.0035336 k( 148) = ( 0.2051282 0.0000000 0.5000000), wk = 0.0035336 k( 149) = ( 0.2179487 0.0000000 0.5000000), wk = 0.0035336 k( 150) = ( 0.2307692 0.0000000 0.5000000), wk = 0.0035336 k( 151) = ( 0.2435897 0.0000000 0.5000000), wk = 0.0035336 k( 152) = ( 0.2564103 0.0000000 0.5000000), wk = 0.0035336 k( 153) = ( 0.2692308 0.0000000 0.5000000), wk = 0.0035336 k( 154) = ( 0.2820513 0.0000000 0.5000000), wk = 0.0035336 k( 155) = ( 0.2948718 -0.0000000 0.5000000), wk = 0.0035336 k( 156) = ( 0.3076923 -0.0000000 0.5000000), wk = 0.0035336 k( 157) = ( 0.3205128 0.0000000 0.5000000), wk = 0.0035336 k( 158) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0035336 k( 159) = ( 0.3461538 0.0000000 0.5000000), wk = 0.0035336 k( 160) = ( 0.3589744 0.0000000 0.5000000), wk = 0.0035336 k( 161) = ( 0.3717949 0.0000000 0.5000000), wk = 0.0035336 k( 162) = ( 0.3846154 0.0000000 0.5000000), wk = 0.0035336 k( 163) = ( 0.3974359 0.0000000 0.5000000), wk = 0.0035336 k( 164) = ( 0.4102564 0.0000000 0.5000000), wk = 0.0035336 k( 165) = ( 0.4230769 0.0000000 0.5000000), wk = 0.0035336 k( 166) = ( 0.4358974 0.0000000 0.5000000), wk = 0.0035336 k( 167) = ( 0.4487179 0.0000000 0.5000000), wk = 0.0035336 k( 168) = ( 0.4615385 0.0000000 0.5000000), wk = 0.0035336 k( 169) = ( 0.4743590 0.0000000 0.5000000), wk = 0.0035336 k( 170) = ( 0.4871795 0.0000000 0.5000000), wk = 0.0035336 k( 171) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035336 k( 172) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035336 k( 173) = ( 0.4927536 0.0144927 0.5000000), wk = 0.0035336 k( 174) = ( 0.4855073 0.0289855 0.5000000), wk = 0.0035336 k( 175) = ( 0.4782609 0.0434783 0.5000000), wk = 0.0035336 k( 176) = ( 0.4710145 0.0579710 0.5000000), wk = 0.0035336 k( 177) = ( 0.4637681 0.0724638 0.5000000), wk = 0.0035336 k( 178) = ( 0.4565217 0.0869565 0.5000000), wk = 0.0035336 k( 179) = ( 0.4492754 0.1014493 0.5000000), wk = 0.0035336 k( 180) = ( 0.4420290 0.1159420 0.5000000), wk = 0.0035336 k( 181) = ( 0.4347826 0.1304348 0.5000000), wk = 0.0035336 k( 182) = ( 0.4275362 0.1449275 0.5000000), wk = 0.0035336 k( 183) = ( 0.4202899 0.1594203 0.5000000), wk = 0.0035336 k( 184) = ( 0.4130435 0.1739130 0.5000000), wk = 0.0035336 k( 185) = ( 0.4057971 0.1884058 0.5000000), wk = 0.0035336 k( 186) = ( 0.3985507 0.2028985 0.5000000), wk = 0.0035336 k( 187) = ( 0.3913044 0.2173913 0.5000000), wk = 0.0035336 k( 188) = ( 0.3840580 0.2318841 0.5000000), wk = 0.0035336 k( 189) = ( 0.3768116 0.2463768 0.5000000), wk = 0.0035336 k( 190) = ( 0.3695652 0.2608696 0.5000000), wk = 0.0035336 k( 191) = ( 0.3623188 0.2753623 0.5000000), wk = 0.0035336 k( 192) = ( 0.3550725 0.2898551 0.5000000), wk = 0.0035336 k( 193) = ( 0.3478261 0.3043478 0.5000000), wk = 0.0035336 k( 194) = ( 0.3405797 0.3188406 0.5000000), wk = 0.0035336 k( 195) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035336 k( 196) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035336 k( 197) = ( 0.3259259 0.3259259 0.5000000), wk = 0.0035336 k( 198) = ( 0.3185185 0.3185185 0.5000000), wk = 0.0035336 k( 199) = ( 0.3111111 0.3111111 0.5000000), wk = 0.0035336 k( 200) = ( 0.3037037 0.3037037 0.5000000), wk = 0.0035336 k( 201) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0035336 k( 202) = ( 0.2888889 0.2888889 0.5000000), wk = 0.0035336 k( 203) = ( 0.2814815 0.2814815 0.5000000), wk = 0.0035336 k( 204) = ( 0.2740741 0.2740741 0.5000000), wk = 0.0035336 k( 205) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0035336 k( 206) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0035336 k( 207) = ( 0.2518518 0.2518518 0.5000000), wk = 0.0035336 k( 208) = ( 0.2444444 0.2444444 0.5000000), wk = 0.0035336 k( 209) = ( 0.2370370 0.2370370 0.5000000), wk = 0.0035336 k( 210) = ( 0.2296296 0.2296296 0.5000000), wk = 0.0035336 k( 211) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0035336 k( 212) = ( 0.2148148 0.2148148 0.5000000), wk = 0.0035336 k( 213) = ( 0.2074074 0.2074074 0.5000000), wk = 0.0035336 k( 214) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0035336 k( 215) = ( 0.1925926 0.1925926 0.5000000), wk = 0.0035336 k( 216) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0035336 k( 217) = ( 0.1777778 0.1777778 0.5000000), wk = 0.0035336 k( 218) = ( 0.1703704 0.1703704 0.5000000), wk = 0.0035336 k( 219) = ( 0.1629630 0.1629630 0.5000000), wk = 0.0035336 k( 220) = ( 0.1555556 0.1555556 0.5000000), wk = 0.0035336 k( 221) = ( 0.1481482 0.1481481 0.5000000), wk = 0.0035336 k( 222) = ( 0.1407407 0.1407407 0.5000000), wk = 0.0035336 k( 223) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0035336 k( 224) = ( 0.1259259 0.1259259 0.5000000), wk = 0.0035336 k( 225) = ( 0.1185185 0.1185185 0.5000000), wk = 0.0035336 k( 226) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0035336 k( 227) = ( 0.1037037 0.1037037 0.5000000), wk = 0.0035336 k( 228) = ( 0.0962963 0.0962963 0.5000000), wk = 0.0035336 k( 229) = ( 0.0888889 0.0888889 0.5000000), wk = 0.0035336 k( 230) = ( 0.0814815 0.0814815 0.5000000), wk = 0.0035336 k( 231) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0035336 k( 232) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0035336 k( 233) = ( 0.0592593 0.0592593 0.5000000), wk = 0.0035336 k( 234) = ( 0.0518518 0.0518518 0.5000000), wk = 0.0035336 k( 235) = ( 0.0444444 0.0444444 0.5000000), wk = 0.0035336 k( 236) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0035336 k( 237) = ( 0.0296296 0.0296296 0.5000000), wk = 0.0035336 k( 238) = ( 0.0222222 0.0222222 0.5000000), wk = 0.0035336 k( 239) = ( 0.0148148 0.0148148 0.5000000), wk = 0.0035336 k( 240) = ( 0.0074074 0.0074074 0.5000000), wk = 0.0035336 k( 241) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035336 k( 242) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035336 k( 243) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0035336 k( 244) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0035336 k( 245) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0035336 k( 246) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0035336 k( 247) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0035336 k( 248) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0035336 k( 249) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0035336 k( 250) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0035336 k( 251) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0035336 k( 252) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0035336 k( 253) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0035336 k( 254) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0035336 k( 255) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0035336 k( 256) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0035336 k( 257) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0035336 k( 258) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0035336 k( 259) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0035336 k( 260) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0035336 k( 261) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0035336 k( 262) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0035336 k( 263) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0035336 k( 264) = ( 0.3333333 0.3333333 0.0250000), wk = 0.0035336 k( 265) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0035336 k( 266) = ( 0.3333333 0.3333333 0.0750000), wk = 0.0035336 k( 267) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0035336 k( 268) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0035336 k( 269) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0035336 k( 270) = ( 0.3333333 0.3333333 0.1750000), wk = 0.0035336 k( 271) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0035336 k( 272) = ( 0.3333333 0.3333333 0.2250000), wk = 0.0035336 k( 273) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0035336 k( 274) = ( 0.3333333 0.3333333 0.2750000), wk = 0.0035336 k( 275) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0035336 k( 276) = ( 0.3333333 0.3333333 0.3250000), wk = 0.0035336 k( 277) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0035336 k( 278) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0035336 k( 279) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0035336 k( 280) = ( 0.3333333 0.3333333 0.4250000), wk = 0.0035336 k( 281) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0035336 k( 282) = ( 0.3333333 0.3333333 0.4750000), wk = 0.0035336 k( 283) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0035336 Dense grid: 153895 G-vectors FFT dimensions: ( 60, 60, 100) Smooth grid: 44183 G-vectors FFT dimensions: ( 40, 40, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.23 Mb ( 238, 62) NL pseudopotentials 0.31 Mb ( 119, 168) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.02 Mb ( 3209) G-vector shells 0.01 Mb ( 1592) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.90 Mb ( 238, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.32 Mb ( 168, 2, 62) The potential is recalculated from file : ./CaBiAu.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.9 secs Computing kpt #: 2 total cpu time spent up to now is 54.9 secs Computing kpt #: 3 total cpu time spent up to now is 61.1 secs Computing kpt #: 4 total cpu time spent up to now is 67.9 secs Computing kpt #: 5 total cpu time spent up to now is 74.2 secs Computing kpt #: 6 total cpu time spent up to now is 80.9 secs Computing kpt #: 7 total cpu time spent up to now is 87.0 secs Computing kpt #: 8 total cpu time spent up to now is 92.9 secs Computing kpt #: 9 total cpu time spent up to now is 99.2 secs Computing kpt #: 10 total cpu time spent up to now is 105.2 secs Computing kpt #: 11 total cpu time spent up to now is 111.2 secs Computing kpt #: 12 total cpu time spent up to now is 116.9 secs Computing kpt #: 13 total cpu time spent up to now is 122.6 secs Computing kpt #: 14 total cpu time spent up to now is 129.4 secs Computing kpt #: 15 total cpu time spent up to now is 135.6 secs Computing kpt #: 16 total cpu time spent up to now is 142.2 secs Computing kpt #: 17 total cpu time spent up to now is 149.4 secs Computing kpt #: 18 total cpu time spent up to now is 156.1 secs Computing kpt #: 19 total cpu time spent up to now is 162.6 secs Computing kpt #: 20 total cpu time spent up to now is 169.0 secs Computing kpt #: 21 total cpu time spent up to now is 175.1 secs Computing kpt #: 22 total cpu time spent up to now is 181.1 secs Computing kpt #: 23 total cpu time spent up to now is 187.1 secs Computing kpt #: 24 total cpu time spent up to now is 193.0 secs Computing kpt #: 25 total cpu time spent up to now is 199.0 secs Computing kpt #: 26 total cpu time spent up to now is 205.0 secs Computing kpt #: 27 total cpu time spent up to now is 211.3 secs Computing kpt #: 28 total cpu time spent up to now is 217.6 secs Computing kpt #: 29 total cpu time spent up to now is 223.6 secs Computing kpt #: 30 total cpu time spent up to now is 230.5 secs Computing kpt #: 31 total cpu time spent up to now is 237.1 secs Computing kpt #: 32 total cpu time spent up to now is 244.6 secs Computing kpt #: 33 total cpu time spent up to now is 252.1 secs Computing kpt #: 34 total cpu time spent up to now is 258.7 secs Computing kpt #: 35 total cpu time spent up to now is 265.9 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 273.4 secs Computing kpt #: 37 total cpu time spent up to now is 280.7 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 288.4 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 296.1 secs Computing kpt #: 40 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.3 secs Computing kpt #: 41 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 310.7 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 318.3 secs Computing kpt #: 43 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 325.8 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 333.4 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 341.0 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 348.6 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 356.3 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 364.0 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 371.7 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 379.5 secs Computing kpt #: 51 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 387.7 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 395.4 secs Computing kpt #: 53 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 403.1 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 410.8 secs Computing kpt #: 55 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 418.6 secs Computing kpt #: 56 total cpu time spent up to now is 425.3 secs Computing kpt #: 57 total cpu time spent up to now is 431.6 secs Computing kpt #: 58 total cpu time spent up to now is 439.1 secs Computing kpt #: 59 total cpu time spent up to now is 446.8 secs Computing kpt #: 60 total cpu time spent up to now is 453.6 secs Computing kpt #: 61 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 461.1 secs Computing kpt #: 62 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 469.1 secs Computing kpt #: 63 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 476.5 secs Computing kpt #: 64 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 483.9 secs Computing kpt #: 65 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 491.3 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 498.7 secs Computing kpt #: 67 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 506.5 secs Computing kpt #: 68 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 513.9 secs Computing kpt #: 69 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 521.4 secs Computing kpt #: 70 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 530.2 secs Computing kpt #: 71 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 538.6 secs Computing kpt #: 72 total cpu time spent up to now is 545.4 secs Computing kpt #: 73 total cpu time spent up to now is 551.9 secs Computing kpt #: 74 total cpu time spent up to now is 558.3 secs Computing kpt #: 75 total cpu time spent up to now is 565.3 secs Computing kpt #: 76 total cpu time spent up to now is 571.0 secs Computing kpt #: 77 total cpu time spent up to now is 577.3 secs Computing kpt #: 78 total cpu time spent up to now is 583.5 secs Computing kpt #: 79 total cpu time spent up to now is 590.7 secs Computing kpt #: 80 total cpu time spent up to now is 597.7 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 605.4 secs Computing kpt #: 82 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 613.0 secs Computing kpt #: 83 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 620.7 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 628.2 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 635.9 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 643.4 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 651.1 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 658.8 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 666.7 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 674.3 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 682.1 secs Computing kpt #: 92 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 690.0 secs Computing kpt #: 93 total cpu time spent up to now is 697.5 secs Computing kpt #: 94 total cpu time spent up to now is 705.1 secs Computing kpt #: 95 total cpu time spent up to now is 712.0 secs Computing kpt #: 96 total cpu time spent up to now is 719.4 secs Computing kpt #: 97 total cpu time spent up to now is 725.9 secs Computing kpt #: 98 total cpu time spent up to now is 732.0 secs Computing kpt #: 99 total cpu time spent up to now is 737.9 secs Computing kpt #: 100 total cpu time spent up to now is 744.2 secs Computing kpt #: 101 total cpu time spent up to now is 750.9 secs Computing kpt #: 102 total cpu time spent up to now is 756.9 secs Computing kpt #: 103 total cpu time spent up to now is 763.0 secs Computing kpt #: 104 total cpu time spent up to now is 769.7 secs Computing kpt #: 105 total cpu time spent up to now is 775.9 secs Computing kpt #: 106 total cpu time spent up to now is 782.0 secs Computing kpt #: 107 total cpu time spent up to now is 788.2 secs Computing kpt #: 108 total cpu time spent up to now is 794.1 secs Computing kpt #: 109 total cpu time spent up to now is 800.0 secs Computing kpt #: 110 total cpu time spent up to now is 806.0 secs Computing kpt #: 111 total cpu time spent up to now is 812.6 secs Computing kpt #: 112 total cpu time spent up to now is 819.5 secs Computing kpt #: 113 total cpu time spent up to now is 825.4 secs Computing kpt #: 114 total cpu time spent up to now is 833.9 secs Computing kpt #: 115 total cpu time spent up to now is 840.2 secs Computing kpt #: 116 total cpu time spent up to now is 846.1 secs Computing kpt #: 117 total cpu time spent up to now is 852.0 secs Computing kpt #: 118 total cpu time spent up to now is 857.8 secs Computing kpt #: 119 total cpu time spent up to now is 863.7 secs Computing kpt #: 120 total cpu time spent up to now is 869.4 secs Computing kpt #: 121 total cpu time spent up to now is 875.4 secs Computing kpt #: 122 total cpu time spent up to now is 881.1 secs Computing kpt #: 123 total cpu time spent up to now is 887.0 secs Computing kpt #: 124 total cpu time spent up to now is 892.9 secs Computing kpt #: 125 total cpu time spent up to now is 899.2 secs Computing kpt #: 126 total cpu time spent up to now is 905.1 secs Computing kpt #: 127 total cpu time spent up to now is 912.1 secs Computing kpt #: 128 total cpu time spent up to now is 919.0 secs Computing kpt #: 129 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 926.7 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 934.5 secs Computing kpt #: 131 total cpu time spent up to now is 940.3 secs Computing kpt #: 132 total cpu time spent up to now is 947.4 secs Computing kpt #: 133 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 955.1 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 963.1 secs Computing kpt #: 135 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 971.3 secs Computing kpt #: 136 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 979.5 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 987.6 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 995.5 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1003.3 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1011.1 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1019.0 secs Computing kpt #: 142 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1026.7 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1034.2 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1041.7 secs Computing kpt #: 145 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1049.4 secs Computing kpt #: 146 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1057.0 secs Computing kpt #: 147 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1064.5 secs Computing kpt #: 148 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1072.2 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1080.0 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1087.4 secs Computing kpt #: 151 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1094.9 secs Computing kpt #: 152 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1102.4 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1109.7 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1117.2 secs Computing kpt #: 155 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1124.5 secs Computing kpt #: 156 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1132.8 secs Computing kpt #: 157 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1139.9 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1147.1 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1154.5 secs Computing kpt #: 160 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1161.9 secs Computing kpt #: 161 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1169.0 secs Computing kpt #: 162 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1176.2 secs Computing kpt #: 163 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1183.2 secs Computing kpt #: 164 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1190.2 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1197.2 secs Computing kpt #: 166 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1204.3 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1211.3 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1218.3 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1225.3 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1232.3 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1239.3 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1246.3 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1253.3 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1260.3 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1267.3 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1274.3 secs Computing kpt #: 177 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1281.5 secs Computing kpt #: 178 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1288.5 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1295.5 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1302.5 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1309.8 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1317.0 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1324.2 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1331.4 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1338.6 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1346.1 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1353.6 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1361.1 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1368.5 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1376.0 secs Computing kpt #: 191 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1383.3 secs Computing kpt #: 192 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1390.8 secs Computing kpt #: 193 total cpu time spent up to now is 1397.4 secs Computing kpt #: 194 total cpu time spent up to now is 1405.2 secs Computing kpt #: 195 total cpu time spent up to now is 1412.4 secs Computing kpt #: 196 total cpu time spent up to now is 1419.7 secs Computing kpt #: 197 total cpu time spent up to now is 1427.3 secs Computing kpt #: 198 total cpu time spent up to now is 1435.2 secs Computing kpt #: 199 total cpu time spent up to now is 1441.4 secs Computing kpt #: 200 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1449.0 secs Computing kpt #: 201 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1456.6 secs Computing kpt #: 202 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1464.1 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1471.9 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1479.5 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1487.0 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1494.5 secs Computing kpt #: 207 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1502.0 secs Computing kpt #: 208 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1509.3 secs Computing kpt #: 209 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1516.6 secs Computing kpt #: 210 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1523.9 secs Computing kpt #: 211 total cpu time spent up to now is 1530.8 secs Computing kpt #: 212 total cpu time spent up to now is 1537.2 secs Computing kpt #: 213 total cpu time spent up to now is 1543.4 secs Computing kpt #: 214 total cpu time spent up to now is 1550.7 secs Computing kpt #: 215 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1558.1 secs Computing kpt #: 216 total cpu time spent up to now is 1565.4 secs Computing kpt #: 217 total cpu time spent up to now is 1572.5 secs Computing kpt #: 218 total cpu time spent up to now is 1578.9 secs Computing kpt #: 219 total cpu time spent up to now is 1585.5 secs Computing kpt #: 220 total cpu time spent up to now is 1592.6 secs Computing kpt #: 221 total cpu time spent up to now is 1599.8 secs Computing kpt #: 222 total cpu time spent up to now is 1607.2 secs Computing kpt #: 223 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1614.8 secs Computing kpt #: 224 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1622.3 secs Computing kpt #: 225 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1629.8 secs Computing kpt #: 226 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1637.9 secs Computing kpt #: 227 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1645.3 secs Computing kpt #: 228 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1652.8 secs Computing kpt #: 229 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1660.4 secs Computing kpt #: 230 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1668.0 secs Computing kpt #: 231 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1675.6 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1683.4 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1691.1 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1698.7 secs Computing kpt #: 235 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1706.6 secs Computing kpt #: 236 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1714.3 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1722.4 secs Computing kpt #: 238 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1732.3 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1740.8 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1748.5 secs Computing kpt #: 241 total cpu time spent up to now is 1755.2 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1762.1 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1769.2 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1776.3 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1783.4 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1790.5 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1797.9 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1805.1 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1812.3 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1819.5 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1826.7 secs Computing kpt #: 252 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1834.0 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1841.4 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1848.8 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1856.1 secs Computing kpt #: 256 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1863.5 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1870.8 secs Computing kpt #: 258 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1878.3 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1885.6 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1893.3 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1900.8 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1908.1 secs Computing kpt #: 263 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1915.7 secs Computing kpt #: 264 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1923.0 secs Computing kpt #: 265 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1930.4 secs Computing kpt #: 266 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1937.8 secs Computing kpt #: 267 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1945.3 secs Computing kpt #: 268 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1952.6 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1960.5 secs Computing kpt #: 270 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1968.1 secs Computing kpt #: 271 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1975.7 secs Computing kpt #: 272 total cpu time spent up to now is 1983.1 secs Computing kpt #: 273 total cpu time spent up to now is 1990.9 secs Computing kpt #: 274 total cpu time spent up to now is 1997.3 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2005.1 secs Computing kpt #: 276 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2012.9 secs Computing kpt #: 277 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2020.3 secs Computing kpt #: 278 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2028.3 secs Computing kpt #: 279 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2036.1 secs Computing kpt #: 280 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2043.8 secs Computing kpt #: 281 total cpu time spent up to now is 2051.2 secs Computing kpt #: 282 total cpu time spent up to now is 2058.9 secs Computing kpt #: 283 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2066.2 secs ethr = 1.92E-11, avg # of iterations =107.8 total cpu time spent up to now is 2066.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4976 -13.4976 -13.4737 -13.4737 -13.1416 -13.1416 -13.0990 -13.0990 -13.0934 -13.0934 -13.0904 -13.0904 -2.4346 -2.4346 -1.8089 -1.8089 3.4729 3.4729 3.5742 3.5742 3.7441 3.7441 3.9602 3.9602 4.1058 4.1058 4.3063 4.3063 4.5765 4.5765 5.1372 5.1372 5.1480 5.1480 5.4425 5.4425 5.7477 5.7477 8.0438 8.0438 8.0658 8.0658 8.7808 8.7808 8.9675 8.9675 9.2043 9.2043 10.3999 10.3999 10.5038 10.5038 10.8443 10.8443 11.1058 11.1058 11.1472 11.1472 k = 0.0128 0.0074-0.0000 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4977 -13.4975 -13.4738 -13.4736 -13.1417 -13.1415 -13.0990 -13.0990 -13.0935 -13.0933 -13.0904 -13.0904 -2.4337 -2.4336 -1.8090 -1.8081 3.4732 3.4732 3.5742 3.5742 3.7405 3.7477 3.9463 3.9752 4.0904 4.1214 4.3028 4.3092 4.5765 4.5775 5.1369 5.1370 5.1453 5.1510 5.4427 5.4427 5.7440 5.7512 8.0264 8.0468 8.0503 8.0701 8.7570 8.7586 8.9434 8.9927 9.2178 9.2465 10.3824 10.4086 10.4932 10.4935 10.8346 10.8462 11.1085 11.1114 11.1529 11.1540 k = 0.0256 0.0148-0.0000 ( 5537 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4978 -13.4974 -13.4740 -13.4736 -13.1418 -13.1414 -13.0991 -13.0991 -13.0936 -13.0932 -13.0904 -13.0904 -2.4308 -2.4308 -1.8083 -1.8065 3.4738 3.4739 3.5742 3.5743 3.7371 3.7515 3.9334 3.9911 4.0752 4.1368 4.2990 4.3117 4.5771 4.5795 5.1360 5.1366 5.1433 5.1543 5.4432 5.4433 5.7399 5.7545 7.9983 8.0139 8.0447 8.0601 8.6987 8.7074 8.9203 9.0162 9.2772 9.3279 10.3579 10.4061 10.4630 10.4654 10.8168 10.8424 11.1172 11.1245 11.1688 11.1758 k = 0.0385 0.0222-0.0000 ( 5543 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4980 -13.4974 -13.4741 -13.4735 -13.1419 -13.1413 -13.0992 -13.0992 -13.0937 -13.0931 -13.0906 -13.0906 -2.4261 -2.4260 -1.8068 -1.8041 3.4749 3.4750 3.5742 3.5745 3.7338 3.7555 3.9217 4.0079 4.0604 4.1521 4.2947 4.3137 4.5783 4.5826 5.1343 5.1360 5.1420 5.1577 5.4441 5.4443 5.7356 5.7577 7.9601 7.9663 8.0278 8.0358 8.6279 8.6471 8.8973 9.0361 9.3614 9.4294 10.3272 10.3898 10.4182 10.4249 10.7944 10.8354 11.1281 11.1438 11.1939 11.2112 k = 0.0513 0.0296-0.0000 ( 5535 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4981 -13.4973 -13.4743 -13.4735 -13.1420 -13.1412 -13.0995 -13.0994 -13.0938 -13.0930 -13.0907 -13.0907 -2.4195 -2.4194 -1.8045 -1.8010 3.4763 3.4767 3.5740 3.5748 3.7306 3.7595 3.9113 4.0252 4.0463 4.1670 4.2901 4.3152 4.5800 4.5873 5.1320 5.1353 5.1412 5.1612 5.4454 5.4457 5.7309 5.7608 7.9050 7.9118 7.9978 7.9998 8.5574 8.5875 8.8743 9.0513 9.4568 9.5402 10.2880 10.3582 10.3673 10.3781 10.7729 10.8268 11.1399 11.1679 11.2262 11.2569 k = 0.0641 0.0370-0.0000 ( 5531 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4982 -13.4972 -13.4745 -13.4735 -13.1421 -13.1411 -13.0997 -13.0996 -13.0939 -13.0930 -13.0908 -13.0908 -2.4110 -2.4109 -1.8015 -1.7971 3.4780 3.4788 3.5737 3.5753 3.7275 3.7637 3.9020 4.0309 4.0449 4.1813 4.2853 4.3163 4.5821 4.5934 5.1295 5.1345 5.1406 5.1649 5.4470 5.4476 5.7258 5.7638 7.8312 7.8533 7.9479 7.9615 8.4929 8.5318 8.8506 9.0608 9.5552 9.6546 10.2343 10.3128 10.3217 10.3299 10.7559 10.8181 11.1532 11.1951 11.2629 11.3096 k = 0.0769 0.0444-0.0000 ( 5519 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4983 -13.4971 -13.4747 -13.4736 -13.1422 -13.1409 -13.1001 -13.0999 -13.0940 -13.0929 -13.0910 -13.0910 -2.4006 -2.4005 -1.7978 -1.7925 3.4800 3.4815 3.5733 3.5759 3.7246 3.7680 3.8940 4.0181 4.0633 4.1949 4.2802 4.3169 4.5844 4.6014 5.1270 5.1337 5.1399 5.1687 5.4491 5.4499 5.7203 5.7669 7.7471 7.7842 7.8893 7.9142 8.4357 8.4806 8.8258 9.0632 9.6500 9.7683 10.1649 10.2566 10.2867 10.2880 10.7443 10.8104 11.1694 11.2244 11.3018 11.3667 k = 0.0897 0.0518-0.0000 ( 5509 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4984 -13.4971 -13.4750 -13.4736 -13.1423 -13.1408 -13.1004 -13.1002 -13.0941 -13.0928 -13.0913 -13.0913 -2.3885 -2.3884 -1.7933 -1.7872 3.4822 3.4845 3.5726 3.5767 3.7218 3.7724 3.8872 4.0053 4.0825 4.2076 4.2750 4.3171 4.5869 4.6112 5.1245 5.1330 5.1392 5.1726 5.4516 5.4528 5.7143 5.7701 7.6549 7.7046 7.8254 7.8591 8.3849 8.4331 8.7989 9.0575 9.7326 9.8764 10.0853 10.1936 10.2574 10.2656 10.7374 10.8047 11.1890 11.2550 11.3418 11.4259 k = 0.1026 0.0592-0.0000 ( 5503 PWs) bands (ev): -32.2063 -32.2063 -32.2020 -32.2020 -13.4985 -13.4971 -13.4752 -13.4737 -13.1424 -13.1407 -13.1009 -13.1006 -13.0942 -13.0928 -13.0915 -13.0915 -2.3746 -2.3745 -1.7882 -1.7813 3.4845 3.4880 3.5715 3.5777 3.7191 3.7768 3.8817 3.9930 4.1020 4.2192 4.2698 4.3168 4.5897 4.6230 5.1220 5.1322 5.1383 5.1766 5.4545 5.4561 5.7079 5.7736 7.5569 7.6164 7.7585 7.7973 8.3388 8.3881 8.7693 9.0426 9.7902 9.9707 10.0003 10.1294 10.2527 10.2578 10.7341 10.8025 11.2125 11.2866 11.3821 11.4851 k = 0.1154 0.0666-0.0000 ( 5507 PWs) bands (ev): -32.2063 -32.2063 -32.2020 -32.2020 -13.4987 -13.4970 -13.4755 -13.4739 -13.1425 -13.1407 -13.1014 -13.1010 -13.0942 -13.0928 -13.0919 -13.0918 -2.3591 -2.3590 -1.7825 -1.7748 3.4870 3.4918 3.5702 3.5789 3.7165 3.7814 3.8774 3.9814 4.1216 4.2296 4.2646 4.3162 4.5926 4.6368 5.1196 5.1316 5.1372 5.1808 5.4578 5.4598 5.7010 5.7773 7.4550 7.5220 7.6895 7.7300 8.2956 8.3449 8.7365 9.0180 9.8095 9.9113 10.0382 10.0705 10.2743 10.2813 10.7339 10.8057 11.2401 11.3191 11.4227 11.5427 k = 0.1282 0.0740-0.0000 ( 5499 PWs) bands (ev): -32.2063 -32.2063 -32.2019 -32.2019 -13.4988 -13.4970 -13.4758 -13.4740 -13.1426 -13.1406 -13.1019 -13.1014 -13.0943 -13.0928 -13.0922 -13.0922 -2.3419 -2.3419 -1.7761 -1.7677 3.4894 3.4959 3.5686 3.5803 3.7141 3.7860 3.8744 3.9704 4.1411 4.2389 4.2596 4.3152 4.5958 4.6525 5.1173 5.1310 5.1360 5.1852 5.4617 5.4639 5.6937 5.7815 7.3508 7.4238 7.6188 7.6582 8.2539 8.3024 8.7003 8.9836 9.7888 9.8210 10.0229 10.0687 10.3198 10.3392 10.7377 10.8173 11.2719 11.3526 11.4634 11.5972 k = 0.1410 0.0814-0.0000 ( 5501 PWs) bands (ev): -32.2062 -32.2062 -32.2019 -32.2019 -13.4989 -13.4971 -13.4761 -13.4742 -13.1427 -13.1405 -13.1025 -13.1019 -13.0943 -13.0928 -13.0926 -13.0925 -2.3232 -2.3232 -1.7692 -1.7600 3.4918 3.5001 3.5666 3.5819 3.7120 3.7907 3.8725 3.9600 4.1602 4.2470 4.2550 4.3139 4.5993 4.6700 5.1150 5.1306 5.1345 5.1899 5.4661 5.4683 5.6859 5.7863 7.2456 7.3239 7.5465 7.5826 8.2130 8.2603 8.6606 8.9399 9.7299 9.7391 9.9880 10.0743 10.3770 10.4106 10.7482 10.8411 11.3080 11.3869 11.5041 11.6472 k = 0.1538 0.0888-0.0000 ( 5497 PWs) bands (ev): -32.2062 -32.2062 -32.2019 -32.2019 -13.4991 -13.4971 -13.4765 -13.4744 -13.1427 -13.1405 -13.1031 -13.1024 -13.0944 -13.0930 -13.0929 -13.0928 -2.3031 -2.3031 -1.7618 -1.7518 3.4939 3.5045 3.5644 3.5838 3.7101 3.7954 3.8718 3.9503 4.1788 4.2504 4.2541 4.3121 4.6031 4.6892 5.1128 5.1303 5.1329 5.1949 5.4709 5.4730 5.6776 5.7917 7.1405 7.2239 7.4729 7.5039 8.1721 8.2182 8.6177 8.8878 9.6387 9.6731 9.9636 10.0697 10.4263 10.4779 10.7718 10.8802 11.3486 11.4222 11.5449 11.6916 k = 0.1667 0.0962-0.0000 ( 5505 PWs) bands (ev): -32.2062 -32.2062 -32.2019 -32.2019 -13.4992 -13.4971 -13.4768 -13.4746 -13.1428 -13.1404 -13.1038 -13.1030 -13.0945 -13.0934 -13.0933 -13.0929 -2.2816 -2.2815 -1.7539 -1.7433 3.4956 3.5088 3.5620 3.5858 3.7086 3.8003 3.8721 3.9413 4.1965 4.2466 4.2598 4.3098 4.6075 4.7099 5.1106 5.1303 5.1312 5.2002 5.4762 5.4776 5.6689 5.7979 7.0364 7.1251 7.3981 7.4229 8.1310 8.1759 8.5717 8.8289 9.5480 9.5993 9.9468 10.0616 10.4592 10.5256 10.8166 10.9341 11.3935 11.4583 11.5855 11.7291 k = 0.1795 0.1036-0.0000 ( 5503 PWs) bands (ev): -32.2061 -32.2061 -32.2018 -32.2018 -13.4993 -13.4971 -13.4772 -13.4749 -13.1429 -13.1404 -13.1045 -13.1036 -13.0946 -13.0939 -13.0937 -13.0929 -2.2589 -2.2586 -1.7456 -1.7343 3.4967 3.5128 3.5597 3.5882 3.7076 3.8052 3.8733 3.9329 4.2131 4.2433 4.2645 4.3070 4.6125 4.7317 5.1082 5.1294 5.1305 5.2060 5.4818 5.4823 5.6599 5.8050 6.9341 7.0284 7.3224 7.3398 8.0896 8.1334 8.5232 8.7644 9.4582 9.5220 9.9356 10.0526 10.4759 10.5484 10.8839 10.9979 11.4425 11.4951 11.6258 11.7580 k = 0.1923 0.1110-0.0000 ( 5503 PWs) bands (ev): -32.2061 -32.2061 -32.2018 -32.2018 -13.4994 -13.4971 -13.4775 -13.4752 -13.1429 -13.1403 -13.1052 -13.1043 -13.0947 -13.0943 -13.0940 -13.0929 -2.2350 -2.2346 -1.7369 -1.7250 3.4970 3.5164 3.5576 3.5908 3.7071 3.8101 3.8753 3.9252 4.2285 4.2405 4.2682 4.3034 4.6185 4.7545 5.1057 5.1278 5.1309 5.2122 5.4867 5.4875 5.6507 5.8131 6.8343 6.9347 7.2463 7.2554 8.0477 8.0906 8.4725 8.6959 9.3699 9.4435 9.9284 10.0437 10.4803 10.5522 10.9651 11.0650 11.4950 11.5320 11.6652 11.7771 k = 0.2051 0.1184-0.0000 ( 5505 PWs) bands (ev): -32.2061 -32.2061 -32.2018 -32.2018 -13.4996 -13.4972 -13.4779 -13.4755 -13.1430 -13.1402 -13.1060 -13.1049 -13.0949 -13.0948 -13.0943 -13.0930 -2.2099 -2.2094 -1.7279 -1.7155 3.4961 3.5194 3.5561 3.5937 3.7075 3.8152 3.8781 3.9182 4.2383 4.2424 4.2710 4.2989 4.6254 4.7779 5.1028 5.1264 5.1316 5.2190 5.4908 5.4931 5.6415 5.8222 6.7375 6.8445 7.1699 7.1701 8.0054 8.0478 8.4201 8.6247 9.2832 9.3651 9.9242 10.0350 10.4762 10.5440 11.0511 11.1304 11.5494 11.5684 11.7030 11.7869 k = 0.2179 0.1258-0.0000 ( 5497 PWs) bands (ev): -32.2061 -32.2060 -32.2017 -32.2017 -13.4996 -13.4972 -13.4783 -13.4758 -13.1430 -13.1402 -13.1067 -13.1056 -13.0952 -13.0952 -13.0944 -13.0931 -2.1840 -2.1833 -1.7187 -1.7057 3.4940 3.5215 3.5554 3.5969 3.7088 3.8204 3.8815 3.9119 4.2368 4.2548 4.2728 4.2933 4.6336 4.8017 5.0995 5.1255 5.1325 5.2262 5.4944 5.4981 5.6326 5.8322 6.6445 6.7584 7.0838 7.0944 7.9629 8.0049 8.3665 8.5519 9.1984 9.2875 9.9222 10.0266 10.4664 10.5286 11.1363 11.1909 11.6032 11.6037 11.7379 11.7912 k = 0.2308 0.1332-0.0000 ( 5491 PWs) bands (ev): -32.2060 -32.2060 -32.2017 -32.2017 -13.4998 -13.4973 -13.4786 -13.4761 -13.1431 -13.1402 -13.1074 -13.1062 -13.0957 -13.0956 -13.0945 -13.0931 -2.1572 -2.1563 -1.7094 -1.6959 3.4905 3.5226 3.5555 3.6003 3.7112 3.8256 3.8853 3.9063 4.2358 4.2656 4.2738 4.2863 4.6431 4.8255 5.0957 5.1253 5.1337 5.2341 5.4974 5.5020 5.6245 5.8430 6.5558 6.6767 6.9976 7.0197 7.9203 7.9621 8.3120 8.4785 9.1158 9.2110 9.9216 10.0183 10.4528 10.5083 11.2173 11.2456 11.6342 11.6560 11.7688 11.7954 k = 0.2436 0.1406-0.0000 ( 5495 PWs) bands (ev): -32.2060 -32.2060 -32.2017 -32.2017 -13.4999 -13.4974 -13.4790 -13.4764 -13.1431 -13.1402 -13.1082 -13.1069 -13.0962 -13.0960 -13.0946 -13.0932 -2.1298 -2.1287 -1.6999 -1.6860 3.4858 3.5225 3.5564 3.6040 3.7149 3.8309 3.8895 3.9014 4.2353 4.2735 4.2738 4.2790 4.6540 4.8490 5.0913 5.1258 5.1351 5.2425 5.4997 5.5041 5.6178 5.8543 6.4719 6.5995 6.9119 6.9469 7.8776 7.9196 8.2570 8.4052 9.0355 9.1360 9.9218 10.0098 10.4368 10.4847 11.2926 11.2943 11.6589 11.7043 11.7958 11.8050 k = 0.2564 0.1480-0.0000 ( 5495 PWs) bands (ev): -32.2059 -32.2059 -32.2016 -32.2016 -13.5000 -13.4975 -13.4793 -13.4768 -13.1431 -13.1402 -13.1089 -13.1076 -13.0966 -13.0965 -13.0946 -13.0933 -2.1018 -2.1004 -1.6905 -1.6762 3.4800 3.5212 3.5581 3.6078 3.7201 3.8363 3.8938 3.8971 4.2353 4.2659 4.2730 4.2841 4.6663 4.8719 5.0865 5.1274 5.1367 5.2515 5.5013 5.5035 5.6131 5.8656 6.3936 6.5268 6.8271 6.8769 7.8352 7.8776 8.2020 8.3328 8.9578 9.0627 9.9224 10.0012 10.4192 10.4591 11.3377 11.3616 11.6753 11.7471 11.8207 11.8236 k = 0.2692 0.1554-0.0000 ( 5495 PWs) bands (ev): -32.2059 -32.2059 -32.2016 -32.2016 -13.5001 -13.4976 -13.4796 -13.4771 -13.1432 -13.1402 -13.1096 -13.1083 -13.0971 -13.0970 -13.0946 -13.0933 -2.0734 -2.0717 -1.6812 -1.6666 3.4735 3.5188 3.5602 3.6117 3.7267 3.8418 3.8935 3.8983 4.2355 4.2534 4.2714 4.2910 4.6797 4.8939 5.0813 5.1301 5.1385 5.2610 5.5000 5.5022 5.6106 5.8758 6.3217 6.4583 6.7440 6.8107 7.7931 7.8363 8.1473 8.2618 8.8826 8.9910 9.9229 9.9921 10.4009 10.4322 11.3764 11.4242 11.6847 11.7823 11.8475 11.8507 k = 0.2821 0.1628-0.0000 ( 5495 PWs) bands (ev): -32.2059 -32.2058 -32.2016 -32.2016 -13.5002 -13.4977 -13.4799 -13.4774 -13.1432 -13.1403 -13.1103 -13.1090 -13.0976 -13.0974 -13.0946 -13.0934 -2.0448 -2.0428 -1.6720 -1.6572 3.4665 3.5152 3.5628 3.6154 3.7348 3.8473 3.8906 3.9027 4.2358 4.2388 4.2690 4.2971 4.6942 4.9144 5.0762 5.1341 5.1404 5.2711 5.4935 5.5023 5.6102 5.8836 6.2569 6.3933 6.6637 6.7495 7.7516 7.7959 8.0932 8.1925 8.8101 8.9213 9.9232 9.9824 10.3824 10.4048 11.4111 11.4809 11.6902 11.8089 11.8791 11.8835 k = 0.2949 0.1702-0.0000 ( 5497 PWs) bands (ev): -32.2058 -32.2058 -32.2015 -32.2015 -13.5003 -13.4979 -13.4803 -13.4778 -13.1432 -13.1403 -13.1110 -13.1097 -13.0981 -13.0979 -13.0946 -13.0934 -2.0160 -2.0138 -1.6632 -1.6481 3.4592 3.5106 3.5655 3.6190 3.7443 3.8529 3.8883 3.9069 4.2222 4.2357 4.2661 4.3023 4.7096 4.9332 5.0713 5.1395 5.1424 5.2816 5.4847 5.5018 5.6112 5.8871 6.2004 6.3312 6.5873 6.6946 7.7109 7.7565 8.0399 8.1254 8.7404 8.8534 9.9228 9.9723 10.3641 10.3776 11.4426 11.5321 11.6946 11.8295 11.9148 11.9195 k = 0.3077 0.1776-0.0000 ( 5503 PWs) bands (ev): -32.2058 -32.2058 -32.2015 -32.2015 -13.5003 -13.4980 -13.4806 -13.4782 -13.1432 -13.1404 -13.1117 -13.1104 -13.0985 -13.0983 -13.0947 -13.0935 -1.9874 -1.9848 -1.6547 -1.6394 3.4518 3.5052 3.5683 3.6224 3.7551 3.8585 3.8867 3.9109 4.2040 4.2346 4.2633 4.3069 4.7256 4.9496 5.0672 5.1443 5.1467 5.2926 5.4742 5.5007 5.6128 5.8839 6.1526 6.2710 6.5168 6.6473 7.6712 7.7185 7.9878 8.0607 8.6736 8.7875 9.9218 9.9616 10.3462 10.3511 11.4714 11.5786 11.6992 11.8474 11.9521 11.9569 k = 0.3205 0.1850-0.0000 ( 5501 PWs) bands (ev): -32.2057 -32.2057 -32.2015 -32.2015 -13.5004 -13.4981 -13.4808 -13.4785 -13.1432 -13.1405 -13.1123 -13.1110 -13.0990 -13.0987 -13.0947 -13.0936 -1.9590 -1.9560 -1.6466 -1.6313 3.4446 3.4992 3.5711 3.6254 3.7671 3.8641 3.8857 3.9144 4.1843 4.2319 4.2612 4.3108 4.7421 4.9631 5.0645 5.1463 5.1556 5.3040 5.4629 5.4992 5.6144 5.8724 6.1128 6.2120 6.4550 6.6082 7.6328 7.6819 7.9371 7.9987 8.6098 8.7237 9.9199 9.9505 10.3257 10.3291 11.4980 11.6207 11.7049 11.8643 11.9897 11.9948 k = 0.3333 0.1925-0.0000 ( 5497 PWs) bands (ev): -32.2057 -32.2057 -32.2015 -32.2015 -13.5004 -13.4983 -13.4811 -13.4789 -13.1432 -13.1405 -13.1129 -13.1117 -13.0994 -13.0991 -13.0947 -13.0936 -1.9310 -1.9277 -1.6391 -1.6238 3.4377 3.4927 3.5739 3.6281 3.7798 3.8697 3.8856 3.9174 4.1636 4.2267 4.2604 4.3140 4.7589 4.9733 5.0638 5.1481 5.1663 5.3156 5.4512 5.4973 5.6153 5.8526 6.0770 6.1539 6.4055 6.5779 7.5959 7.6470 7.8882 7.9397 8.5491 8.6620 9.9171 9.9392 10.3019 10.3127 11.5231 11.6591 11.7119 11.8808 12.0269 12.0325 k = 0.3462 0.1999-0.0000 ( 5495 PWs) bands (ev): -32.2057 -32.2057 -32.2014 -32.2014 -13.5005 -13.4984 -13.4813 -13.4792 -13.1431 -13.1406 -13.1135 -13.1123 -13.0998 -13.0995 -13.0946 -13.0937 -1.9036 -1.8998 -1.6322 -1.6170 3.4312 3.4858 3.5765 3.6302 3.7931 3.8753 3.8864 3.9197 4.1423 4.2193 4.2608 4.3167 4.7757 4.9800 5.0656 5.1498 5.1789 5.3273 5.4397 5.4953 5.6154 5.8269 6.0395 6.0964 6.3718 6.5559 7.5608 7.6140 7.8411 7.8838 8.4917 8.6026 9.9134 9.9277 10.2799 10.2972 11.5469 11.6937 11.7204 11.8969 12.0633 12.0697 k = 0.3590 0.2073-0.0000 ( 5501 PWs) bands (ev): -32.2056 -32.2056 -32.2014 -32.2014 -13.5005 -13.4986 -13.4815 -13.4796 -13.1431 -13.1407 -13.1140 -13.1129 -13.1001 -13.0999 -13.0946 -13.0937 -1.8770 -1.8728 -1.6261 -1.6110 3.4252 3.4788 3.5790 3.6318 3.8063 3.8809 3.8886 3.9211 4.1208 4.2100 4.2622 4.3188 4.7926 4.9833 5.0700 5.1513 5.1930 5.3391 5.4286 5.4933 5.6144 5.7982 5.9962 6.0401 6.3550 6.5415 7.5279 7.5830 7.7962 7.8313 8.4377 8.5457 9.9088 9.9164 10.2598 10.2825 11.5699 11.7226 11.7326 11.9123 12.0985 12.1057 k = 0.3718 0.2147-0.0000 ( 5495 PWs) bands (ev): -32.2056 -32.2056 -32.2014 -32.2014 -13.5005 -13.4987 -13.4817 -13.4799 -13.1431 -13.1408 -13.1145 -13.1134 -13.1005 -13.1002 -13.0946 -13.0938 -1.8513 -1.8466 -1.6208 -1.6059 3.4199 3.4716 3.5813 3.6327 3.8189 3.8865 3.8926 3.9217 4.0997 4.1994 4.2641 4.3203 4.8093 4.9843 5.0765 5.1525 5.2085 5.3507 5.4183 5.4913 5.6124 5.7688 5.9467 5.9853 6.3527 6.5336 7.4973 7.5542 7.7536 7.7823 8.3874 8.4914 9.9036 9.9055 10.2420 10.2687 11.5923 11.7370 11.7571 11.9267 12.1323 12.1405 k = 0.3846 0.2221-0.0000 ( 5497 PWs) bands (ev): -32.2056 -32.2056 -32.2014 -32.2014 -13.5005 -13.4989 -13.4819 -13.4802 -13.1430 -13.1409 -13.1150 -13.1139 -13.1008 -13.1005 -13.0946 -13.0938 -1.8267 -1.8216 -1.6164 -1.6018 3.4153 3.4645 3.5835 3.6329 3.8301 3.8921 3.8991 3.9213 4.0792 4.1876 4.2665 4.3211 4.8257 4.9836 5.0845 5.1535 5.2250 5.3620 5.4089 5.4894 5.6095 5.7404 5.8935 5.9327 6.3609 6.5308 7.4695 7.5278 7.7136 7.7369 8.3411 8.4399 9.8952 9.8977 10.2263 10.2557 11.6141 11.7476 11.7831 11.9395 12.1645 12.1735 k = 0.3974 0.2295-0.0000 ( 5503 PWs) bands (ev): -32.2056 -32.2055 -32.2013 -32.2013 -13.5005 -13.4990 -13.4820 -13.4805 -13.1429 -13.1410 -13.1154 -13.1144 -13.1011 -13.1008 -13.0946 -13.0939 -1.8034 -1.7979 -1.6130 -1.5988 3.4116 3.4575 3.5856 3.6323 3.8393 3.8975 3.9086 3.9199 4.0599 4.1750 4.2692 4.3212 4.8418 4.9820 5.0936 5.1544 5.2422 5.3727 5.4008 5.4877 5.6059 5.7138 5.8392 5.8829 6.3759 6.5316 7.4449 7.5038 7.6764 7.6954 8.2990 8.3915 9.8857 9.8915 10.2129 10.2435 11.6354 11.7575 11.8073 11.9505 12.1948 12.2046 k = 0.4103 0.2369-0.0000 ( 5506 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5005 -13.4992 -13.4822 -13.4808 -13.1428 -13.1411 -13.1158 -13.1149 -13.1013 -13.1011 -13.0946 -13.0940 -1.7815 -1.7757 -1.6105 -1.5969 3.4087 3.4507 3.5876 3.6308 3.8464 3.9027 3.9179 3.9209 4.0421 4.1617 4.2722 4.3207 4.8575 4.9798 5.1033 5.1550 5.2598 5.3823 5.3941 5.4861 5.6017 5.6896 5.7859 5.8365 6.3950 6.5347 7.4237 7.4822 7.6421 7.6579 8.2616 8.3466 9.8772 9.8851 10.2016 10.2321 11.6561 11.7665 11.8297 11.9592 12.2229 12.2334 k = 0.4231 0.2443-0.0000 ( 5506 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5005 -13.4993 -13.4823 -13.4811 -13.1427 -13.1413 -13.1160 -13.1153 -13.1015 -13.1013 -13.0946 -13.0941 -1.7613 -1.7552 -1.6090 -1.5961 3.4068 3.4442 3.5897 3.6286 3.8520 3.9067 3.9161 3.9352 4.0262 4.1478 4.2755 4.3196 4.8727 4.9771 5.1134 5.1556 5.2774 5.3894 5.3905 5.4842 5.5973 5.6683 5.7357 5.7939 6.4161 6.5387 7.4063 7.4630 7.6113 7.6245 8.2292 8.3054 9.8698 9.8788 10.1926 10.2215 11.6761 11.7740 11.8504 11.9654 12.2487 12.2595 k = 0.4359 0.2517-0.0000 ( 5520 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5005 -13.4995 -13.4823 -13.4813 -13.1427 -13.1415 -13.1163 -13.1157 -13.1017 -13.1016 -13.0946 -13.0941 -1.7430 -1.7368 -1.6085 -1.5965 3.4057 3.4379 3.5918 3.6257 3.8566 3.9062 3.9180 3.9503 4.0129 4.1333 4.2791 4.3177 4.8871 4.9739 5.1233 5.1560 5.2950 5.3870 5.3966 5.4814 5.5929 5.6501 5.6902 5.7554 6.4380 6.5423 7.3931 7.4460 7.5841 7.5954 8.2023 8.2683 9.8637 9.8727 10.1856 10.2117 11.6952 11.7796 11.8698 11.9690 12.2718 12.2825 k = 0.4487 0.2591-0.0000 ( 5524 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5004 -13.4996 -13.4824 -13.4816 -13.1426 -13.1416 -13.1165 -13.1160 -13.1018 -13.1017 -13.0946 -13.0942 -1.7267 -1.7207 -1.6086 -1.5979 3.4056 3.4321 3.5941 3.6222 3.8610 3.9022 3.9230 3.9634 4.0043 4.1182 4.2831 4.3152 4.9008 4.9701 5.1326 5.1564 5.3123 5.3876 5.4001 5.4767 5.5888 5.6356 5.6517 5.7213 6.4594 6.5446 7.3841 7.4310 7.5611 7.5708 8.1811 8.2358 9.8589 9.8671 10.1807 10.2029 11.7132 11.7827 11.8878 11.9697 12.2920 12.3020 k = 0.4615 0.2665-0.0000 ( 5520 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5003 -13.4997 -13.4824 -13.4818 -13.1425 -13.1417 -13.1166 -13.1163 -13.1019 -13.1018 -13.0945 -13.0943 -1.7128 -1.7074 -1.6092 -1.6002 3.4063 3.4266 3.5966 3.6183 3.8653 3.8971 3.9289 3.9682 4.0060 4.1024 4.2872 4.3122 4.9136 4.9655 5.1407 5.1566 5.3294 5.3915 5.4003 5.4684 5.5854 5.6198 5.6278 5.6918 6.4796 6.5446 7.3793 7.4178 7.5429 7.5509 8.1660 8.2082 9.8555 9.8623 10.1778 10.1952 11.7297 11.7832 11.9046 11.9677 12.3089 12.3176 k = 0.4744 0.2739-0.0000 ( 5508 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5002 -13.4998 -13.4823 -13.4819 -13.1423 -13.1418 -13.1167 -13.1165 -13.1020 -13.1019 -13.0945 -13.0943 -1.7018 -1.6975 -1.6097 -1.6030 3.4079 3.4217 3.5995 3.6143 3.8699 3.8915 3.9352 3.9638 4.0184 4.0861 4.2916 4.3086 4.9253 4.9599 5.1471 5.1566 5.3463 5.3966 5.3989 5.4555 5.5830 5.6005 5.6227 5.6670 6.4978 6.5417 7.3786 7.4061 7.5300 7.5358 8.1573 8.1860 9.8535 9.8583 10.1767 10.1887 11.7445 11.7809 11.9200 11.9629 12.3222 12.3287 k = 0.4872 0.2813-0.0000 ( 5506 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5002 -13.5000 -13.4823 -13.4821 -13.1422 -13.1419 -13.1167 -13.1166 -13.1020 -13.1020 -13.0944 -13.0943 -1.6942 -1.6918 -1.6095 -1.6059 3.4103 3.4173 3.6028 3.6102 3.8749 3.8858 3.9419 3.9566 4.0347 4.0692 4.2960 4.3047 4.9359 4.9531 5.1517 5.1560 5.3626 5.3890 5.4096 5.4396 5.5823 5.5892 5.6246 5.6473 6.5135 6.5356 7.3815 7.3959 7.5228 7.5259 8.1550 8.1695 9.8528 9.8553 10.1773 10.1835 11.7573 11.7757 11.9338 11.9555 12.3312 12.3347 k = 0.5000 0.2887-0.0000 ( 5510 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5001 -13.5001 -13.4822 -13.4822 -13.1421 -13.1421 -13.1167 -13.1167 -13.1020 -13.1020 -13.0944 -13.0944 -1.6907 -1.6907 -1.6083 -1.6083 3.4135 3.4135 3.6064 3.6064 3.8802 3.8802 3.9491 3.9491 4.0520 4.0520 4.3005 4.3005 4.9451 4.9451 5.1545 5.1545 5.3773 5.3773 5.4235 5.4235 5.5839 5.5839 5.6329 5.6329 6.5262 6.5262 7.3875 7.3875 7.5215 7.5215 8.1591 8.1591 9.8534 9.8534 10.1796 10.1796 11.7677 11.7677 11.9457 11.9457 12.3355 12.3355 k = 0.5000 0.2887-0.0000 ( 5510 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5001 -13.5001 -13.4822 -13.4822 -13.1421 -13.1421 -13.1167 -13.1167 -13.1020 -13.1020 -13.0944 -13.0944 -1.6907 -1.6907 -1.6083 -1.6083 3.4135 3.4135 3.6064 3.6064 3.8802 3.8802 3.9491 3.9491 4.0520 4.0520 4.3005 4.3005 4.9451 4.9451 5.1545 5.1545 5.3773 5.3773 5.4235 5.4235 5.5839 5.5839 5.6329 5.6329 6.5262 6.5262 7.3875 7.3875 7.5215 7.5215 8.1591 8.1591 9.8534 9.8534 10.1796 10.1796 11.7677 11.7677 11.9457 11.9457 12.3355 12.3355 k = 0.4928 0.3012-0.0000 ( 5504 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5001 -13.5000 -13.4822 -13.4822 -13.1421 -13.1420 -13.1167 -13.1167 -13.1020 -13.1020 -13.0944 -13.0943 -1.6906 -1.6901 -1.6083 -1.6078 3.4126 3.4168 3.6057 3.6079 3.8768 3.8840 3.9440 3.9541 4.0451 4.0586 4.2994 4.3017 4.9382 4.9497 5.1432 5.1663 5.3716 5.3825 5.4213 5.4257 5.5802 5.5834 5.6333 5.6370 6.4955 6.5547 7.3558 7.4097 7.4949 7.5441 8.1404 8.1749 9.8369 9.8826 10.1813 10.1887 11.7583 11.7777 11.9405 11.9513 12.3328 12.3376 k = 0.4855 0.3138-0.0000 ( 5504 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5001 -13.5000 -13.4823 -13.4821 -13.1421 -13.1420 -13.1167 -13.1166 -13.1021 -13.1020 -13.0945 -13.0943 -1.6899 -1.6890 -1.6079 -1.6070 3.4141 3.4226 3.6059 3.6102 3.8737 3.8881 3.9389 3.9589 4.0379 4.0646 4.2987 4.3029 4.9291 4.9515 5.1327 5.1782 5.3656 5.3870 5.4192 5.4281 5.5740 5.5789 5.6368 5.6451 6.4625 6.5810 7.3149 7.4224 7.4654 7.5620 8.1193 8.1873 9.8333 9.9232 10.1940 10.2084 11.7494 11.7880 11.9356 11.9574 12.3296 12.3391 k = 0.4783 0.3263-0.0000 ( 5500 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5002 -13.5000 -13.4823 -13.4821 -13.1421 -13.1420 -13.1168 -13.1166 -13.1021 -13.1020 -13.0946 -13.0943 -1.6887 -1.6872 -1.6071 -1.6058 3.4181 3.4309 3.6068 3.6132 3.8710 3.8924 3.9337 3.9635 4.0307 4.0701 4.2984 4.3041 4.9180 4.9503 5.1231 5.1901 5.3594 5.3904 5.4173 5.4304 5.5670 5.5716 5.6418 5.6558 6.4270 6.6047 7.2658 7.4259 7.4342 7.5754 8.0964 8.1961 9.8417 9.9727 10.2185 10.2384 11.7411 11.7984 11.9309 11.9637 12.3259 12.3398 k = 0.4710 0.3389-0.0000 ( 5498 PWs) bands (ev): -32.2055 -32.2055 -32.2012 -32.2012 -13.5002 -13.4999 -13.4824 -13.4821 -13.1421 -13.1419 -13.1168 -13.1166 -13.1021 -13.1020 -13.0947 -13.0944 -1.6868 -1.6849 -1.6059 -1.6042 3.4242 3.4416 3.6087 3.6171 3.8688 3.8968 3.9284 3.9680 4.0237 4.0749 4.2987 4.3051 4.9052 4.9458 5.1149 5.2018 5.3533 5.3925 5.4155 5.4326 5.5604 5.5624 5.6475 5.6680 6.3889 6.6252 7.2104 7.4024 7.4211 7.5846 8.0724 8.2010 9.8607 10.0278 10.2557 10.2784 11.7330 11.8082 11.9265 11.9699 12.3212 12.3392 k = 0.4638 0.3514-0.0000 ( 5500 PWs) bands (ev): -32.2055 -32.2055 -32.2012 -32.2012 -13.5002 -13.4999 -13.4824 -13.4821 -13.1421 -13.1418 -13.1169 -13.1166 -13.1022 -13.1021 -13.0948 -13.0945 -1.6844 -1.6820 -1.6044 -1.6023 3.4325 3.4547 3.6113 3.6217 3.8670 3.9012 3.9232 3.9721 4.0172 4.0791 4.2996 4.3059 4.8907 4.9381 5.1079 5.2132 5.3473 5.3931 5.4138 5.4347 5.5518 5.5548 5.6535 5.6811 6.3479 6.6409 7.1521 7.3706 7.4093 7.5900 8.0480 8.2021 9.8883 10.0851 10.3066 10.3278 11.7251 11.8166 11.9225 11.9756 12.3153 12.3365 k = 0.4565 0.3640-0.0000 ( 5500 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5003 -13.4999 -13.4825 -13.4821 -13.1421 -13.1418 -13.1169 -13.1167 -13.1023 -13.1022 -13.0950 -13.0945 -1.6815 -1.6786 -1.6025 -1.6000 3.4427 3.4700 3.6147 3.6270 3.8656 3.9053 3.9180 3.9756 4.0118 4.0825 4.3013 4.3062 4.8747 4.9271 5.1022 5.2241 5.3417 5.3919 5.4123 5.4368 5.5400 5.5505 5.6596 5.6947 6.3039 6.6493 7.0955 7.3393 7.3923 7.5916 8.0239 8.1993 9.9224 10.1418 10.3709 10.3858 11.7170 11.8219 11.9196 11.9799 12.3074 12.3300 k = 0.4493 0.3765-0.0000 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5003 -13.4999 -13.4825 -13.4821 -13.1420 -13.1417 -13.1170 -13.1167 -13.1024 -13.1022 -13.0951 -13.0946 -1.6781 -1.6747 -1.6004 -1.5975 3.4547 3.4875 3.6189 3.6331 3.8648 3.9090 3.9130 3.9783 4.0081 4.0852 4.3038 4.3060 4.8573 4.9133 5.0976 5.2344 5.3364 5.3888 5.4108 5.4389 5.5270 5.5475 5.6658 5.7085 6.2571 6.6464 7.0466 7.3088 7.3721 7.5896 8.0007 8.1926 9.9612 10.1971 10.4465 10.4509 11.7082 11.8220 11.9188 11.9817 12.2963 12.3159 k = 0.4420 0.3891-0.0000 ( 5494 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5003 -13.4999 -13.4826 -13.4821 -13.1420 -13.1416 -13.1171 -13.1167 -13.1025 -13.1023 -13.0953 -13.0947 -1.6741 -1.6702 -1.5980 -1.5948 3.4681 3.5069 3.6240 3.6399 3.8646 3.9083 3.9117 3.9797 4.0068 4.0871 4.3053 4.3072 4.8384 4.8968 5.0937 5.2441 5.3317 5.3837 5.4095 5.4410 5.5129 5.5457 5.6720 5.7222 6.2077 6.6276 7.0116 7.2797 7.3504 7.5842 7.9787 8.1823 10.0033 10.2516 10.5214 10.5303 11.6984 11.8153 11.9209 11.9795 12.2809 12.2927 k = 0.4348 0.4016-0.0000 ( 5510 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5004 -13.5000 -13.4826 -13.4822 -13.1420 -13.1416 -13.1171 -13.1168 -13.1026 -13.1025 -13.0955 -13.0949 -1.6699 -1.6654 -1.5955 -1.5919 3.4826 3.5281 3.6298 3.6474 3.8649 3.9038 3.9132 3.9803 4.0084 4.0885 4.3039 4.3114 4.8182 4.8780 5.0902 5.2530 5.3273 5.3770 5.4084 5.4433 5.4978 5.5449 5.6782 5.7359 6.1563 6.5911 6.9939 7.2524 7.3287 7.5756 7.9583 8.1685 10.0474 10.3061 10.5954 10.6187 11.6869 11.8015 11.9254 11.9719 12.2605 12.2671 k = 0.4275 0.4142-0.0000 ( 5516 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5005 -13.5000 -13.4827 -13.4822 -13.1420 -13.1416 -13.1172 -13.1168 -13.1027 -13.1026 -13.0956 -13.0950 -1.6652 -1.6602 -1.5929 -1.5890 3.4978 3.5506 3.6365 3.6555 3.8659 3.8998 3.9131 3.9808 4.0121 4.0893 4.3019 4.3165 4.7966 4.8573 5.0869 5.2608 5.3234 5.3688 5.4074 5.4457 5.4818 5.5448 5.6842 5.7492 6.1037 6.5398 6.9918 7.2274 7.3080 7.5645 7.9392 8.1513 10.0927 10.3611 10.6709 10.7088 11.6731 11.7814 11.9307 11.9582 12.2361 12.2438 k = 0.4203 0.4267-0.0000 ( 5504 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5005 -13.5000 -13.4827 -13.4822 -13.1419 -13.1415 -13.1172 -13.1169 -13.1028 -13.1026 -13.0958 -13.0952 -1.6601 -1.6545 -1.5901 -1.5859 3.5131 3.5740 3.6442 3.6644 3.8677 3.8963 3.9112 3.9823 4.0175 4.0897 4.2993 4.3225 4.7736 4.8349 5.0837 5.2673 5.3198 5.3599 5.4066 5.4482 5.4649 5.5451 5.6898 5.7621 6.0509 6.4790 7.0008 7.2057 7.2890 7.5517 7.9215 8.1309 10.1384 10.4168 10.7457 10.7980 11.6562 11.7565 11.9350 11.9391 12.2096 12.2229 k = 0.4130 0.4393-0.0000 ( 5508 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5005 -13.5000 -13.4828 -13.4822 -13.1419 -13.1414 -13.1173 -13.1170 -13.1029 -13.1027 -13.0960 -13.0953 -1.6548 -1.6486 -1.5875 -1.5831 3.5282 3.5973 3.6535 3.6737 3.8704 3.8936 3.9078 3.9847 4.0242 4.0897 4.2960 4.3293 4.7492 4.8111 5.0805 5.2718 5.3162 5.3509 5.4061 5.4477 5.4507 5.5455 5.6948 5.7745 5.9993 6.4138 7.0161 7.1882 7.2718 7.5381 7.9047 8.1074 10.1839 10.4733 10.8177 10.8843 11.6356 11.7284 11.9163 11.9366 12.1832 12.2007 k = 0.4058 0.4518-0.0000 ( 5512 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5001 -13.4828 -13.4823 -13.1418 -13.1414 -13.1174 -13.1171 -13.1030 -13.1028 -13.0961 -13.0955 -1.6493 -1.6425 -1.5849 -1.5803 3.5424 3.6191 3.6653 3.6833 3.8743 3.8918 3.9033 3.9880 4.0320 4.0894 4.2922 4.3369 4.7235 4.7859 5.0771 5.2732 5.3121 5.3433 5.4061 5.4304 5.4533 5.5458 5.6985 5.7862 5.9506 6.3478 7.0335 7.1767 7.2564 7.5246 7.8886 8.0811 10.2286 10.5302 10.8851 10.9659 11.6111 11.6988 11.8924 11.9341 12.1592 12.1731 k = 0.3986 0.4644-0.0000 ( 5504 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5001 -13.4828 -13.4823 -13.1418 -13.1413 -13.1174 -13.1171 -13.1030 -13.1029 -13.0963 -13.0956 -1.6437 -1.6362 -1.5824 -1.5777 3.5554 3.6375 3.6811 3.6928 3.8791 3.8918 3.8981 3.9918 4.0407 4.0890 4.2882 4.3454 4.6964 4.7596 5.0738 5.2706 5.3070 5.3382 5.4066 5.4140 5.4557 5.5459 5.7000 5.7973 5.9068 6.2832 7.0491 7.1737 7.2424 7.5123 7.8728 8.0521 10.2721 10.5875 10.9461 11.0411 11.5832 11.6694 11.8695 11.9267 12.1393 12.1401 k = 0.3913 0.4769-0.0000 ( 5514 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5001 -13.4829 -13.4824 -13.1417 -13.1413 -13.1175 -13.1173 -13.1031 -13.1030 -13.0964 -13.0958 -1.6380 -1.6298 -1.5803 -1.5755 3.5668 3.6516 3.7009 3.7015 3.8825 3.8926 3.8962 3.9959 4.0500 4.0884 4.2843 4.3546 4.6681 4.7323 5.0704 5.2637 5.2999 5.3364 5.3994 5.4079 5.4581 5.5455 5.6976 5.8076 5.8708 6.2215 7.0595 7.1815 7.2293 7.5021 7.8572 8.0207 10.3137 10.6447 10.9989 11.1082 11.5532 11.6419 11.8490 11.9145 12.1043 12.1244 k = 0.3841 0.4895-0.0000 ( 5512 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5002 -13.4829 -13.4825 -13.1417 -13.1412 -13.1176 -13.1174 -13.1032 -13.1031 -13.0965 -13.0960 -1.6322 -1.6233 -1.5784 -1.5736 3.5766 3.6626 3.7088 3.7229 3.8834 3.8871 3.9063 4.0000 4.0594 4.0877 4.2813 4.3644 4.6387 4.7044 5.0671 5.2535 5.2901 5.3372 5.3875 5.4104 5.4602 5.5443 5.6896 5.8172 5.8451 6.1637 7.0647 7.1997 7.2167 7.4944 7.8418 7.9873 10.3528 10.7015 11.0424 11.1644 11.5239 11.6178 11.8318 11.8991 12.0676 12.1140 k = 0.3768 0.5020-0.0000 ( 5508 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5002 -13.4829 -13.4825 -13.1416 -13.1412 -13.1177 -13.1174 -13.1033 -13.1032 -13.0966 -13.0961 -1.6267 -1.6168 -1.5769 -1.5723 3.5846 3.6719 3.7142 3.7451 3.8817 3.8834 3.9207 4.0041 4.0678 4.0869 4.2802 4.3747 4.6086 4.6761 5.0639 5.2416 5.2777 5.3396 5.3786 5.4141 5.4621 5.5418 5.6759 5.8262 5.8312 6.1102 7.0672 7.2041 7.2249 7.4897 7.8266 7.9522 10.3887 10.7577 11.0757 11.2057 11.5000 11.5985 11.8184 11.8824 12.0313 12.1074 k = 0.3696 0.5146-0.0000 ( 5494 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5003 -13.4829 -13.4825 -13.1415 -13.1412 -13.1177 -13.1175 -13.1033 -13.1032 -13.0966 -13.0962 -1.6212 -1.6104 -1.5759 -1.5715 3.5911 3.6803 3.7175 3.7660 3.8769 3.8830 3.9383 4.0082 4.0739 4.0860 4.2824 4.3850 4.5787 4.6477 5.0611 5.2297 5.2635 5.3428 5.3722 5.4196 5.4637 5.5374 5.6593 5.8271 5.8346 6.0611 7.0697 7.1912 7.2539 7.4880 7.8121 7.9163 10.4208 10.8126 11.0986 11.2265 11.4879 11.5845 11.8092 11.8666 11.9958 12.1035 k = 0.3623 0.5271-0.0000 ( 5500 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5003 -13.4829 -13.4826 -13.1415 -13.1412 -13.1178 -13.1176 -13.1034 -13.1033 -13.0967 -13.0963 -1.6162 -1.6043 -1.5755 -1.5715 3.5962 3.6879 3.7189 3.7846 3.8728 3.8823 3.9581 4.0121 4.0760 4.0848 4.2893 4.3940 4.5506 4.6197 5.0586 5.2190 5.2485 5.3462 5.3677 5.4268 5.4650 5.5300 5.6438 5.8301 5.8426 6.0166 7.0737 7.1777 7.2839 7.4887 7.7988 7.8805 10.4482 10.8660 11.1123 11.2239 11.4910 11.5751 11.8045 11.8531 11.9616 12.1018 k = 0.3551 0.5397-0.0000 ( 5500 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2011 -13.5006 -13.5004 -13.4829 -13.4827 -13.1415 -13.1412 -13.1178 -13.1177 -13.1034 -13.1033 -13.0967 -13.0964 -1.6116 -1.5984 -1.5755 -1.5722 3.5999 3.6948 3.7185 3.7999 3.8699 3.8811 3.9792 4.0159 4.0732 4.0833 4.3016 4.3992 4.5276 4.5928 5.0567 5.2105 5.2343 5.3495 5.3643 5.4359 5.4659 5.5193 5.6319 5.8379 5.8502 5.9763 7.0801 7.1637 7.3127 7.4913 7.7877 7.8462 10.4703 10.9170 11.1189 11.2025 11.5056 11.5690 11.8050 11.8430 11.9288 12.1019 k = 0.3478 0.5522-0.0000 ( 5512 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5006 -13.5004 -13.4829 -13.4828 -13.1414 -13.1412 -13.1179 -13.1178 -13.1035 -13.1034 -13.0967 -13.0965 -1.6079 -1.5929 -1.5759 -1.5737 3.6024 3.7010 3.7168 3.8111 3.8688 3.8794 4.0005 4.0194 4.0651 4.0815 4.3192 4.3963 4.5147 4.5676 5.0553 5.2050 5.2219 5.3526 5.3615 5.4470 5.4664 5.5057 5.6246 5.8491 5.8579 5.9401 7.0894 7.1489 7.3375 7.4945 7.7799 7.8157 10.4865 10.9644 11.1208 11.1710 11.5240 11.5643 11.8112 11.8367 11.8980 12.1038 k = 0.3406 0.5648-0.0000 ( 5508 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5006 -13.5005 -13.4829 -13.4828 -13.1414 -13.1413 -13.1179 -13.1178 -13.1035 -13.1034 -13.0967 -13.0966 -1.6052 -1.5883 -1.5765 -1.5758 3.6039 3.7064 3.7141 3.8175 3.8701 3.8769 4.0207 4.0227 4.0526 4.0793 4.3404 4.3830 4.5153 4.5451 5.0544 5.2033 5.2121 5.3552 5.3592 5.4599 5.4667 5.4904 5.6210 5.8633 5.8657 5.9077 7.1017 7.1334 7.3551 7.4971 7.7768 7.7923 10.4962 11.0044 11.1208 11.1382 11.5405 11.5591 11.8231 11.8341 11.8701 12.1073 k = 0.3333 0.5774-0.0000 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5005 -13.5005 -13.4829 -13.4829 -13.1413 -13.1413 -13.1179 -13.1178 -13.1034 -13.1033 -13.0967 -13.0967 -1.6041 -1.5859 -1.5770 -1.5770 3.6044 3.7107 3.7107 3.8194 3.8734 3.8734 4.0247 4.0377 4.0377 4.0780 4.3628 4.3628 4.5268 4.5268 5.0542 5.2057 5.2057 5.3572 5.3572 5.4669 5.4746 5.4746 5.6201 5.8727 5.8803 5.8803 7.1171 7.1171 7.3618 7.4981 7.7797 7.7797 10.4994 11.0233 11.1209 11.1209 11.5520 11.5520 11.8346 11.8346 11.8518 12.1118 k = 0.3333 0.5774-0.0000 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5005 -13.5005 -13.4829 -13.4829 -13.1413 -13.1413 -13.1179 -13.1178 -13.1034 -13.1033 -13.0967 -13.0967 -1.6041 -1.5859 -1.5770 -1.5770 3.6044 3.7107 3.7107 3.8194 3.8734 3.8734 4.0247 4.0377 4.0377 4.0780 4.3628 4.3628 4.5268 4.5268 5.0542 5.2057 5.2057 5.3572 5.3572 5.4669 5.4746 5.4746 5.6201 5.8727 5.8803 5.8803 7.1171 7.1171 7.3618 7.4981 7.7797 7.7797 10.4994 11.0233 11.1209 11.1209 11.5520 11.5520 11.8346 11.8346 11.8518 12.1118 k = 0.3259 0.5645-0.0000 ( 5506 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5005 -13.5004 -13.4829 -13.4828 -13.1414 -13.1413 -13.1179 -13.1178 -13.1034 -13.1034 -13.0967 -13.0966 -1.6054 -1.5886 -1.5769 -1.5750 3.6039 3.7067 3.7138 3.8179 3.8686 3.8778 4.0154 4.0317 4.0471 4.0813 4.3404 4.3829 4.5151 4.5454 5.0544 5.2032 5.2126 5.3558 5.3585 5.4589 5.4673 5.4913 5.6208 5.8517 5.8848 5.9006 7.0992 7.1358 7.3542 7.4970 7.7809 7.7895 10.4962 11.0041 11.1225 11.1374 11.5419 11.5568 11.8196 11.8380 11.8699 12.1086 k = 0.3185 0.5517-0.0000 ( 5508 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5006 -13.5004 -13.4830 -13.4828 -13.1414 -13.1412 -13.1179 -13.1178 -13.1034 -13.1033 -13.0967 -13.0965 -1.6091 -1.5944 -1.5762 -1.5718 3.6025 3.7023 3.7150 3.8141 3.8624 3.8819 3.9967 4.0341 4.0454 4.0917 4.3196 4.3954 4.5141 4.5681 5.0551 5.2048 5.2237 5.3553 5.3583 5.4452 5.4679 5.5094 5.6224 5.8287 5.8961 5.9239 7.0800 7.1576 7.3320 7.4940 7.7971 7.8066 10.4869 10.9655 11.1264 11.1697 11.5285 11.5538 11.8043 11.8434 11.8982 12.1090 k = 0.3111 0.5389-0.0000 ( 5506 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5006 -13.5003 -13.4830 -13.4827 -13.1415 -13.1411 -13.1178 -13.1177 -13.1034 -13.1033 -13.0967 -13.0964 -1.6150 -1.6021 -1.5752 -1.5686 3.6003 3.6978 3.7139 3.8091 3.8544 3.8852 3.9779 4.0373 4.0374 4.1047 4.3025 4.3978 4.5248 4.5933 5.0562 5.2106 5.2384 5.3562 5.3562 5.4344 5.4695 5.5289 5.6243 5.8087 5.9097 5.9505 7.0591 7.1817 7.2980 7.4903 7.8259 7.8303 10.4725 10.9221 11.1329 11.2036 11.5116 11.5427 11.7955 11.8507 11.9293 12.1136 k = 0.3037 0.5260-0.0000 ( 5494 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5007 -13.5002 -13.4830 -13.4825 -13.1416 -13.1411 -13.1177 -13.1176 -13.1033 -13.1032 -13.0967 -13.0963 -1.6231 -1.6114 -1.5742 -1.5660 3.5972 3.6932 3.7098 3.8034 3.8445 3.8873 3.9606 4.0267 4.0409 4.1171 4.2895 4.3930 4.5433 4.6200 5.0577 5.2195 5.2553 5.3516 5.3592 5.4277 5.4731 5.5495 5.6262 5.7918 5.9261 5.9806 7.0362 7.2052 7.2585 7.4870 7.8598 7.8642 10.4539 10.8777 11.1414 11.2353 11.4916 11.5244 11.7938 11.8597 11.9600 12.1251 k = 0.2963 0.5132-0.0000 ( 5488 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2011 -13.5007 -13.5001 -13.4830 -13.4824 -13.1417 -13.1410 -13.1176 -13.1174 -13.1032 -13.1031 -13.0967 -13.0961 -1.6330 -1.6223 -1.5735 -1.5640 3.5933 3.6887 3.7021 3.7977 3.8326 3.8880 3.9457 4.0148 4.0449 4.1285 4.2806 4.3851 4.5644 4.6474 5.0596 5.2302 5.2719 5.3446 5.3655 5.4254 5.4803 5.5709 5.6279 5.7782 5.9461 6.0144 7.0112 7.1928 7.2516 7.4856 7.8944 7.9094 10.4322 10.8336 11.1517 11.2635 11.4687 11.5002 11.7990 11.8704 11.9863 12.1303 k = 0.2889 0.5004-0.0000 ( 5486 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5007 -13.5000 -13.4830 -13.4823 -13.1418 -13.1409 -13.1175 -13.1172 -13.1031 -13.1030 -13.0966 -13.0960 -1.6447 -1.6348 -1.5733 -1.5628 3.5887 3.6843 3.6907 3.7925 3.8188 3.8875 3.9336 4.0030 4.0496 4.1389 4.2750 4.3764 4.5850 4.6750 5.0619 5.2406 5.2845 5.3373 5.3763 5.4266 5.4936 5.5929 5.6293 5.7684 5.9703 6.0520 6.9841 7.1427 7.2813 7.4872 7.9332 7.9596 10.4082 10.7904 11.1628 11.2873 11.4434 11.4716 11.8105 11.8831 12.0049 12.1300 k = 0.2815 0.4875-0.0000 ( 5486 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5007 -13.4999 -13.4829 -13.4821 -13.1419 -13.1409 -13.1173 -13.1170 -13.1029 -13.1029 -13.0966 -13.0959 -1.6580 -1.6488 -1.5737 -1.5623 3.5835 3.6761 3.6800 3.7877 3.8035 3.8858 3.9242 3.9921 4.0552 4.1485 4.2720 4.3680 4.6037 4.7023 5.0647 5.2488 5.2880 5.3334 5.3920 5.4294 5.5158 5.6153 5.6304 5.7629 5.9995 6.0938 6.9552 7.0869 7.3171 7.4925 7.9755 8.0135 10.3827 10.7485 11.1741 11.3062 11.4162 11.4399 11.8279 11.8982 12.0146 12.1261 k = 0.2741 0.4747-0.0000 ( 5490 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5007 -13.4998 -13.4829 -13.4819 -13.1420 -13.1408 -13.1171 -13.1168 -13.1027 -13.1027 -13.0966 -13.0957 -1.6731 -1.6645 -1.5747 -1.5627 3.5777 3.6592 3.6758 3.7831 3.7871 3.8831 3.9171 3.9823 4.0618 4.1576 4.2709 4.3602 4.6198 4.7292 5.0678 5.2539 5.2813 5.3339 5.4119 5.4325 5.5479 5.6311 5.6379 5.7628 6.0342 6.1397 6.9249 7.0293 7.3561 7.5019 8.0209 8.0703 10.3565 10.7079 11.1848 11.3199 11.3876 11.4062 11.8506 11.9161 12.0165 12.1172 k = 0.2667 0.4619-0.0000 ( 5488 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5008 -13.4997 -13.4828 -13.4817 -13.1421 -13.1408 -13.1169 -13.1165 -13.1026 -13.1025 -13.0965 -13.0955 -1.6897 -1.6818 -1.5765 -1.5638 3.5714 3.6410 3.6717 3.7705 3.7783 3.8799 3.9118 3.9738 4.0694 4.1665 4.2710 4.3531 4.6332 4.7554 5.0712 5.2561 5.2685 5.3354 5.4336 5.4353 5.5888 5.6319 5.6607 5.7693 6.0748 6.1898 6.8937 6.9715 7.3980 7.5159 8.0689 8.1295 10.3302 10.6689 11.1941 11.3271 11.3579 11.3724 11.8778 11.9370 12.0125 12.1027 k = 0.2593 0.4491-0.0000 ( 5486 PWs) bands (ev): -32.2054 -32.2054 -32.2012 -32.2012 -13.5008 -13.4995 -13.4828 -13.4815 -13.1422 -13.1407 -13.1166 -13.1161 -13.1023 -13.1023 -13.0964 -13.0954 -1.7079 -1.7005 -1.5791 -1.5658 3.5649 3.6226 3.6676 3.7543 3.7730 3.8763 3.9078 3.9663 4.0781 4.1753 4.2718 4.3467 4.6438 4.7807 5.0748 5.2529 5.2558 5.3358 5.4379 5.4544 5.6262 5.6432 5.6832 5.7840 6.1214 6.2442 6.8626 6.9145 7.4426 7.5343 8.1192 8.1905 10.3039 10.6314 11.2014 11.3198 11.3275 11.3469 11.9076 11.9607 12.0049 12.0830 k = 0.2519 0.4362-0.0000 ( 5498 PWs) bands (ev): -32.2055 -32.2055 -32.2012 -32.2012 -13.5008 -13.4994 -13.4827 -13.4813 -13.1424 -13.1407 -13.1163 -13.1158 -13.1021 -13.1021 -13.0963 -13.0952 -1.7277 -1.7208 -1.5824 -1.5686 3.5582 3.6047 3.6635 3.7390 3.7669 3.8727 3.9047 3.9598 4.0878 4.1841 4.2730 4.3408 4.6521 4.8052 5.0786 5.2358 5.2538 5.3347 5.4406 5.4722 5.6291 5.6944 5.7049 5.8081 6.1738 6.3027 6.8323 6.8596 7.4897 7.5571 8.1715 8.2531 10.2783 10.5955 11.2059 11.2885 11.2967 11.3400 11.9347 11.9852 11.9991 12.0613 k = 0.2444 0.4234-0.0000 ( 5494 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5008 -13.4993 -13.4825 -13.4810 -13.1425 -13.1407 -13.1160 -13.1154 -13.1019 -13.1018 -13.0962 -13.0950 -1.7488 -1.7424 -1.5864 -1.5722 3.5516 3.5878 3.6590 3.7252 3.7598 3.8692 3.9021 3.9540 4.0984 4.1930 4.2744 4.3353 4.6581 4.8287 5.0825 5.2176 5.2505 5.3324 5.4436 5.4861 5.6287 5.7258 5.7530 5.8417 6.2311 6.3649 6.8039 6.8082 7.5393 7.5843 8.2256 8.3170 10.2534 10.5612 11.2074 11.2508 11.2657 11.3348 11.9431 11.9971 12.0108 12.0521 k = 0.2370 0.4106-0.0000 ( 5500 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5008 -13.4992 -13.4824 -13.4807 -13.1426 -13.1406 -13.1156 -13.1149 -13.1016 -13.1016 -13.0961 -13.0949 -1.7712 -1.7654 -1.5912 -1.5766 3.5452 3.5723 3.6540 3.7132 3.7519 3.8661 3.8998 3.9487 4.1098 4.2018 4.2759 4.3303 4.6621 4.8513 5.0863 5.1985 5.2462 5.3290 5.4471 5.4961 5.6279 5.7463 5.8153 5.8836 6.2915 6.4302 6.7624 6.7790 7.5913 7.6156 8.2811 8.3821 10.2296 10.5284 11.2053 11.2114 11.2346 11.3271 11.9307 11.9781 12.0415 12.0750 k = 0.2296 0.3977-0.0000 ( 5494 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5008 -13.4990 -13.4822 -13.4804 -13.1427 -13.1406 -13.1152 -13.1144 -13.1013 -13.1012 -13.0960 -13.0947 -1.7949 -1.7896 -1.5966 -1.5817 3.5393 3.5585 3.6484 3.7034 3.7430 3.8633 3.8978 3.9437 4.1217 4.2106 4.2773 4.3257 4.6645 4.8730 5.0900 5.1787 5.2410 5.3246 5.4512 5.5029 5.6268 5.7667 5.8804 5.9322 6.3516 6.4969 6.7262 6.7598 7.6456 7.6509 8.3380 8.4481 10.2069 10.4970 11.1712 11.1995 11.2038 11.3168 11.9110 11.9477 12.0761 12.1115 k = 0.2222 0.3849-0.0000 ( 5490 PWs) bands (ev): -32.2056 -32.2056 -32.2013 -32.2013 -13.5007 -13.4989 -13.4821 -13.4801 -13.1428 -13.1405 -13.1148 -13.1139 -13.1009 -13.1009 -13.0959 -13.0946 -1.8198 -1.8149 -1.6027 -1.5875 3.5338 3.5465 3.6420 3.6957 3.7334 3.8608 3.8960 3.9390 4.1338 4.2191 4.2787 4.3214 4.6652 4.8938 5.0935 5.1580 5.2353 5.3194 5.4559 5.5074 5.6253 5.7872 5.9479 5.9860 6.4041 6.5606 6.7070 6.7512 7.6900 7.7022 8.3961 8.5149 10.1854 10.4668 11.1305 11.1728 11.1903 11.3040 11.8892 11.9151 12.1068 12.1522 k = 0.2148 0.3721-0.0000 ( 5494 PWs) bands (ev): -32.2056 -32.2056 -32.2014 -32.2014 -13.5007 -13.4987 -13.4819 -13.4798 -13.1429 -13.1404 -13.1143 -13.1134 -13.1006 -13.1005 -13.0958 -13.0944 -1.8457 -1.8412 -1.6094 -1.5941 3.5291 3.5362 3.6350 3.6901 3.7233 3.8585 3.8943 3.9344 4.1459 4.2275 4.2800 4.3173 4.6647 4.9137 5.0968 5.1366 5.2290 5.3134 5.4614 5.5101 5.6236 5.8076 6.0174 6.0439 6.4383 6.6105 6.7160 6.7644 7.7325 7.7609 8.4551 8.5823 10.1652 10.4378 11.0897 11.1422 11.1772 11.2889 11.8670 11.8828 12.1276 12.1935 k = 0.2074 0.3592-0.0000 ( 5494 PWs) bands (ev): -32.2056 -32.2056 -32.2014 -32.2014 -13.5006 -13.4986 -13.4817 -13.4795 -13.1429 -13.1404 -13.1138 -13.1128 -13.1002 -13.1001 -13.0957 -13.0943 -1.8724 -1.8684 -1.6167 -1.6013 3.5251 3.5277 3.6276 3.6862 3.7126 3.8564 3.8929 3.9299 4.1577 4.2354 4.2812 4.3137 4.6629 4.9326 5.0999 5.1144 5.2223 5.3067 5.4677 5.5117 5.6215 5.8273 6.0887 6.1052 6.4489 6.6355 6.7590 6.8110 7.7782 7.8217 8.5150 8.6502 10.1465 10.4097 11.0492 11.1121 11.1605 11.2719 11.8456 11.8517 12.1349 12.2205 k = 0.2000 0.3464-0.0000 ( 5498 PWs) bands (ev): -32.2057 -32.2057 -32.2014 -32.2014 -13.5006 -13.4984 -13.4814 -13.4792 -13.1430 -13.1403 -13.1133 -13.1122 -13.0998 -13.0997 -13.0956 -13.0942 -1.8999 -1.8963 -1.6246 -1.6091 3.5209 3.5218 3.6201 3.6836 3.7017 3.8543 3.8918 3.9254 4.1688 4.2428 4.2823 4.3103 4.6602 4.9505 5.0914 5.1028 5.2153 5.2995 5.4747 5.5125 5.6192 5.8455 6.1617 6.1695 6.4451 6.6446 6.8276 6.8820 7.8267 7.8844 8.5756 8.7184 10.1291 10.3824 11.0093 11.0823 11.1404 11.2529 11.8225 11.8257 12.1305 12.2132 k = 0.1926 0.3336-0.0000 ( 5492 PWs) bands (ev): -32.2057 -32.2057 -32.2014 -32.2014 -13.5005 -13.4982 -13.4812 -13.4788 -13.1430 -13.1403 -13.1127 -13.1116 -13.0994 -13.0992 -13.0955 -13.0940 -1.9280 -1.9248 -1.6329 -1.6174 3.5157 3.5194 3.6126 3.6822 3.6906 3.8522 3.8911 3.9209 4.1790 4.2497 4.2833 4.3072 4.6565 4.9672 5.0677 5.1055 5.2081 5.2918 5.4823 5.5127 5.6165 5.8611 6.2364 6.2364 6.4387 6.6510 6.9109 6.9646 7.8779 7.9490 8.6368 8.7870 10.1132 10.3557 10.9706 11.0530 11.1171 11.2320 11.7953 11.8078 12.1185 12.1995 k = 0.1852 0.3208-0.0000 ( 5480 PWs) bands (ev): -32.2057 -32.2057 -32.2015 -32.2015 -13.5004 -13.4981 -13.4809 -13.4785 -13.1430 -13.1402 -13.1121 -13.1110 -13.0989 -13.0988 -13.0954 -13.0939 -1.9565 -1.9537 -1.6417 -1.6262 3.5119 3.5176 3.6055 3.6795 3.6815 3.8498 3.8909 3.9164 4.1882 4.2558 4.2844 4.3044 4.6522 4.9823 5.0438 5.1079 5.2009 5.2838 5.4902 5.5123 5.6138 5.8729 6.3056 6.3127 6.4372 6.6605 7.0023 7.0529 7.9311 8.0152 8.6986 8.8557 10.0988 10.3292 10.9335 11.0244 11.0907 11.2092 11.7702 11.7924 12.1024 12.1855 k = 0.1778 0.3079-0.0000 ( 5492 PWs) bands (ev): -32.2058 -32.2058 -32.2015 -32.2015 -13.5004 -13.4980 -13.4806 -13.4781 -13.1431 -13.1402 -13.1115 -13.1103 -13.0985 -13.0984 -13.0953 -13.0938 -1.9854 -1.9829 -1.6508 -1.6354 3.5094 3.5163 3.5989 3.6685 3.6816 3.8471 3.8913 3.9117 4.1961 4.2613 4.2854 4.3016 4.6474 4.9931 5.0223 5.1101 5.1937 5.2756 5.4981 5.5114 5.6111 5.8800 6.3770 6.3906 6.4445 6.6752 7.0986 7.1444 7.9862 8.0828 8.7611 8.9245 10.0857 10.3028 10.8986 10.9964 11.0616 11.1841 11.7469 11.7796 12.0842 12.1723 k = 0.1704 0.2951-0.0000 ( 5504 PWs) bands (ev): -32.2058 -32.2058 -32.2015 -32.2015 -13.5003 -13.4978 -13.4803 -13.4778 -13.1431 -13.1402 -13.1109 -13.1097 -13.0980 -13.0979 -13.0953 -13.0937 -2.0144 -2.0123 -1.6601 -1.6450 3.5079 3.5156 3.5927 3.6577 3.6822 3.8441 3.8923 3.9071 4.2027 4.2658 4.2867 4.2987 4.6423 4.9836 5.0194 5.1121 5.1867 5.2674 5.5053 5.5100 5.6091 5.8821 6.4496 6.4634 6.4700 6.6965 7.1975 7.2378 8.0425 8.1518 8.8241 8.9933 10.0742 10.2764 10.8663 10.9690 11.0299 11.1566 11.7249 11.7697 12.0652 12.1606 k = 0.1630 0.2823-0.0000 ( 5514 PWs) bands (ev): -32.2059 -32.2059 -32.2016 -32.2016 -13.5002 -13.4977 -13.4800 -13.4775 -13.1431 -13.1402 -13.1102 -13.1090 -13.0976 -13.0975 -13.0952 -13.0936 -2.0435 -2.0416 -1.6697 -1.6548 3.5073 3.5151 3.5871 3.6473 3.6833 3.8407 3.8941 3.9024 4.2082 4.2693 4.2882 4.2954 4.6370 4.9591 5.0299 5.1138 5.1801 5.2592 5.5080 5.5112 5.6082 5.8794 6.4906 6.5270 6.5508 6.7249 7.2979 7.3321 8.0996 8.2217 8.8880 9.0623 10.0641 10.2499 10.8370 10.9423 10.9960 11.1262 11.7035 11.7626 12.0460 12.1502 k = 0.1556 0.2694-0.0000 ( 5504 PWs) bands (ev): -32.2059 -32.2059 -32.2016 -32.2016 -13.5001 -13.4976 -13.4797 -13.4771 -13.1431 -13.1402 -13.1095 -13.1083 -13.0971 -13.0970 -13.0951 -13.0935 -2.0723 -2.0708 -1.6794 -1.6647 3.5072 3.5148 3.5822 3.6372 3.6849 3.8371 3.8966 3.8978 4.2127 4.2718 4.2901 4.2912 4.6318 4.9321 5.0413 5.1153 5.1738 5.2512 5.5056 5.5150 5.6091 5.8731 6.5304 6.6042 6.6327 6.7607 7.3985 7.4264 8.1569 8.2925 8.9528 9.1313 10.0555 10.2235 10.8110 10.9153 10.9608 11.0925 11.6816 11.7580 12.0272 12.1164 k = 0.1481 0.2566-0.0000 ( 5511 PWs) bands (ev): -32.2059 -32.2059 -32.2016 -32.2016 -13.5000 -13.4975 -13.4794 -13.4768 -13.1431 -13.1402 -13.1088 -13.1076 -13.0967 -13.0965 -13.0950 -13.0934 -2.1009 -2.0996 -1.6892 -1.6748 3.5075 3.5143 3.5780 3.6277 3.6867 3.8331 3.8933 3.8998 4.2164 4.2731 4.2860 4.2924 4.6268 4.9043 5.0522 5.1165 5.1680 5.2434 5.5026 5.5164 5.6122 5.8641 6.5796 6.6832 6.7152 6.8047 7.4984 7.5200 8.2140 8.3639 9.0188 9.2006 10.0484 10.1972 10.7881 10.8861 10.9263 11.0550 11.6582 11.7550 12.0037 12.0381 k = 0.1407 0.2438-0.0000 ( 5503 PWs) bands (ev): -32.2060 -32.2060 -32.2017 -32.2017 -13.4999 -13.4974 -13.4790 -13.4764 -13.1431 -13.1402 -13.1081 -13.1069 -13.0962 -13.0961 -13.0949 -13.0933 -2.1291 -2.1280 -1.6989 -1.6850 3.5080 3.5137 3.5747 3.6188 3.6889 3.8288 3.8889 3.9038 4.2195 4.2735 4.2793 4.2949 4.6221 4.8762 5.0624 5.1175 5.1628 5.2359 5.4991 5.5153 5.6174 5.8538 6.6371 6.7638 6.7969 6.8578 7.5967 7.6120 8.2703 8.4354 9.0863 9.2702 10.0429 10.1715 10.7682 10.8504 10.8966 11.0132 11.6319 11.7520 11.9413 11.9828 k = 0.1333 0.2309-0.0000 ( 5491 PWs) bands (ev): -32.2060 -32.2060 -32.2017 -32.2017 -13.4998 -13.4973 -13.4786 -13.4761 -13.1430 -13.1402 -13.1073 -13.1062 -13.0957 -13.0956 -13.0948 -13.0932 -2.1566 -2.1558 -1.7086 -1.6951 3.5083 3.5126 3.5722 3.6107 3.6912 3.8244 3.8848 3.9084 4.2221 4.2713 4.2730 4.2976 4.6178 4.8480 5.0717 5.1183 5.1583 5.2288 5.4952 5.5120 5.6245 5.8430 6.7020 6.8458 6.8748 6.9227 7.6924 7.7017 8.3252 8.5067 9.1556 9.3404 10.0389 10.1470 10.7506 10.8063 10.8733 10.9666 11.6017 11.7452 11.8664 11.9153 k = 0.1259 0.2181-0.0000 ( 5495 PWs) bands (ev): -32.2060 -32.2060 -32.2017 -32.2017 -13.4997 -13.4972 -13.4783 -13.4758 -13.1430 -13.1402 -13.1066 -13.1055 -13.0952 -13.0951 -13.0947 -13.0931 -2.1835 -2.1828 -1.7181 -1.7051 3.5084 3.5111 3.5705 3.6034 3.6938 3.8198 3.8811 3.9138 4.2241 4.2620 4.2717 4.3003 4.6140 4.8201 5.0803 5.1188 5.1544 5.2220 5.4909 5.5073 5.6327 5.8324 6.7732 6.9288 6.9479 6.9999 7.7848 7.7883 8.3785 8.5774 9.2269 9.4114 10.0364 10.1243 10.7341 10.7555 10.8547 10.9153 11.5668 11.7241 11.8039 11.8511 k = 0.1185 0.2053-0.0000 ( 5491 PWs) bands (ev): -32.2061 -32.2061 -32.2018 -32.2018 -13.4995 -13.4972 -13.4779 -13.4754 -13.1429 -13.1402 -13.1058 -13.1049 -13.0949 -13.0946 -13.0945 -13.0931 -2.2095 -2.2090 -1.7275 -1.7150 3.5080 3.5091 3.5696 3.5971 3.6964 3.8151 3.8778 3.9198 4.2246 4.2524 4.2696 4.3030 4.6105 4.7927 5.0881 5.1191 5.1511 5.2157 5.4864 5.5016 5.6416 5.8225 6.8500 7.0126 7.0203 7.0846 7.8709 7.8729 8.4298 8.6469 9.3005 9.4833 10.0354 10.1043 10.6988 10.7160 10.8393 10.8608 11.5272 11.6746 11.7688 11.7914 k = 0.1111 0.1925-0.0000 ( 5499 PWs) bands (ev): -32.2061 -32.2061 -32.2018 -32.2018 -13.4994 -13.4971 -13.4776 -13.4752 -13.1429 -13.1402 -13.1052 -13.1043 -13.0947 -13.0942 -13.0942 -13.0930 -2.2346 -2.2342 -1.7366 -1.7247 3.5067 3.5070 3.5693 3.5918 3.6992 3.8103 3.8751 3.9265 4.2207 4.2458 4.2668 4.3055 4.6074 4.7662 5.0951 5.1193 5.1485 5.2097 5.4818 5.4954 5.6508 5.8134 6.9315 7.0956 7.0970 7.1724 7.9488 7.9561 8.4789 8.7145 9.3764 9.5565 10.0358 10.0877 10.6368 10.6891 10.8091 10.8266 11.4838 11.6111 11.7361 11.7465 k = 0.1037 0.1796-0.0000 ( 5493 PWs) bands (ev): -32.2062 -32.2062 -32.2018 -32.2018 -13.4993 -13.4970 -13.4772 -13.4749 -13.1428 -13.1403 -13.1045 -13.1036 -13.0946 -13.0937 -13.0937 -13.0930 -2.2586 -2.2583 -1.7453 -1.7340 3.5039 3.5054 3.5695 3.5875 3.7020 3.8055 3.8731 3.9340 4.2102 4.2446 4.2632 4.3079 4.6045 4.7407 5.1014 5.1195 5.1465 5.2041 5.4771 5.4890 5.6600 5.8053 7.0172 7.1748 7.1816 7.2616 8.0213 8.0338 8.5259 8.7794 9.4546 9.6310 10.0371 10.0756 10.5701 10.6415 10.7719 10.8165 11.4385 11.5481 11.6847 11.7231 k = 0.0963 0.1668-0.0000 ( 5493 PWs) bands (ev): -32.2062 -32.2062 -32.2019 -32.2018 -13.4991 -13.4970 -13.4768 -13.4746 -13.1427 -13.1403 -13.1038 -13.1030 -13.0946 -13.0933 -13.0933 -13.0929 -2.2814 -2.2812 -1.7537 -1.7431 3.5009 3.5031 3.5701 3.5841 3.7048 3.8006 3.8719 3.9421 4.1954 4.2468 4.2586 4.3101 4.6019 4.7166 5.1071 5.1197 5.1449 5.1988 5.4726 5.4827 5.6689 5.7981 7.1062 7.2576 7.2660 7.3510 8.0880 8.1057 8.5707 8.8405 9.5345 9.7068 10.0385 10.0690 10.4998 10.5701 10.7519 10.8086 11.3933 11.4896 11.6359 11.6952 k = 0.0889 0.1540-0.0000 ( 5503 PWs) bands (ev): -32.2062 -32.2062 -32.2019 -32.2019 -13.4990 -13.4970 -13.4765 -13.4744 -13.1427 -13.1404 -13.1032 -13.1025 -13.0945 -13.0930 -13.0929 -13.0928 -2.3029 -2.3029 -1.7617 -1.7517 3.4977 3.5003 3.5707 3.5815 3.7076 3.7958 3.8717 3.9510 4.1784 4.2504 4.2530 4.3120 4.5993 4.6941 5.1122 5.1201 5.1437 5.1938 5.4682 5.4766 5.6776 5.7918 7.1980 7.3437 7.3497 7.4400 8.1486 8.1717 8.6134 8.8965 9.6152 9.7836 10.0386 10.0686 10.4287 10.4835 10.7415 10.8030 11.3500 11.4365 11.5888 11.6619 k = 0.0815 0.1411-0.0000 ( 5499 PWs) bands (ev): -32.2063 -32.2063 -32.2019 -32.2019 -13.4989 -13.4970 -13.4762 -13.4742 -13.1426 -13.1405 -13.1025 -13.1020 -13.0944 -13.0929 -13.0925 -13.0925 -2.3231 -2.3231 -1.7692 -1.7599 3.4945 3.4971 3.5715 3.5796 3.7104 3.7910 3.8725 3.9605 4.1601 4.2463 4.2547 4.3137 4.5967 4.6734 5.1166 5.1207 5.1428 5.1891 5.4641 5.4709 5.6858 5.7864 7.2918 7.4321 7.4323 7.5277 8.2033 8.2322 8.6541 8.9461 9.6945 9.8608 10.0345 10.0747 10.3618 10.3886 10.7358 10.7996 11.3101 11.3888 11.5425 11.6231 k = 0.0741 0.1283-0.0000 ( 5507 PWs) bands (ev): -32.2063 -32.2063 -32.2019 -32.2019 -13.4988 -13.4970 -13.4759 -13.4740 -13.1425 -13.1406 -13.1019 -13.1015 -13.0943 -13.0928 -13.0922 -13.0922 -2.3418 -2.3418 -1.7761 -1.7676 3.4914 3.4938 3.5722 3.5781 3.7131 3.7862 3.8744 3.9707 4.1411 4.2385 4.2594 4.3151 4.5942 4.6547 5.1206 5.1216 5.1422 5.1847 5.4603 5.4657 5.6936 5.7816 7.3867 7.5132 7.5219 7.6134 8.2529 8.2876 8.6925 8.9881 9.7670 9.9361 10.0236 10.0857 10.2925 10.3073 10.7326 10.7982 11.2742 11.3459 11.4965 11.5789 k = 0.0667 0.1155-0.0000 ( 5507 PWs) bands (ev): -32.2063 -32.2063 -32.2020 -32.2020 -13.4987 -13.4970 -13.4755 -13.4739 -13.1425 -13.1406 -13.1014 -13.1010 -13.0943 -13.0928 -13.0919 -13.0918 -2.3590 -2.3589 -1.7825 -1.7747 3.4883 3.4903 3.5729 3.5771 3.7159 3.7815 3.8774 3.9816 4.1217 4.2293 4.2645 4.3161 4.5917 4.6382 5.1228 5.1240 5.1417 5.1804 5.4569 5.4610 5.7010 5.7774 7.4817 7.5918 7.6117 7.6959 8.2987 8.3391 8.7285 9.0213 9.8148 9.9978 10.0151 10.0952 10.2148 10.2743 10.7315 10.7989 11.2428 11.3072 11.4507 11.5298 k = 0.0593 0.1026-0.0000 ( 5515 PWs) bands (ev): -32.2063 -32.2063 -32.2020 -32.2020 -13.4985 -13.4971 -13.4753 -13.4737 -13.1424 -13.1407 -13.1009 -13.1006 -13.0942 -13.0928 -13.0915 -13.0915 -2.3746 -2.3745 -1.7882 -1.7813 3.4855 3.4870 3.5734 3.5763 3.7187 3.7769 3.8817 3.9931 4.1021 4.2190 4.2697 4.3167 4.5891 4.6238 5.1243 5.1269 5.1414 5.1764 5.4538 5.4568 5.7079 5.7736 7.5754 7.6673 7.6996 7.7740 8.3427 8.3879 8.7620 9.0451 9.8036 9.9806 10.0413 10.1258 10.1981 10.2647 10.7325 10.8015 11.2159 11.2720 11.4049 11.4766 k = 0.0519 0.0898-0.0000 ( 5523 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4984 -13.4971 -13.4750 -13.4737 -13.1423 -13.1408 -13.1004 -13.1002 -13.0941 -13.0929 -13.0913 -13.0913 -2.3885 -2.3883 -1.7934 -1.7872 3.4828 3.4839 3.5738 3.5757 3.7216 3.7724 3.8872 4.0053 4.0826 4.2075 4.2749 4.3170 4.5866 4.6117 5.1260 5.1294 5.1412 5.1724 5.4512 5.4532 5.7143 5.7701 7.6664 7.7390 7.7833 7.8462 8.3876 8.4357 8.7928 9.0595 9.7393 9.8864 10.1015 10.1898 10.2267 10.2730 10.7360 10.8059 11.1934 11.2396 11.3595 11.4207 k = 0.0444 0.0770-0.0000 ( 5527 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4983 -13.4972 -13.4748 -13.4736 -13.1422 -13.1409 -13.1001 -13.0999 -13.0940 -13.0929 -13.0910 -13.0910 -2.4006 -2.4005 -1.7978 -1.7925 3.4803 3.4811 3.5740 3.5752 3.7245 3.7680 3.8939 4.0181 4.0633 4.1949 4.2802 4.3169 4.5842 4.6016 5.1280 5.1315 5.1411 5.1686 5.4489 5.4502 5.7202 5.7669 7.7526 7.8059 7.8600 7.9105 8.4363 8.4842 8.8211 9.0650 9.6516 9.7742 10.1709 10.2551 10.2710 10.2941 10.7431 10.8120 11.1749 11.2097 11.3147 11.3639 k = 0.0370 0.0642-0.0000 ( 5531 PWs) bands (ev): -32.2064 -32.2064 -32.2020 -32.2020 -13.4982 -13.4972 -13.4745 -13.4735 -13.1421 -13.1411 -13.0997 -13.0996 -13.0939 -13.0930 -13.0909 -13.0909 -2.4109 -2.4108 -1.8015 -1.7971 3.4782 3.4787 3.5742 3.5749 3.7275 3.7637 3.9020 4.0309 4.0450 4.1814 4.2852 4.3163 4.5820 4.5936 5.1302 5.1332 5.1412 5.1649 5.4469 5.4477 5.7257 5.7638 7.8317 7.8672 7.9270 7.9651 8.4918 8.5353 8.8474 9.0623 9.5549 9.6579 10.2358 10.3119 10.3226 10.3263 10.7550 10.8193 11.1597 11.1820 11.2713 11.3084 k = 0.0296 0.0513-0.0000 ( 5535 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4981 -13.4973 -13.4743 -13.4735 -13.1420 -13.1412 -13.0994 -13.0994 -13.0938 -13.0930 -13.0907 -13.0907 -2.4195 -2.4194 -1.8045 -1.8010 3.4764 3.4766 3.5742 3.5746 3.7306 3.7595 3.9112 4.0253 4.0462 4.1670 4.2901 4.3152 4.5800 4.5873 5.1324 5.1346 5.1414 5.1612 5.4453 5.4458 5.7309 5.7608 7.9011 7.9224 7.9814 8.0082 8.5556 8.5903 8.8722 9.0525 9.4562 9.5419 10.2880 10.3578 10.3699 10.3749 10.7723 10.8275 11.1470 11.1570 11.2307 11.2565 k = 0.0222 0.0385-0.0000 ( 5545 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4980 -13.4974 -13.4741 -13.4735 -13.1419 -13.1413 -13.0993 -13.0992 -13.0937 -13.0931 -13.0906 -13.0906 -2.4261 -2.4260 -1.8068 -1.8041 3.4749 3.4750 3.5742 3.5744 3.7338 3.7555 3.9217 4.0079 4.0604 4.1521 4.2947 4.3137 4.5783 4.5827 5.1345 5.1357 5.1420 5.1577 5.4441 5.4443 5.7356 5.7577 7.9570 7.9720 8.0207 8.0398 8.6262 8.6490 8.8963 9.0368 9.3611 9.4302 10.3271 10.3897 10.4192 10.4237 10.7942 10.8356 11.1351 11.1354 11.1955 11.2113 k = 0.0148 0.0257-0.0000 ( 5533 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4978 -13.4974 -13.4740 -13.4736 -13.1418 -13.1413 -13.0991 -13.0991 -13.0936 -13.0932 -13.0904 -13.0904 -2.4308 -2.4308 -1.8083 -1.8065 3.4738 3.4739 3.5742 3.5743 3.7371 3.7516 3.9334 3.9911 4.0752 4.1369 4.2990 4.3117 4.5771 4.5795 5.1361 5.1365 5.1433 5.1543 5.4432 5.4433 5.7399 5.7545 7.9978 8.0151 8.0431 8.0608 8.6977 8.7083 8.9199 9.0165 9.2771 9.3282 10.3579 10.4061 10.4632 10.4650 10.8167 10.8424 11.1188 11.1227 11.1690 11.1759 k = 0.0074 0.0128-0.0000 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4977 -13.4975 -13.4738 -13.4736 -13.1417 -13.1415 -13.0990 -13.0990 -13.0935 -13.0933 -13.0904 -13.0904 -2.4337 -2.4336 -1.8090 -1.8081 3.4732 3.4732 3.5742 3.5742 3.7405 3.7477 3.9463 3.9752 4.0904 4.1214 4.3028 4.3092 4.5765 4.5775 5.1369 5.1370 5.1453 5.1510 5.4427 5.4427 5.7440 5.7512 8.0264 8.0472 8.0499 8.0701 8.7568 8.7588 8.9434 8.9927 9.2178 9.2465 10.3824 10.4087 10.4932 10.4935 10.8346 10.8462 11.1086 11.1113 11.1529 11.1541 k = 0.0000 0.0000 0.0000 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4976 -13.4976 -13.4737 -13.4737 -13.1416 -13.1416 -13.0990 -13.0990 -13.0934 -13.0934 -13.0904 -13.0904 -2.4346 -2.4346 -1.8089 -1.8089 3.4729 3.4729 3.5742 3.5742 3.7441 3.7441 3.9602 3.9602 4.1058 4.1058 4.3063 4.3063 4.5765 4.5765 5.1372 5.1372 5.1480 5.1480 5.4425 5.4425 5.7477 5.7477 8.0438 8.0438 8.0658 8.0658 8.7808 8.7808 8.9675 8.9675 9.2043 9.2043 10.3999 10.3999 10.5038 10.5038 10.8443 10.8443 11.1058 11.1058 11.1472 11.1472 k = 0.0000 0.0000 0.0000 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4976 -13.4976 -13.4737 -13.4737 -13.1416 -13.1416 -13.0990 -13.0990 -13.0934 -13.0934 -13.0904 -13.0904 -2.4346 -2.4346 -1.8089 -1.8089 3.4729 3.4729 3.5742 3.5742 3.7441 3.7441 3.9602 3.9602 4.1058 4.1058 4.3063 4.3063 4.5765 4.5765 5.1372 5.1372 5.1480 5.1480 5.4425 5.4425 5.7477 5.7477 8.0438 8.0438 8.0658 8.0658 8.7808 8.7808 8.9675 8.9675 9.2043 9.2043 10.3999 10.3999 10.5038 10.5038 10.8443 10.8443 11.1058 11.1058 11.1472 11.1472 k = 0.0000 0.0000 0.0150 ( 5523 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4976 -13.4976 -13.4737 -13.4737 -13.1415 -13.1415 -13.0989 -13.0989 -13.0934 -13.0934 -13.0904 -13.0904 -2.4337 -2.4337 -1.8100 -1.8100 3.4731 3.4731 3.5740 3.5740 3.7441 3.7441 3.9584 3.9584 4.1060 4.1060 4.3058 4.3058 4.5796 4.5796 5.1376 5.1376 5.1476 5.1476 5.4419 5.4419 5.7500 5.7500 8.0377 8.0377 8.0673 8.0673 8.7828 8.7828 8.9684 8.9684 9.2051 9.2051 10.3895 10.3895 10.4989 10.4989 10.8567 10.8567 11.1067 11.1067 11.1482 11.1482 k = 0.0000 0.0000 0.0301 ( 5529 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4975 -13.4975 -13.4738 -13.4738 -13.1413 -13.1413 -13.0989 -13.0989 -13.0937 -13.0937 -13.0904 -13.0904 -2.4312 -2.4312 -1.8133 -1.8133 3.4735 3.4735 3.5735 3.5735 3.7444 3.7444 3.9532 3.9532 4.1066 4.1066 4.3043 4.3043 4.5887 4.5887 5.1388 5.1388 5.1464 5.1464 5.4403 5.4403 5.7570 5.7570 8.0196 8.0196 8.0717 8.0717 8.7886 8.7886 8.9709 8.9709 9.2074 9.2074 10.3611 10.3611 10.4843 10.4843 10.8907 10.8907 11.1092 11.1092 11.1514 11.1514 k = 0.0000 0.0000 0.0451 ( 5523 PWs) bands (ev): -32.2064 -32.2064 -32.2021 -32.2021 -13.4972 -13.4972 -13.4740 -13.4740 -13.1409 -13.1409 -13.0989 -13.0989 -13.0941 -13.0941 -13.0904 -13.0904 -2.4270 -2.4270 -1.8188 -1.8188 3.4742 3.4742 3.5726 3.5726 3.7448 3.7448 3.9450 3.9450 4.1074 4.1074 4.3018 4.3018 4.6031 4.6031 5.1409 5.1409 5.1445 5.1445 5.4376 5.4376 5.7686 5.7686 7.9904 7.9904 8.0792 8.0792 8.7983 8.7983 8.9741 8.9741 9.2113 9.2113 10.3206 10.3206 10.4605 10.4605 10.9405 10.9405 11.1134 11.1134 11.1569 11.1569 k = 0.0000 0.0000 0.0601 ( 5523 PWs) bands (ev): -32.2063 -32.2063 -32.2022 -32.2022 -13.4970 -13.4970 -13.4741 -13.4741 -13.1406 -13.1406 -13.0987 -13.0987 -13.0946 -13.0946 -13.0906 -13.0906 -2.4211 -2.4211 -1.8263 -1.8263 3.4752 3.4752 3.5715 3.5715 3.7453 3.7453 3.9346 3.9346 4.1085 4.1085 4.2984 4.2984 4.6222 4.6222 5.1418 5.1418 5.1438 5.1438 5.4338 5.4338 5.7850 5.7850 7.9511 7.9511 8.0895 8.0895 8.8118 8.8118 8.9770 8.9770 9.2169 9.2169 10.2733 10.2733 10.4285 10.4285 11.0008 11.0008 11.1191 11.1191 11.1644 11.1644 k = 0.0000 0.0000 0.0751 ( 5517 PWs) bands (ev): -32.2063 -32.2063 -32.2022 -32.2022 -13.4966 -13.4966 -13.4744 -13.4744 -13.1400 -13.1400 -13.0986 -13.0986 -13.0953 -13.0953 -13.0907 -13.0907 -2.4136 -2.4136 -1.8359 -1.8359 3.4765 3.4765 3.5700 3.5700 3.7460 3.7460 3.9225 3.9225 4.1098 4.1098 4.2941 4.2941 4.6450 4.6450 5.1384 5.1384 5.1474 5.1474 5.4290 5.4290 5.8064 5.8064 7.9029 7.9029 8.1028 8.1028 8.8290 8.8290 8.9784 8.9784 9.2240 9.2240 10.2226 10.2226 10.3891 10.3891 11.0682 11.0682 11.1266 11.1266 11.1741 11.1741 k = 0.0000 0.0000 0.0902 ( 5504 PWs) bands (ev): -32.2062 -32.2062 -32.2023 -32.2023 -13.4961 -13.4961 -13.4747 -13.4747 -13.1392 -13.1392 -13.0985 -13.0985 -13.0962 -13.0962 -13.0908 -13.0908 -2.4044 -2.4044 -1.8475 -1.8475 3.4781 3.4781 3.5682 3.5682 3.7468 3.7468 3.9094 3.9094 4.1114 4.1114 4.2890 4.2890 4.6706 4.6706 5.1342 5.1342 5.1519 5.1519 5.4232 5.4232 5.8329 5.8329 7.8472 7.8472 8.1189 8.1189 8.8500 8.8500 8.9773 8.9773 9.2327 9.2327 10.1704 10.1704 10.3434 10.3434 11.1358 11.1358 11.1401 11.1401 11.1860 11.1860 k = 0.0000 0.0000 0.1052 ( 5504 PWs) bands (ev): -32.2061 -32.2061 -32.2024 -32.2024 -13.4955 -13.4955 -13.4751 -13.4751 -13.1384 -13.1384 -13.0983 -13.0983 -13.0972 -13.0972 -13.0910 -13.0910 -2.3936 -2.3936 -1.8610 -1.8610 3.4799 3.4799 3.5661 3.5661 3.7478 3.7478 3.8958 3.8958 4.1132 4.1132 4.2830 4.2830 4.6980 4.6980 5.1293 5.1293 5.1571 5.1571 5.4165 5.4165 5.8645 5.8645 7.7851 7.7851 8.1377 8.1377 8.8746 8.8746 8.9728 8.9728 9.2431 9.2431 10.1179 10.1179 10.2925 10.2925 11.1466 11.1466 11.2000 11.2000 11.2146 11.2146 k = 0.0000 0.0000 0.1202 ( 5498 PWs) bands (ev): -32.2060 -32.2060 -32.2025 -32.2025 -13.4949 -13.4949 -13.4755 -13.4755 -13.1374 -13.1374 -13.0983 -13.0983 -13.0981 -13.0981 -13.0912 -13.0912 -2.3813 -2.3813 -1.8762 -1.8762 3.4819 3.4819 3.5638 3.5638 3.7489 3.7489 3.8823 3.8823 4.1152 4.1152 4.2763 4.2763 4.7265 4.7265 5.1237 5.1237 5.1631 5.1631 5.4090 5.4090 5.9015 5.9015 7.7176 7.7176 8.1593 8.1593 8.9027 8.9027 8.9641 8.9641 9.2552 9.2552 10.0659 10.0659 10.2372 10.2372 11.1589 11.1589 11.2161 11.2161 11.2897 11.2897 k = 0.0000 0.0000 0.1352 ( 5528 PWs) bands (ev): -32.2059 -32.2059 -32.2026 -32.2026 -13.4943 -13.4943 -13.4760 -13.4760 -13.1364 -13.1364 -13.0997 -13.0997 -13.0979 -13.0979 -13.0914 -13.0914 -2.3676 -2.3676 -1.8932 -1.8932 3.4843 3.4843 3.5611 3.5611 3.7502 3.7502 3.8692 3.8692 4.1176 4.1176 4.2690 4.2690 4.7552 4.7552 5.1174 5.1174 5.1698 5.1698 5.4006 5.4006 5.9439 5.9439 7.6454 7.6454 8.1834 8.1834 8.9343 8.9343 8.9510 8.9510 9.2690 9.2690 10.0148 10.0148 10.1785 10.1785 11.1728 11.1728 11.2343 11.2343 11.3626 11.3626 k = 0.0000 0.0000 0.1503 ( 5528 PWs) bands (ev): -32.2058 -32.2058 -32.2027 -32.2027 -13.4936 -13.4936 -13.4766 -13.4766 -13.1352 -13.1352 -13.1011 -13.1011 -13.0977 -13.0977 -13.0917 -13.0917 -2.3525 -2.3525 -1.9115 -1.9115 3.4868 3.4868 3.5583 3.5583 3.7516 3.7516 3.8566 3.8566 4.1203 4.1203 4.2611 4.2611 4.7836 4.7836 5.1104 5.1104 5.1771 5.1771 5.3916 5.3916 5.9917 5.9917 7.5694 7.5694 8.2100 8.2100 8.9333 8.9333 8.9691 8.9691 9.2846 9.2846 9.9649 9.9649 10.1171 10.1171 11.1882 11.1882 11.2547 11.2547 11.4287 11.4287 k = 0.0000 0.0000 0.1653 ( 5504 PWs) bands (ev): -32.2057 -32.2057 -32.2028 -32.2028 -13.4927 -13.4927 -13.4772 -13.4772 -13.1339 -13.1339 -13.1026 -13.1026 -13.0974 -13.0974 -13.0919 -13.0919 -2.3360 -2.3360 -1.9311 -1.9311 3.4896 3.4896 3.5552 3.5552 3.7532 3.7532 3.8449 3.8449 4.1234 4.1234 4.2528 4.2528 4.8114 4.8114 5.1028 5.1028 5.1851 5.1851 5.3819 5.3819 6.0448 6.0448 7.4903 7.4903 8.2390 8.2390 8.9111 8.9111 9.0072 9.0072 9.3020 9.3020 9.9162 9.9162 10.0538 10.0538 11.2051 11.2051 11.2771 11.2771 11.4813 11.4813 k = 0.0000 0.0000 0.1803 ( 5498 PWs) bands (ev): -32.2055 -32.2055 -32.2030 -32.2030 -13.4919 -13.4919 -13.4778 -13.4778 -13.1325 -13.1325 -13.1041 -13.1041 -13.0971 -13.0971 -13.0921 -13.0921 -2.3182 -2.3182 -1.9520 -1.9520 3.4925 3.4925 3.5519 3.5519 3.7549 3.7549 3.8340 3.8340 4.1270 4.1270 4.2441 4.2441 4.8380 4.8380 5.0945 5.0945 5.1937 5.1937 5.3716 5.3716 6.1030 6.1030 7.4084 7.4084 8.2703 8.2703 8.8847 8.8847 9.0484 9.0484 9.3212 9.3212 9.8689 9.8689 9.9890 9.9890 11.2235 11.2235 11.3016 11.3016 11.5140 11.5140 k = 0.0000 0.0000 0.1953 ( 5498 PWs) bands (ev): -32.2054 -32.2054 -32.2031 -32.2031 -13.4910 -13.4910 -13.4785 -13.4785 -13.1310 -13.1310 -13.1058 -13.1058 -13.0968 -13.0968 -13.0924 -13.0924 -2.2992 -2.2992 -1.9739 -1.9739 3.4957 3.4957 3.5485 3.5485 3.7569 3.7569 3.8240 3.8240 4.1310 4.1310 4.2352 4.2352 4.8633 4.8633 5.0854 5.0854 5.2029 5.2029 5.3609 5.3609 6.1661 6.1661 7.3244 7.3244 8.3036 8.3036 8.8545 8.8545 9.0925 9.0925 9.3422 9.3422 9.8230 9.8230 9.9233 9.9233 11.2431 11.2431 11.3280 11.3280 11.5270 11.5270 k = 0.0000 0.0000 0.2104 ( 5504 PWs) bands (ev): -32.2052 -32.2052 -32.2033 -32.2033 -13.4901 -13.4901 -13.4793 -13.4793 -13.1295 -13.1295 -13.1076 -13.1076 -13.0966 -13.0966 -13.0927 -13.0927 -2.2792 -2.2792 -1.9967 -1.9967 3.4990 3.4990 3.5449 3.5449 3.7590 3.7590 3.8150 3.8150 4.1355 4.1355 4.2260 4.2260 4.8872 4.8872 5.0757 5.0757 5.2126 5.2126 5.3498 5.3498 6.2337 6.2337 7.2387 7.2387 8.3389 8.3389 8.8209 8.8209 9.1394 9.1394 9.3651 9.3651 9.7785 9.7785 9.8572 9.8572 11.2641 11.2641 11.3564 11.3564 11.5256 11.5256 k = 0.0000 0.0000 0.2254 ( 5504 PWs) bands (ev): -32.2051 -32.2051 -32.2034 -32.2034 -13.4892 -13.4892 -13.4801 -13.4801 -13.1278 -13.1278 -13.1094 -13.1094 -13.0963 -13.0963 -13.0930 -13.0930 -2.2581 -2.2581 -2.0201 -2.0201 3.5025 3.5025 3.5411 3.5411 3.7614 3.7614 3.8068 3.8068 4.1405 4.1405 4.2169 4.2169 4.9096 4.9096 5.0653 5.0653 5.2228 5.2228 5.3383 5.3383 6.3056 6.3056 7.1516 7.1516 8.3759 8.3759 8.7845 8.7845 9.1889 9.1889 9.3899 9.3899 9.7353 9.7353 9.7911 9.7911 11.2862 11.2862 11.3868 11.3868 11.5153 11.5153 k = 0.0000 0.0000 0.2404 ( 5516 PWs) bands (ev): -32.2049 -32.2049 -32.2036 -32.2036 -13.4883 -13.4883 -13.4809 -13.4809 -13.1261 -13.1261 -13.1113 -13.1113 -13.0960 -13.0960 -13.0933 -13.0933 -2.2362 -2.2362 -2.0441 -2.0441 3.5061 3.5061 3.5373 3.5373 3.7640 3.7640 3.7995 3.7995 4.1460 4.1460 4.2078 4.2078 4.9305 4.9305 5.0541 5.0541 5.2334 5.2334 5.3266 5.3266 6.3812 6.3812 7.0637 7.0637 8.4145 8.4145 8.7459 8.7459 9.2409 9.2409 9.4165 9.4165 9.6935 9.6935 9.7252 9.7252 11.3094 11.3094 11.4190 11.4190 11.4991 11.4991 k = 0.0000 0.0000 0.2554 ( 5516 PWs) bands (ev): -32.2048 -32.2048 -32.2037 -32.2037 -13.4873 -13.4873 -13.4818 -13.4818 -13.1244 -13.1244 -13.1132 -13.1132 -13.0957 -13.0957 -13.0936 -13.0936 -2.2135 -2.2135 -2.0685 -2.0685 3.5099 3.5099 3.5334 3.5334 3.7668 3.7668 3.7931 3.7931 4.1521 4.1521 4.1988 4.1988 4.9501 4.9501 5.0421 5.0421 5.2444 5.2444 5.3148 5.3148 6.4601 6.4601 6.9753 6.9753 8.4544 8.4544 8.7056 8.7056 9.2953 9.2953 9.4450 9.4450 9.6532 9.6532 9.6600 9.6600 11.3334 11.3334 11.4530 11.4530 11.4792 11.4792 k = 0.0000 0.0000 0.2705 ( 5528 PWs) bands (ev): -32.2046 -32.2046 -32.2039 -32.2039 -13.4864 -13.4864 -13.4827 -13.4827 -13.1226 -13.1226 -13.1151 -13.1151 -13.0953 -13.0953 -13.0940 -13.0940 -2.1902 -2.1902 -2.0931 -2.0931 3.5137 3.5137 3.5295 3.5295 3.7700 3.7700 3.7873 3.7873 4.1588 4.1588 4.1900 4.1900 4.9682 4.9682 5.0293 5.0293 5.2557 5.2557 5.3029 5.3029 6.5418 6.5418 6.8868 6.8868 8.4954 8.4954 8.6641 8.6641 9.3518 9.3518 9.4753 9.4753 9.5956 9.5956 9.6144 9.6144 11.3580 11.3580 11.4569 11.4569 11.4886 11.4886 k = 0.0000 0.0000 0.2855 ( 5540 PWs) bands (ev): -32.2044 -32.2044 -32.2041 -32.2041 -13.4855 -13.4855 -13.4836 -13.4836 -13.1208 -13.1208 -13.1170 -13.1170 -13.0950 -13.0950 -13.0943 -13.0943 -2.1664 -2.1664 -2.1177 -2.1177 3.5176 3.5176 3.5255 3.5255 3.7736 3.7736 3.7822 3.7822 4.1659 4.1659 4.1816 4.1816 4.9851 4.9851 5.0156 5.0156 5.2673 5.2673 5.2909 5.2909 6.6258 6.6258 6.7988 6.7988 8.5372 8.5372 8.6220 8.6220 9.4103 9.4103 9.5075 9.5075 9.5324 9.5324 9.5771 9.5771 11.3830 11.3830 11.4329 11.4329 11.5258 11.5258 k = 0.0000 0.0000 0.3005 ( 5552 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4845 -13.4845 -13.4845 -13.4845 -13.1189 -13.1189 -13.1189 -13.1189 -13.0947 -13.0947 -13.0947 -13.0947 -2.1422 -2.1422 -2.1422 -2.1422 3.5215 3.5215 3.5215 3.5215 3.7776 3.7776 3.7776 3.7776 4.1735 4.1735 4.1735 4.1735 5.0009 5.0009 5.0009 5.0009 5.2790 5.2790 5.2790 5.2790 6.7116 6.7116 6.7116 6.7116 8.5795 8.5795 8.5795 8.5795 9.4705 9.4705 9.4705 9.4705 9.5414 9.5414 9.5414 9.5414 11.4081 11.4081 11.4081 11.4081 11.5646 11.5646 k = 0.0000 0.0000 0.3005 ( 5552 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4845 -13.4845 -13.4845 -13.4845 -13.1189 -13.1189 -13.1189 -13.1189 -13.0947 -13.0947 -13.0947 -13.0947 -2.1422 -2.1422 -2.1422 -2.1422 3.5215 3.5215 3.5215 3.5215 3.7776 3.7776 3.7776 3.7776 4.1735 4.1735 4.1735 4.1735 5.0009 5.0009 5.0009 5.0009 5.2790 5.2790 5.2790 5.2790 6.7116 6.7116 6.7116 6.7116 8.5795 8.5795 8.5795 8.5795 9.4705 9.4705 9.4705 9.4705 9.5414 9.5414 9.5414 9.5414 11.4081 11.4081 11.4081 11.4081 11.5646 11.5646 k = 0.0128 0.0074 0.3005 ( 5552 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4847 -13.4847 -13.4845 -13.4845 -13.1190 -13.1190 -13.1188 -13.1188 -13.0947 -13.0947 -13.0947 -13.0947 -2.1416 -2.1416 -2.1413 -2.1413 3.5215 3.5215 3.5215 3.5215 3.7757 3.7757 3.7793 3.7793 4.1736 4.1736 4.1737 4.1737 4.9960 4.9960 5.0058 5.0058 5.2793 5.2793 5.2793 5.2793 6.7093 6.7093 6.7128 6.7128 8.5607 8.5607 8.5851 8.5851 9.4138 9.4138 9.4226 9.4226 9.5865 9.5865 9.6073 9.6073 11.4045 11.4045 11.4108 11.4108 11.5630 11.5631 k = 0.0256 0.0148 0.3005 ( 5532 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4847 -13.4847 -13.4843 -13.4843 -13.1191 -13.1191 -13.1187 -13.1187 -13.0947 -13.0947 -13.0947 -13.0947 -2.1396 -2.1396 -2.1389 -2.1389 3.5214 3.5214 3.5215 3.5215 3.7735 3.7735 3.7808 3.7808 4.1738 4.1738 4.1741 4.1741 4.9913 4.9913 5.0107 5.0107 5.2800 5.2800 5.2801 5.2801 6.7060 6.7060 6.7129 6.7129 8.5293 8.5293 8.5772 8.5772 9.3340 9.3340 9.3561 9.3561 9.6611 9.6611 9.6970 9.6970 11.3993 11.3993 11.4125 11.4125 11.5591 11.5596 k = 0.0385 0.0222 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4849 -13.4849 -13.4843 -13.4843 -13.1192 -13.1192 -13.1186 -13.1186 -13.0949 -13.0949 -13.0948 -13.0948 -2.1362 -2.1362 -2.1351 -2.1351 3.5213 3.5213 3.5216 3.5216 3.7710 3.7710 3.7821 3.7821 4.1743 4.1743 4.1748 4.1748 4.9867 4.9867 5.0155 5.0155 5.2811 5.2811 5.2816 5.2816 6.7015 6.7015 6.7117 6.7117 8.4866 8.4866 8.5559 8.5559 9.2566 9.2566 9.2909 9.2909 9.7394 9.7394 9.7896 9.7896 11.3913 11.3913 11.4121 11.4121 11.5555 11.5563 k = 0.0513 0.0296 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4850 -13.4850 -13.4842 -13.4842 -13.1194 -13.1194 -13.1185 -13.1185 -13.0950 -13.0950 -13.0950 -13.0950 -2.1314 -2.1314 -2.1299 -2.1299 3.5210 3.5210 3.5216 3.5216 3.7683 3.7683 3.7833 3.7833 4.1751 4.1751 4.1756 4.1756 4.9825 4.9825 5.0201 5.0201 5.2826 5.2826 5.2837 5.2837 6.6959 6.6959 6.7089 6.7089 8.4343 8.4343 8.5224 8.5224 9.1840 9.1840 9.2281 9.2281 9.8183 9.8183 9.8823 9.8823 11.3794 11.3794 11.4080 11.4080 11.5530 11.5561 k = 0.0641 0.0370 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4852 -13.4852 -13.4842 -13.4842 -13.1195 -13.1195 -13.1184 -13.1184 -13.0952 -13.0952 -13.0952 -13.0952 -2.1252 -2.1252 -2.1233 -2.1233 3.5205 3.5205 3.5218 3.5218 3.7654 3.7654 3.7845 3.7845 4.1760 4.1760 4.1766 4.1766 4.9786 4.9786 5.0245 5.0245 5.2845 5.2845 5.2866 5.2866 6.6890 6.6890 6.7044 6.7044 8.3742 8.3742 8.4781 8.4781 9.1162 9.1162 9.1675 9.1675 9.8962 9.8962 9.9732 9.9732 11.3634 11.3634 11.3995 11.3995 11.5569 11.5596 k = 0.0769 0.0444 0.3005 ( 5530 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4854 -13.4854 -13.4842 -13.4842 -13.1196 -13.1196 -13.1184 -13.1184 -13.0955 -13.0955 -13.0954 -13.0954 -2.1176 -2.1176 -2.1154 -2.1154 3.5197 3.5197 3.5219 3.5219 3.7624 3.7624 3.7856 3.7856 4.1772 4.1772 4.1778 4.1778 4.9752 4.9752 5.0284 5.0284 5.2866 5.2866 5.2901 5.2901 6.6805 6.6805 6.6977 6.6977 8.3082 8.3082 8.4252 8.4252 9.0525 9.0525 9.1086 9.1086 9.9715 9.9715 10.0607 10.0607 11.3443 11.3443 11.3871 11.3871 11.5593 11.5600 k = 0.0897 0.0518 0.3005 ( 5526 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4856 -13.4856 -13.4842 -13.4842 -13.1198 -13.1198 -13.1183 -13.1183 -13.0957 -13.0957 -13.0957 -13.0957 -2.1087 -2.1087 -2.1062 -2.1062 3.5186 3.5186 3.5221 3.5221 3.7592 3.7592 3.7869 3.7869 4.1785 4.1785 4.1792 4.1792 4.9722 4.9722 5.0321 5.0321 5.2889 5.2889 5.2944 5.2944 6.6702 6.6702 6.6886 6.6886 8.2384 8.2384 8.3661 8.3661 8.9920 8.9920 9.0507 9.0507 10.0427 10.0427 10.1430 10.1430 11.3238 11.3238 11.3732 11.3732 11.5722 11.5737 k = 0.1026 0.0592 0.3005 ( 5514 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4858 -13.4858 -13.4843 -13.4843 -13.1199 -13.1199 -13.1182 -13.1182 -13.0960 -13.0960 -13.0960 -13.0960 -2.0985 -2.0985 -2.0956 -2.0956 3.5172 3.5172 3.5222 3.5222 3.7560 3.7560 3.7883 3.7883 4.1800 4.1800 4.1806 4.1806 4.9697 4.9697 5.0353 5.0353 5.2915 5.2915 5.2994 5.2994 6.6577 6.6577 6.6766 6.6766 8.1665 8.1665 8.3033 8.3033 8.9338 8.9338 8.9934 8.9934 10.1083 10.1083 10.2184 10.2184 11.3040 11.3040 11.3606 11.3606 11.5895 11.5921 k = 0.1154 0.0666 0.3005 ( 5518 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4860 -13.4860 -13.4843 -13.4843 -13.1201 -13.1201 -13.1182 -13.1182 -13.0964 -13.0964 -13.0963 -13.0963 -2.0870 -2.0870 -2.0839 -2.0839 3.5154 3.5154 3.5223 3.5223 3.7528 3.7528 3.7900 3.7900 4.1816 4.1816 4.1822 4.1822 4.9678 4.9678 5.0380 5.0380 5.2943 5.2943 5.3051 5.3051 6.6426 6.6426 6.6611 6.6611 8.0941 8.0941 8.2391 8.2391 8.8767 8.8767 8.9363 8.9363 10.1667 10.1667 10.2848 10.2848 11.2866 11.2866 11.3519 11.3519 11.6124 11.6191 k = 0.1282 0.0740 0.3005 ( 5522 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4862 -13.4862 -13.4844 -13.4844 -13.1202 -13.1202 -13.1181 -13.1181 -13.0968 -13.0968 -13.0967 -13.0967 -2.0744 -2.0744 -2.0710 -2.0710 3.5132 3.5132 3.5224 3.5224 3.7497 3.7497 3.7920 3.7920 4.1833 4.1833 4.1838 4.1838 4.9664 4.9664 5.0404 5.0404 5.2971 5.2971 5.3115 5.3115 6.6246 6.6246 6.6419 6.6419 8.0228 8.0228 8.1754 8.1754 8.8204 8.8204 8.8791 8.8791 10.2167 10.2167 10.3404 10.3404 11.2730 11.2730 11.3493 11.3493 11.6343 11.6407 k = 0.1410 0.0814 0.3005 ( 5504 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4864 -13.4864 -13.4845 -13.4845 -13.1203 -13.1203 -13.1181 -13.1181 -13.0972 -13.0972 -13.0971 -13.0971 -2.0607 -2.0607 -2.0569 -2.0569 3.5105 3.5105 3.5223 3.5223 3.7469 3.7469 3.7943 3.7943 4.1851 4.1851 4.1854 4.1854 4.9656 4.9656 5.0423 5.0423 5.3002 5.3002 5.3184 5.3184 6.6031 6.6031 6.6184 6.6184 7.9539 7.9539 8.1139 8.1139 8.7642 8.7642 8.8219 8.8219 10.2570 10.2570 10.3837 10.3837 11.2642 11.2642 11.3540 11.3540 11.6584 11.6609 k = 0.1538 0.0888 0.3005 ( 5508 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4867 -13.4867 -13.4846 -13.4846 -13.1205 -13.1205 -13.1181 -13.1181 -13.0977 -13.0977 -13.0975 -13.0975 -2.0459 -2.0459 -2.0419 -2.0419 3.5074 3.5074 3.5222 3.5222 3.7443 3.7443 3.7971 3.7971 4.1868 4.1868 4.1870 4.1870 4.9654 4.9654 5.0438 5.0438 5.3033 5.3033 5.3259 5.3259 6.5777 6.5777 6.5903 6.5903 7.8885 7.8885 8.0560 8.0560 8.7080 8.7080 8.7646 8.7646 10.2872 10.2872 10.4141 10.4141 11.2603 11.2603 11.3658 11.3658 11.6851 11.6878 k = 0.1667 0.0962 0.3005 ( 5508 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4869 -13.4869 -13.4847 -13.4847 -13.1207 -13.1207 -13.1181 -13.1181 -13.0981 -13.0981 -13.0979 -13.0979 -2.0301 -2.0301 -2.0259 -2.0259 3.5039 3.5039 3.5218 3.5218 3.7421 3.7421 3.8002 3.8002 4.1885 4.1885 4.1886 4.1886 4.9658 4.9658 5.0450 5.0450 5.3066 5.3066 5.3339 5.3339 6.5481 6.5481 6.5574 6.5574 7.8276 7.8276 8.0025 8.0025 8.6518 8.6518 8.7073 8.7073 10.3073 10.3073 10.4320 10.4320 11.2610 11.2610 11.3832 11.3832 11.7141 11.7205 k = 0.1795 0.1036 0.3005 ( 5500 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4871 -13.4871 -13.4849 -13.4849 -13.1208 -13.1208 -13.1181 -13.1181 -13.0986 -13.0986 -13.0983 -13.0983 -2.0135 -2.0135 -2.0090 -2.0090 3.5001 3.5001 3.5213 3.5213 3.7403 3.7403 3.8037 3.8037 4.1900 4.1900 4.1901 4.1901 4.9667 4.9667 5.0458 5.0458 5.3100 5.3100 5.3422 5.3422 6.5141 6.5141 6.5197 6.5197 7.7718 7.7718 7.9542 7.9542 8.5956 8.5956 8.6503 8.6503 10.3180 10.3180 10.4388 10.4388 11.2651 11.2651 11.4035 11.4035 11.7416 11.7427 k = 0.1923 0.1110 0.3005 ( 5504 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4874 -13.4874 -13.4850 -13.4850 -13.1210 -13.1210 -13.1181 -13.1181 -13.0991 -13.0991 -13.0988 -13.0988 -1.9960 -1.9960 -1.9913 -1.9913 3.4959 3.4959 3.5207 3.5207 3.7390 3.7390 3.8077 3.8077 4.1913 4.1913 4.1915 4.1915 4.9681 4.9681 5.0463 5.0463 5.3134 5.3134 5.3508 5.3508 6.4755 6.4755 6.4772 6.4772 7.7217 7.7217 7.9112 7.9112 8.5398 8.5398 8.5938 8.5938 10.3204 10.3204 10.4363 10.4363 11.2708 11.2708 11.4231 11.4231 11.7708 11.7711 k = 0.2051 0.1184 0.3005 ( 5506 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4876 -13.4876 -13.4852 -13.4852 -13.1212 -13.1212 -13.1182 -13.1182 -13.0996 -13.0996 -13.0993 -13.0993 -1.9778 -1.9778 -1.9729 -1.9729 3.4915 3.4915 3.5198 3.5198 3.7383 3.7383 3.8121 3.8121 4.1923 4.1923 4.1927 4.1927 4.9701 4.9701 5.0465 5.0465 5.3170 5.3170 5.3597 5.3597 6.4303 6.4303 6.4326 6.4326 7.6774 7.6774 7.8737 7.8737 8.4844 8.4844 8.5380 8.5380 10.3163 10.3163 10.4267 10.4267 11.2764 11.2764 11.4384 11.4384 11.8008 11.8008 k = 0.2179 0.1258 0.3005 ( 5512 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4879 -13.4879 -13.4854 -13.4854 -13.1213 -13.1213 -13.1182 -13.1182 -13.1002 -13.1002 -13.0997 -13.0997 -1.9591 -1.9591 -1.9540 -1.9540 3.4870 3.4870 3.5187 3.5187 3.7382 3.7382 3.8167 3.8167 4.1930 4.1930 4.1936 4.1936 4.9725 4.9725 5.0465 5.0465 5.3206 5.3206 5.3686 5.3686 6.3795 6.3795 6.3856 6.3856 7.6388 7.6388 7.8411 7.8411 8.4299 8.4299 8.4833 8.4833 10.3071 10.3071 10.4121 10.4121 11.2801 11.2801 11.4468 11.4468 11.8318 11.8318 k = 0.2308 0.1332 0.3005 ( 5516 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4881 -13.4881 -13.4856 -13.4856 -13.1215 -13.1215 -13.1183 -13.1183 -13.1007 -13.1007 -13.1002 -13.1002 -1.9398 -1.9398 -1.9346 -1.9346 3.4824 3.4824 3.5175 3.5175 3.7387 3.7387 3.8218 3.8218 4.1933 4.1933 4.1941 4.1941 4.9754 4.9754 5.0462 5.0462 5.3244 5.3244 5.3776 5.3776 6.3254 6.3254 6.3351 6.3351 7.6056 7.6056 7.8131 7.8131 8.3767 8.3767 8.4300 8.4300 10.2945 10.2945 10.3943 10.3943 11.2805 11.2805 11.4467 11.4467 11.8638 11.8638 k = 0.2436 0.1406 0.3005 ( 5512 PWs) bands (ev): -32.2038 -32.2038 -32.2038 -32.2038 -13.4883 -13.4883 -13.4858 -13.4858 -13.1217 -13.1217 -13.1184 -13.1184 -13.1012 -13.1012 -13.1007 -13.1007 -1.9201 -1.9201 -1.9149 -1.9149 3.4778 3.4778 3.5162 3.5162 3.7398 3.7398 3.8270 3.8270 4.1931 4.1931 4.1942 4.1942 4.9787 4.9787 5.0458 5.0458 5.3283 5.3283 5.3866 5.3866 6.2689 6.2689 6.2818 6.2818 7.5773 7.5773 7.7889 7.7889 8.3251 8.3251 8.3783 8.3783 10.2799 10.2799 10.3747 10.3747 11.2767 11.2767 11.4382 11.4382 11.8967 11.8968 k = 0.2564 0.1480 0.3005 ( 5508 PWs) bands (ev): -32.2038 -32.2038 -32.2038 -32.2038 -13.4886 -13.4886 -13.4860 -13.4860 -13.1218 -13.1218 -13.1185 -13.1185 -13.1017 -13.1017 -13.1011 -13.1011 -1.9002 -1.9002 -1.8948 -1.8948 3.4734 3.4734 3.5147 3.5147 3.7416 3.7416 3.8325 3.8325 4.1922 4.1922 4.1937 4.1937 4.9823 4.9823 5.0452 5.0452 5.3323 5.3323 5.3955 5.3955 6.2108 6.2108 6.2264 6.2264 7.5533 7.5533 7.7677 7.7677 8.2758 8.2758 8.3287 8.3287 10.2644 10.2644 10.3544 10.3544 11.2681 11.2681 11.4220 11.4220 11.9305 11.9305 k = 0.2692 0.1554 0.3005 ( 5512 PWs) bands (ev): -32.2038 -32.2038 -32.2037 -32.2037 -13.4888 -13.4888 -13.4863 -13.4863 -13.1220 -13.1220 -13.1186 -13.1186 -13.1022 -13.1022 -13.1016 -13.1016 -1.8801 -1.8801 -1.8747 -1.8747 3.4692 3.4692 3.5132 3.5132 3.7440 3.7440 3.8382 3.8382 4.1907 4.1907 4.1926 4.1926 4.9862 4.9862 5.0445 5.0445 5.3365 5.3365 5.4041 5.4041 6.1518 6.1518 6.1698 6.1698 7.5329 7.5329 7.7485 7.7485 8.2291 8.2291 8.2816 8.2816 10.2491 10.2491 10.3345 10.3345 11.2548 11.2548 11.3993 11.3993 11.9647 11.9648 k = 0.2821 0.1628 0.3005 ( 5512 PWs) bands (ev): -32.2037 -32.2037 -32.2037 -32.2037 -13.4890 -13.4890 -13.4865 -13.4865 -13.1221 -13.1221 -13.1188 -13.1188 -13.1027 -13.1027 -13.1020 -13.1020 -1.8600 -1.8600 -1.8546 -1.8546 3.4653 3.4653 3.5117 3.5117 3.7470 3.7470 3.8441 3.8441 4.1883 4.1883 4.1908 4.1908 4.9903 4.9903 5.0436 5.0436 5.3408 5.3408 5.4125 5.4125 6.0927 6.0927 6.1127 6.1127 7.5152 7.5152 7.7303 7.7303 8.1857 8.1857 8.2371 8.2371 10.2347 10.2347 10.3157 10.3157 11.2367 11.2367 11.3712 11.3712 11.9992 11.9994 k = 0.2949 0.1702 0.3005 ( 5508 PWs) bands (ev): -32.2037 -32.2037 -32.2037 -32.2037 -13.4892 -13.4892 -13.4868 -13.4868 -13.1223 -13.1223 -13.1189 -13.1189 -13.1032 -13.1032 -13.1024 -13.1024 -1.8400 -1.8400 -1.8347 -1.8347 3.4618 3.4618 3.5102 3.5102 3.7507 3.7507 3.8500 3.8500 4.1850 4.1850 4.1882 4.1882 4.9946 4.9946 5.0427 5.0427 5.3454 5.3454 5.4204 5.4204 6.0344 6.0344 6.0560 6.0560 7.4998 7.4998 7.7123 7.7123 8.1462 8.1462 8.1958 8.1958 10.2220 10.2220 10.2985 10.2985 11.2143 11.2143 11.3388 11.3388 12.0339 12.0342 k = 0.3077 0.1776 0.3005 ( 5506 PWs) bands (ev): -32.2037 -32.2037 -32.2036 -32.2036 -13.4894 -13.4894 -13.4870 -13.4870 -13.1224 -13.1224 -13.1191 -13.1191 -13.1036 -13.1036 -13.1028 -13.1028 -1.8203 -1.8203 -1.8151 -1.8151 3.4587 3.4587 3.5087 3.5087 3.7551 3.7551 3.8561 3.8561 4.1807 4.1807 4.1848 4.1848 4.9990 4.9990 5.0417 5.0417 5.3501 5.3501 5.4280 5.4280 5.9775 5.9775 6.0003 6.0003 7.4858 7.4858 7.6936 7.6936 8.1110 8.1110 8.1578 8.1578 10.2114 10.2114 10.2835 10.2835 11.1880 11.1880 11.3028 11.3028 12.0686 12.0689 k = 0.3205 0.1850 0.3005 ( 5512 PWs) bands (ev): -32.2036 -32.2036 -32.2036 -32.2036 -13.4896 -13.4896 -13.4873 -13.4873 -13.1225 -13.1225 -13.1193 -13.1193 -13.1040 -13.1040 -13.1033 -13.1033 -1.8010 -1.8010 -1.7958 -1.7958 3.4562 3.4562 3.5072 3.5072 3.7601 3.7601 3.8622 3.8622 4.1752 4.1752 4.1804 4.1804 5.0034 5.0034 5.0406 5.0406 5.3550 5.3550 5.4350 5.4350 5.9227 5.9227 5.9463 5.9463 7.4728 7.4728 7.6735 7.6735 8.0805 8.0805 8.1235 8.1235 10.2034 10.2034 10.2710 10.2710 11.1582 11.1582 11.2639 11.2639 12.1032 12.1035 k = 0.3333 0.1925 0.3005 ( 5498 PWs) bands (ev): -32.2036 -32.2036 -32.2036 -32.2036 -13.4897 -13.4897 -13.4875 -13.4875 -13.1226 -13.1226 -13.1195 -13.1195 -13.1044 -13.1044 -13.1036 -13.1036 -1.7822 -1.7822 -1.7772 -1.7772 3.4543 3.4543 3.5059 3.5059 3.7658 3.7658 3.8683 3.8683 4.1685 4.1685 4.1751 4.1751 5.0077 5.0077 5.0396 5.0396 5.3602 5.3602 5.4414 5.4414 5.8704 5.8704 5.8946 5.8946 7.4604 7.4604 7.6517 7.6517 8.0549 8.0549 8.0929 8.0929 10.1983 10.1983 10.2612 10.2612 11.1255 11.1255 11.2226 11.2226 12.1372 12.1378 k = 0.3462 0.1999 0.3005 ( 5498 PWs) bands (ev): -32.2036 -32.2036 -32.2035 -32.2035 -13.4898 -13.4898 -13.4877 -13.4877 -13.1227 -13.1227 -13.1197 -13.1197 -13.1047 -13.1047 -13.1039 -13.1039 -1.7640 -1.7640 -1.7592 -1.7592 3.4530 3.4530 3.5045 3.5045 3.7722 3.7722 3.8744 3.8744 4.1607 4.1607 4.1688 4.1688 5.0119 5.0119 5.0385 5.0385 5.3656 5.3656 5.4472 5.4472 5.8213 5.8213 5.8455 5.8455 7.4483 7.4483 7.6281 7.6281 8.0340 8.0340 8.0662 8.0662 10.1963 10.1963 10.2545 10.2545 11.0902 11.0902 11.1795 11.1795 12.1709 12.1731 k = 0.3590 0.2073 0.3005 ( 5502 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4900 -13.4900 -13.4880 -13.4880 -13.1228 -13.1228 -13.1200 -13.1200 -13.1050 -13.1050 -13.1043 -13.1043 -1.7467 -1.7467 -1.7421 -1.7421 3.4524 3.4524 3.5032 3.5032 3.7793 3.7793 3.8805 3.8805 4.1516 4.1516 4.1615 4.1615 5.0159 5.0159 5.0375 5.0375 5.3713 5.3713 5.4522 5.4522 5.7756 5.7756 5.7995 5.7995 7.4364 7.4364 7.6030 7.6030 8.0174 8.0174 8.0433 8.0433 10.1976 10.1976 10.2508 10.2508 11.0530 11.0530 11.1348 11.1348 12.2037 12.2050 k = 0.3718 0.2147 0.3005 ( 5500 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4901 -13.4901 -13.4882 -13.4882 -13.1229 -13.1229 -13.1202 -13.1202 -13.1053 -13.1053 -13.1046 -13.1046 -1.7303 -1.7303 -1.7260 -1.7260 3.4524 3.4524 3.5019 3.5019 3.7871 3.7871 3.8865 3.8865 4.1415 4.1415 4.1533 4.1533 5.0196 5.0196 5.0366 5.0366 5.3772 5.3772 5.4563 5.4563 5.7338 5.7338 5.7570 5.7570 7.4247 7.4247 7.5770 7.5770 8.0044 8.0044 8.0241 8.0241 10.2021 10.2021 10.2503 10.2503 11.0144 11.0144 11.0890 11.0890 12.2363 12.2384 k = 0.3846 0.2221 0.3005 ( 5494 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4901 -13.4901 -13.4885 -13.4885 -13.1229 -13.1229 -13.1204 -13.1204 -13.1055 -13.1055 -13.1049 -13.1049 -1.7150 -1.7150 -1.7110 -1.7110 3.4530 3.4530 3.5005 3.5005 3.7957 3.7957 3.8923 3.8923 4.1304 4.1304 4.1442 4.1442 5.0230 5.0230 5.0358 5.0358 5.3833 5.3833 5.4596 5.4596 5.6961 5.6961 5.7181 5.7181 7.4135 7.4135 7.5506 7.5506 7.9945 7.9945 8.0084 8.0084 10.2099 10.2099 10.2529 10.2529 10.9749 10.9749 11.0427 11.0427 12.2665 12.2670 k = 0.3974 0.2295 0.3005 ( 5496 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4902 -13.4902 -13.4887 -13.4887 -13.1230 -13.1230 -13.1207 -13.1207 -13.1058 -13.1058 -13.1051 -13.1051 -1.7009 -1.7009 -1.6972 -1.6972 3.4543 3.4543 3.4990 3.4990 3.8050 3.8050 3.8979 3.8979 4.1186 4.1186 4.1345 4.1345 5.0260 5.0260 5.0351 5.0351 5.3896 5.3896 5.4619 5.4619 5.6626 5.6626 5.6830 5.6830 7.4029 7.4029 7.5245 7.5245 7.9870 7.9870 7.9958 7.9958 10.2208 10.2208 10.2584 10.2584 10.9352 10.9352 10.9963 10.9963 12.2959 12.2968 k = 0.4103 0.2369 0.3005 ( 5502 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4903 -13.4903 -13.4889 -13.4889 -13.1230 -13.1230 -13.1210 -13.1210 -13.1060 -13.1060 -13.1054 -13.1054 -1.6881 -1.6881 -1.6848 -1.6848 3.4561 3.4561 3.4973 3.4973 3.8151 3.8151 3.9030 3.9030 4.1064 4.1064 4.1242 4.1242 5.0285 5.0285 5.0346 5.0346 5.3960 5.3960 5.4632 5.4632 5.6335 5.6335 5.6519 5.6519 7.3932 7.3932 7.4992 7.4992 7.9813 7.9813 7.9860 7.9860 10.2343 10.2343 10.2665 10.2665 10.8960 10.8960 10.9504 10.9504 12.3227 12.3241 k = 0.4231 0.2443 0.3005 ( 5514 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4903 -13.4903 -13.4892 -13.4892 -13.1230 -13.1230 -13.1212 -13.1212 -13.1061 -13.1061 -13.1056 -13.1056 -1.6768 -1.6768 -1.6739 -1.6739 3.4584 3.4584 3.4954 3.4954 3.8259 3.8259 3.9074 3.9074 4.0944 4.0944 4.1136 4.1136 5.0306 5.0306 5.0343 5.0343 5.4025 5.4025 5.4633 5.4633 5.6088 5.6088 5.6248 5.6248 7.3849 7.3849 7.4754 7.4754 7.9770 7.9770 7.9786 7.9786 10.2501 10.2501 10.2769 10.2769 10.8581 10.8581 10.9058 10.9058 12.3477 12.3510 k = 0.4359 0.2517 0.3005 ( 5522 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4904 -13.4904 -13.4894 -13.4894 -13.1230 -13.1230 -13.1215 -13.1215 -13.1063 -13.1063 -13.1058 -13.1058 -1.6670 -1.6670 -1.6645 -1.6645 3.4612 3.4612 3.4933 3.4933 3.8372 3.8372 3.9106 3.9106 4.0831 4.0831 4.1030 4.1030 5.0323 5.0323 5.0341 5.0341 5.4091 5.4091 5.4623 5.4623 5.5885 5.5885 5.6018 5.6018 7.3783 7.3783 7.4534 7.4534 7.9732 7.9732 7.9737 7.9737 10.2674 10.2674 10.2889 10.2889 10.8226 10.8226 10.8633 10.8633 12.3697 12.3719 k = 0.4487 0.2591 0.3005 ( 5536 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4904 -13.4904 -13.4896 -13.4896 -13.1230 -13.1230 -13.1218 -13.1218 -13.1064 -13.1064 -13.1060 -13.1060 -1.6588 -1.6588 -1.6568 -1.6568 3.4643 3.4643 3.4908 3.4908 3.8491 3.8491 3.9123 3.9123 4.0733 4.0733 4.0926 4.0926 5.0334 5.0334 5.0340 5.0340 5.4157 5.4157 5.4601 5.4601 5.5724 5.5724 5.5830 5.5830 7.3737 7.3737 7.4336 7.4336 7.9695 7.9695 7.9711 7.9711 10.2853 10.2853 10.3017 10.3017 10.7907 10.7907 10.8242 10.8242 12.3881 12.3896 k = 0.4615 0.2665 0.3005 ( 5544 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4904 -13.4904 -13.4897 -13.4897 -13.1229 -13.1229 -13.1220 -13.1220 -13.1064 -13.1064 -13.1062 -13.1062 -1.6522 -1.6522 -1.6507 -1.6507 3.4677 3.4677 3.4881 3.4881 3.8611 3.8611 3.9118 3.9118 4.0658 4.0658 4.0829 4.0829 5.0341 5.0341 5.0342 5.0342 5.4223 5.4223 5.4567 5.4567 5.5604 5.5604 5.5682 5.5682 7.3715 7.3715 7.4162 7.4162 7.9671 7.9671 7.9690 7.9690 10.3024 10.3024 10.3140 10.3140 10.7639 10.7639 10.7898 10.7898 12.4029 12.4048 k = 0.4744 0.2739 0.3005 ( 5536 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4903 -13.4903 -13.4899 -13.4899 -13.1228 -13.1228 -13.1222 -13.1222 -13.1064 -13.1064 -13.1063 -13.1063 -1.6474 -1.6474 -1.6464 -1.6464 3.4713 3.4713 3.4851 3.4851 3.8731 3.8731 3.9087 3.9087 4.0613 4.0613 4.0742 4.0742 5.0343 5.0343 5.0346 5.0346 5.4287 5.4287 5.4523 5.4523 5.5524 5.5524 5.5575 5.5575 7.3718 7.3718 7.4016 7.4016 7.9658 7.9658 7.9675 7.9675 10.3170 10.3170 10.3243 10.3243 10.7440 10.7440 10.7617 10.7617 12.4138 12.4148 k = 0.4872 0.2813 0.3005 ( 5532 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4902 -13.4902 -13.4900 -13.4900 -13.1227 -13.1227 -13.1224 -13.1224 -13.1064 -13.1064 -13.1063 -13.1063 -1.6444 -1.6444 -1.6439 -1.6439 3.4749 3.4749 3.4819 3.4819 3.8844 3.8844 3.9028 3.9028 4.0602 4.0602 4.0672 4.0672 5.0346 5.0346 5.0348 5.0348 5.4351 5.4351 5.4471 5.4471 5.5481 5.5481 5.5507 5.5507 7.3749 7.3749 7.3898 7.3898 7.9654 7.9654 7.9663 7.9663 10.3274 10.3274 10.3309 10.3309 10.7329 10.7329 10.7419 10.7419 12.4208 12.4215 k = 0.5000 0.2887 0.3005 ( 5524 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4901 -13.4901 -13.4901 -13.4901 -13.1225 -13.1225 -13.1225 -13.1225 -13.1064 -13.1064 -13.1064 -13.1064 -1.6433 -1.6433 -1.6433 -1.6433 3.4784 3.4784 3.4784 3.4784 3.8946 3.8946 3.8946 3.8946 4.0623 4.0623 4.0623 4.0623 5.0347 5.0347 5.0347 5.0347 5.4413 5.4413 5.4413 5.4413 5.5476 5.5476 5.5476 5.5476 7.3809 7.3809 7.3809 7.3809 7.9656 7.9656 7.9656 7.9656 10.3322 10.3322 10.3322 10.3322 10.7320 10.7320 10.7320 10.7320 12.4237 12.4237 k = 0.5000 0.2887 0.3005 ( 5524 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4901 -13.4901 -13.4901 -13.4901 -13.1225 -13.1225 -13.1225 -13.1225 -13.1064 -13.1064 -13.1064 -13.1064 -1.6433 -1.6433 -1.6433 -1.6433 3.4784 3.4784 3.4784 3.4784 3.8946 3.8946 3.8946 3.8946 4.0623 4.0623 4.0623 4.0623 5.0347 5.0347 5.0347 5.0347 5.4413 5.4413 5.4413 5.4413 5.5476 5.5476 5.5476 5.5476 7.3809 7.3809 7.3809 7.3809 7.9656 7.9656 7.9656 7.9656 10.3322 10.3322 10.3322 10.3322 10.7320 10.7320 10.7320 10.7320 12.4237 12.4237 k = 0.4928 0.3012 0.3005 ( 5528 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4903 -13.4903 -13.4900 -13.4900 -13.1226 -13.1226 -13.1225 -13.1225 -13.1066 -13.1066 -13.1062 -13.1062 -1.6436 -1.6436 -1.6424 -1.6424 3.4768 3.4768 3.4816 3.4816 3.8836 3.8836 3.9059 3.9059 4.0580 4.0580 4.0663 4.0663 5.0207 5.0207 5.0485 5.0485 5.4304 5.4304 5.4511 5.4511 5.5463 5.5463 5.5494 5.5494 7.3476 7.3476 7.4061 7.4061 7.9276 7.9276 8.0018 8.0018 10.3181 10.3181 10.3550 10.3550 10.7288 10.7288 10.7418 10.7418 12.4157 12.4233 k = 0.4855 0.3138 0.3005 ( 5524 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4904 -13.4904 -13.4898 -13.4898 -13.1226 -13.1226 -13.1224 -13.1224 -13.1068 -13.1068 -13.1061 -13.1061 -1.6435 -1.6435 -1.6410 -1.6410 3.4768 3.4768 3.4862 3.4862 3.8732 3.8732 3.9175 3.9175 4.0535 4.0535 4.0700 4.0700 5.0063 5.0063 5.0619 5.0619 5.4189 5.4189 5.4592 5.4592 5.5459 5.5459 5.5515 5.5515 7.3076 7.3076 7.4213 7.4213 7.8904 7.8904 8.0345 8.0345 10.3132 10.3132 10.3848 10.3848 10.7325 10.7325 10.7585 10.7585 12.4022 12.4034 k = 0.4783 0.3263 0.3005 ( 5520 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4906 -13.4906 -13.4897 -13.4897 -13.1226 -13.1226 -13.1223 -13.1223 -13.1070 -13.1070 -13.1060 -13.1060 -1.6428 -1.6428 -1.6392 -1.6392 3.4781 3.4781 3.4923 3.4923 3.8631 3.8631 3.9295 3.9295 4.0490 4.0490 4.0733 4.0733 4.9915 4.9915 5.0751 5.0751 5.4070 5.4070 5.4648 5.4648 5.5467 5.5467 5.5541 5.5541 7.2620 7.2620 7.4241 7.4241 7.8575 7.8575 8.0631 8.0631 10.3167 10.3167 10.4185 10.4185 10.7444 10.7444 10.7835 10.7835 12.3881 12.3882 k = 0.4710 0.3389 0.3005 ( 5512 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4907 -13.4907 -13.4895 -13.4895 -13.1226 -13.1226 -13.1222 -13.1222 -13.1073 -13.1073 -13.1059 -13.1059 -1.6417 -1.6417 -1.6368 -1.6368 3.4810 3.4810 3.5000 3.5000 3.8536 3.8536 3.9415 3.9415 4.0445 4.0445 4.0762 4.0762 4.9762 4.9762 5.0882 5.0882 5.3950 5.3950 5.4673 5.4673 5.5483 5.5483 5.5583 5.5583 7.2117 7.2117 7.4121 7.4121 7.8322 7.8322 8.0873 8.0873 10.3269 10.3269 10.4518 10.4518 10.7662 10.7662 10.8188 10.8188 12.3728 12.3732 k = 0.4638 0.3514 0.3005 ( 5508 PWs) bands (ev): -32.2034 -32.2034 -32.2033 -32.2033 -13.4909 -13.4909 -13.4894 -13.4894 -13.1226 -13.1226 -13.1220 -13.1220 -13.1076 -13.1076 -13.1059 -13.1059 -1.6401 -1.6401 -1.6341 -1.6341 3.4852 3.4852 3.5091 3.5091 3.8446 3.8446 3.9536 3.9536 4.0403 4.0403 4.0786 4.0786 4.9603 4.9603 5.1010 5.1010 5.3829 5.3829 5.4664 5.4664 5.5493 5.5493 5.5652 5.5652 7.1575 7.1575 7.3845 7.3845 7.8167 7.8167 8.1073 8.1073 10.3413 10.3413 10.4807 10.4807 10.7995 10.7995 10.8665 10.8665 12.3555 12.3555 k = 0.4565 0.3640 0.3005 ( 5504 PWs) bands (ev): -32.2034 -32.2034 -32.2033 -32.2033 -13.4910 -13.4910 -13.4893 -13.4893 -13.1226 -13.1226 -13.1219 -13.1219 -13.1079 -13.1079 -13.1059 -13.1059 -1.6380 -1.6380 -1.6309 -1.6309 3.4907 3.4907 3.5195 3.5195 3.8361 3.8361 3.9651 3.9651 4.0367 4.0367 4.0804 4.0804 4.9437 4.9437 5.1136 5.1136 5.3710 5.3710 5.4627 5.4627 5.5495 5.5495 5.5749 5.5749 7.1001 7.1001 7.3430 7.3430 7.8106 7.8106 8.1238 8.1238 10.3574 10.3574 10.5030 10.5030 10.8446 10.8446 10.9281 10.9281 12.3370 12.3371 k = 0.4493 0.3765 0.3005 ( 5504 PWs) bands (ev): -32.2034 -32.2034 -32.2033 -32.2033 -13.4912 -13.4912 -13.4892 -13.4892 -13.1225 -13.1225 -13.1217 -13.1217 -13.1083 -13.1083 -13.1059 -13.1059 -1.6356 -1.6356 -1.6273 -1.6273 3.4975 3.4975 3.5313 3.5313 3.8281 3.8281 3.9756 3.9756 4.0343 4.0343 4.0818 4.0818 4.9264 4.9264 5.1260 5.1260 5.3593 5.3593 5.4566 5.4566 5.5489 5.5489 5.5867 5.5867 7.0404 7.0404 7.2910 7.2910 7.8120 7.8120 8.1372 8.1372 10.3730 10.3730 10.5186 10.5186 10.9006 10.9006 11.0029 11.0029 12.3174 12.3175 k = 0.4420 0.3891 0.3005 ( 5508 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4913 -13.4913 -13.4891 -13.4891 -13.1225 -13.1225 -13.1215 -13.1215 -13.1087 -13.1087 -13.1060 -13.1060 -1.6328 -1.6328 -1.6234 -1.6234 3.5054 3.5054 3.5443 3.5443 3.8207 3.8207 3.9838 3.9838 4.0343 4.0343 4.0827 4.0827 4.9084 4.9084 5.1382 5.1382 5.3480 5.3480 5.4487 5.4487 5.5474 5.5474 5.6001 5.6001 6.9792 6.9792 7.2321 7.2321 7.8183 7.8183 8.1483 8.1483 10.3865 10.3865 10.5290 10.5290 10.9665 10.9665 11.0888 11.0888 12.2968 12.2969 k = 0.4348 0.4016 0.3005 ( 5512 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4915 -13.4915 -13.4890 -13.4890 -13.1225 -13.1225 -13.1213 -13.1213 -13.1091 -13.1091 -13.1060 -13.1060 -1.6296 -1.6296 -1.6193 -1.6193 3.5143 3.5143 3.5585 3.5585 3.8139 3.8139 3.9885 3.9885 4.0375 4.0375 4.0835 4.0835 4.8894 4.8894 5.1501 5.1501 5.3371 5.3371 5.4394 5.4394 5.5454 5.5454 5.6146 5.6146 6.9173 6.9173 7.1692 7.1692 7.8278 7.8278 8.1577 8.1577 10.3973 10.3973 10.5357 10.5357 11.0404 11.0404 11.1829 11.1829 12.2756 12.2757 k = 0.4275 0.4142 0.3005 ( 5504 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4916 -13.4916 -13.4889 -13.4889 -13.1224 -13.1224 -13.1211 -13.1211 -13.1095 -13.1095 -13.1061 -13.1061 -1.6262 -1.6262 -1.6149 -1.6149 3.5241 3.5241 3.5737 3.5737 3.8076 3.8076 3.9894 3.9894 4.0436 4.0436 4.0847 4.0847 4.8695 4.8695 5.1615 5.1615 5.3269 5.3269 5.4290 5.4290 5.5426 5.5426 5.6300 5.6300 6.8555 6.8555 7.1050 7.1050 7.8389 7.8389 8.1658 8.1658 10.4052 10.4052 10.5399 10.5399 11.1207 11.1207 11.2822 11.2822 12.2542 12.2543 k = 0.4203 0.4267 0.3005 ( 5500 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4918 -13.4918 -13.4888 -13.4888 -13.1223 -13.1223 -13.1209 -13.1209 -13.1099 -13.1099 -13.1062 -13.1062 -1.6226 -1.6226 -1.6103 -1.6103 3.5346 3.5346 3.5898 3.5898 3.8018 3.8018 3.9878 3.9878 4.0500 4.0500 4.0875 4.0875 4.8488 4.8488 5.1724 5.1724 5.3175 5.3175 5.4178 5.4178 5.5393 5.5393 5.6459 5.6459 6.7945 6.7945 7.0411 7.0411 7.8508 7.8508 8.1729 8.1729 10.4104 10.4104 10.5424 10.5424 11.2050 11.2050 11.3840 11.3840 12.2329 12.2329 k = 0.4130 0.4393 0.3005 ( 5492 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4919 -13.4919 -13.4887 -13.4887 -13.1222 -13.1222 -13.1207 -13.1207 -13.1103 -13.1103 -13.1063 -13.1063 -1.6188 -1.6188 -1.6056 -1.6056 3.5456 3.5456 3.6067 3.6067 3.7967 3.7967 3.9848 3.9848 4.0538 4.0538 4.0937 4.0937 4.8271 4.8271 5.1827 5.1827 5.3091 5.3091 5.4059 5.4059 5.5354 5.5354 5.6623 5.6623 6.7351 6.7351 6.9791 6.9791 7.8629 7.8629 8.1795 8.1795 10.4134 10.4134 10.5437 10.5437 11.2911 11.2911 11.4858 11.4858 12.2122 12.2122 k = 0.4058 0.4518 0.3005 ( 5488 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4920 -13.4920 -13.4887 -13.4887 -13.1222 -13.1222 -13.1204 -13.1204 -13.1108 -13.1108 -13.1064 -13.1064 -1.6149 -1.6149 -1.6009 -1.6009 3.5569 3.5569 3.6241 3.6241 3.7922 3.7922 3.9811 3.9811 4.0537 4.0537 4.1037 4.1037 4.8047 4.8047 5.1920 5.1920 5.3019 5.3019 5.3936 5.3936 5.5311 5.5311 5.6790 5.6790 6.6780 6.6780 6.9199 6.9199 7.8748 7.8748 8.1856 8.1856 10.4147 10.4147 10.5442 10.5442 11.3767 11.3767 11.5851 11.5851 12.1924 12.1924 k = 0.3986 0.4644 0.3005 ( 5498 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4922 -13.4922 -13.4887 -13.4887 -13.1221 -13.1221 -13.1202 -13.1202 -13.1113 -13.1113 -13.1066 -13.1066 -1.6111 -1.6111 -1.5963 -1.5963 3.5683 3.5683 3.6418 3.6418 3.7884 3.7884 3.9772 3.9772 4.0507 4.0507 4.1162 4.1162 4.7817 4.7817 5.2003 5.2003 5.2961 5.2961 5.3813 5.3813 5.5264 5.5264 5.6958 5.6958 6.6236 6.6236 6.8647 6.8647 7.8861 7.8861 8.1913 8.1913 10.4145 10.4145 10.5441 10.5441 11.4596 11.4596 11.6791 11.6791 12.1742 12.1742 k = 0.3913 0.4769 0.3005 ( 5498 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4923 -13.4923 -13.4886 -13.4886 -13.1220 -13.1220 -13.1199 -13.1199 -13.1117 -13.1117 -13.1067 -13.1067 -1.6073 -1.6073 -1.5918 -1.5918 3.5795 3.5795 3.6597 3.6597 3.7853 3.7853 3.9734 3.9734 4.0455 4.0455 4.1298 4.1298 4.7584 4.7584 5.2073 5.2073 5.2918 5.2918 5.3691 5.3691 5.5214 5.5214 5.7124 5.7124 6.5726 6.5726 6.8140 6.8140 7.8966 7.8966 8.1966 8.1966 10.4134 10.4134 10.5436 10.5436 11.5376 11.5376 11.7648 11.7648 12.1580 12.1580 k = 0.3841 0.4895 0.3005 ( 5506 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4924 -13.4924 -13.4886 -13.4886 -13.1220 -13.1220 -13.1197 -13.1197 -13.1121 -13.1121 -13.1069 -13.1069 -1.6036 -1.6036 -1.5876 -1.5876 3.5903 3.5903 3.6772 3.6772 3.7829 3.7829 3.9699 3.9699 4.0389 4.0389 4.1436 4.1436 4.7353 4.7353 5.2130 5.2130 5.2887 5.2887 5.3576 5.3576 5.5163 5.5163 5.7286 5.7286 6.5255 6.5255 6.7685 6.7685 7.9063 7.9063 8.2017 8.2017 10.4115 10.4115 10.5428 10.5428 11.6092 11.6092 11.8392 11.8392 12.1446 12.1446 k = 0.3768 0.5020 0.3005 ( 5498 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4925 -13.4925 -13.4886 -13.4886 -13.1219 -13.1219 -13.1195 -13.1195 -13.1125 -13.1125 -13.1070 -13.1070 -1.6001 -1.6001 -1.5836 -1.5836 3.6004 3.6004 3.6940 3.6940 3.7813 3.7813 3.9669 3.9669 4.0312 4.0312 4.1572 4.1572 4.7129 4.7129 5.2175 5.2175 5.2863 5.2863 5.3473 5.3473 5.5113 5.5113 5.7441 5.7441 6.4829 6.4829 6.7286 6.7286 7.9149 7.9149 8.2063 8.2063 10.4093 10.4093 10.5418 10.5418 11.6731 11.6731 11.8987 11.8987 12.1346 12.1346 k = 0.3696 0.5146 0.3005 ( 5502 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4926 -13.4926 -13.4886 -13.4886 -13.1219 -13.1219 -13.1193 -13.1193 -13.1129 -13.1129 -13.1071 -13.1071 -1.5970 -1.5970 -1.5800 -1.5800 3.6095 3.6095 3.7095 3.7095 3.7807 3.7807 3.9646 3.9646 4.0226 4.0226 4.1698 4.1698 4.6918 4.6918 5.2212 5.2212 5.2835 5.2835 5.3392 5.3392 5.5064 5.5064 5.7585 5.7585 6.4453 6.4453 6.6947 6.6947 7.9223 7.9223 8.2105 8.2105 10.4069 10.4069 10.5406 10.5406 11.7287 11.7287 11.9407 11.9407 12.1274 12.1274 k = 0.3623 0.5271 0.3005 ( 5502 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4926 -13.4926 -13.4885 -13.4885 -13.1218 -13.1218 -13.1190 -13.1190 -13.1132 -13.1132 -13.1072 -13.1072 -1.5942 -1.5942 -1.5768 -1.5768 3.6173 3.6173 3.7231 3.7231 3.7811 3.7811 3.9634 3.9634 4.0135 4.0135 4.1809 4.1809 4.6729 4.6729 5.2247 5.2247 5.2793 5.2793 5.3338 5.3338 5.5020 5.5020 5.7713 5.7713 6.4134 6.4134 6.6669 6.6669 7.9284 7.9284 8.2142 8.2142 10.4046 10.4046 10.5395 10.5395 11.7757 11.7757 11.9648 11.9648 12.1210 12.1210 k = 0.3551 0.5397 0.3005 ( 5502 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1218 -13.1218 -13.1189 -13.1189 -13.1135 -13.1135 -13.1073 -13.1073 -1.5919 -1.5919 -1.5742 -1.5742 3.6236 3.6236 3.7341 3.7341 3.7823 3.7823 3.9637 3.9637 4.0042 4.0042 4.1901 4.1901 4.6570 4.6570 5.2284 5.2284 5.2734 5.2734 5.3312 5.3312 5.4981 5.4981 5.7819 5.7819 6.3878 6.3878 6.6454 6.6454 7.9333 7.9333 8.2172 8.2172 10.4025 10.4025 10.5384 10.5384 11.8141 11.8141 11.9749 11.9749 12.1134 12.1134 k = 0.3478 0.5522 0.3005 ( 5498 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1187 -13.1187 -13.1137 -13.1137 -13.1073 -13.1073 -1.5902 -1.5902 -1.5723 -1.5723 3.6282 3.6282 3.7420 3.7420 3.7841 3.7841 3.9658 3.9658 3.9948 3.9948 4.1968 4.1968 4.6450 4.6450 5.2327 5.2327 5.2663 5.2663 5.3305 5.3305 5.4952 5.4952 5.7899 5.7899 6.3690 6.3690 6.6301 6.6301 7.9367 7.9367 8.2195 8.2195 10.4008 10.4008 10.5375 10.5375 11.8435 11.8435 11.9766 11.9766 12.1056 12.1056 k = 0.3406 0.5648 0.3005 ( 5492 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1187 -13.1187 -13.1138 -13.1138 -13.1074 -13.1074 -1.5891 -1.5891 -1.5710 -1.5710 3.6309 3.6309 3.7467 3.7467 3.7856 3.7856 3.9703 3.9703 3.9858 3.9858 4.2008 4.2008 4.6375 4.6375 5.2375 5.2375 5.2592 5.2592 5.3305 5.3305 5.4933 5.4933 5.7949 5.7949 6.3575 6.3575 6.6210 6.6210 7.9388 7.9388 8.2209 8.2209 10.3997 10.3997 10.5369 10.5369 11.8623 11.8623 11.9752 11.9752 12.0995 12.0995 k = 0.3333 0.5774 0.3005 ( 5496 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1186 -13.1186 -13.1139 -13.1139 -13.1074 -13.1074 -1.5887 -1.5887 -1.5706 -1.5706 3.6319 3.6319 3.7483 3.7483 3.7861 3.7861 3.9771 3.9771 3.9775 3.9775 4.2021 4.2021 4.6350 4.6350 5.2404 5.2404 5.2554 5.2554 5.3307 5.3307 5.4926 5.4926 5.7965 5.7965 6.3537 6.3537 6.6180 6.6180 7.9395 7.9395 8.2214 8.2214 10.3993 10.3993 10.5367 10.5367 11.8688 11.8688 11.9744 11.9744 12.0971 12.0971 k = 0.3333 0.5774 0.3005 ( 5496 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1186 -13.1186 -13.1139 -13.1139 -13.1074 -13.1074 -1.5887 -1.5887 -1.5706 -1.5706 3.6319 3.6319 3.7483 3.7483 3.7861 3.7861 3.9771 3.9771 3.9775 3.9775 4.2021 4.2021 4.6350 4.6350 5.2404 5.2404 5.2554 5.2554 5.3307 5.3307 5.4926 5.4926 5.7965 5.7965 6.3537 6.3537 6.6180 6.6180 7.9395 7.9395 8.2214 8.2214 10.3993 10.3993 10.5367 10.5367 11.8688 11.8688 11.9744 11.9744 12.0971 12.0971 k = 0.3259 0.5645 0.3005 ( 5496 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1187 -13.1187 -13.1138 -13.1138 -13.1074 -13.1074 -1.5891 -1.5891 -1.5711 -1.5711 3.6309 3.6309 3.7466 3.7466 3.7856 3.7856 3.9692 3.9692 3.9869 3.9869 4.2009 4.2009 4.6376 4.6376 5.2369 5.2369 5.2599 5.2599 5.3304 5.3304 5.4933 5.4933 5.7948 5.7948 6.3576 6.3576 6.6211 6.6211 7.9388 7.9388 8.2209 8.2209 10.3997 10.3997 10.5370 10.5370 11.8626 11.8626 11.9746 11.9746 12.1001 12.1001 k = 0.3185 0.5517 0.3005 ( 5500 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1218 -13.1218 -13.1187 -13.1187 -13.1137 -13.1137 -13.1073 -13.1073 -1.5905 -1.5905 -1.5725 -1.5725 3.6281 3.6281 3.7414 3.7414 3.7841 3.7841 3.9617 3.9617 3.9986 3.9986 4.1980 4.1980 4.6450 4.6450 5.2305 5.2305 5.2697 5.2697 5.3297 5.3297 5.4955 5.4955 5.7901 5.7901 6.3693 6.3693 6.6301 6.6301 7.9367 7.9367 8.2192 8.2192 10.4012 10.4012 10.5379 10.5379 11.8465 11.8465 11.9724 11.9724 12.1095 12.1095 k = 0.3111 0.5389 0.3005 ( 5502 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1218 -13.1218 -13.1189 -13.1189 -13.1135 -13.1135 -13.1073 -13.1073 -1.5928 -1.5928 -1.5751 -1.5751 3.6236 3.6236 3.7330 3.7330 3.7821 3.7821 3.9549 3.9549 4.0118 4.0118 4.1943 4.1943 4.6566 4.6566 5.2238 5.2238 5.2819 5.2819 5.3288 5.3288 5.4992 5.4992 5.7828 5.7828 6.3882 6.3882 6.6450 6.6450 7.9333 7.9333 8.2163 8.2163 10.4037 10.4037 10.5397 10.5397 11.8238 11.8238 11.9650 11.9650 12.1251 12.1251 k = 0.3037 0.5260 0.3005 ( 5494 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4926 -13.4926 -13.4885 -13.4885 -13.1218 -13.1218 -13.1189 -13.1189 -13.1132 -13.1132 -13.1072 -13.1072 -1.5961 -1.5961 -1.5787 -1.5787 3.6173 3.6173 3.7218 3.7218 3.7797 3.7797 3.9485 3.9485 4.0258 4.0258 4.1906 4.1906 4.6716 4.6716 5.2173 5.2173 5.2953 5.2953 5.3287 5.3287 5.5042 5.5042 5.7738 5.7738 6.4137 6.4137 6.6654 6.6654 7.9286 7.9286 8.2122 8.2122 10.4075 10.4075 10.5425 10.5425 11.7969 11.7969 11.9512 11.9512 12.1455 12.1455 k = 0.2963 0.5132 0.3005 ( 5482 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4925 -13.4925 -13.4885 -13.4885 -13.1218 -13.1218 -13.1190 -13.1190 -13.1129 -13.1129 -13.1070 -13.1070 -1.6005 -1.6005 -1.5834 -1.5834 3.6096 3.6096 3.7088 3.7088 3.7767 3.7767 3.9425 3.9425 4.0402 4.0402 4.1876 4.1876 4.6893 4.6893 5.2109 5.2109 5.3067 5.3067 5.3327 5.3327 5.5106 5.5106 5.7636 5.7636 6.4452 6.4452 6.6910 6.6910 7.9228 7.9228 8.2069 8.2069 10.4125 10.4125 10.5464 10.5464 11.7671 11.7671 11.9314 11.9314 12.1686 12.1686 k = 0.2889 0.5004 0.3005 ( 5476 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4924 -13.4924 -13.4884 -13.4884 -13.1219 -13.1219 -13.1191 -13.1191 -13.1125 -13.1125 -13.1069 -13.1069 -1.6061 -1.6061 -1.5894 -1.5894 3.6004 3.6004 3.6946 3.6946 3.7731 3.7731 3.9369 3.9369 4.0544 4.0544 4.1858 4.1858 4.7088 4.7088 5.2045 5.2045 5.3114 5.3114 5.3456 5.3456 5.5184 5.5184 5.7533 5.7533 6.4820 6.4820 6.7216 6.7216 7.9160 7.9160 8.2004 8.2004 10.4188 10.4188 10.5517 10.5517 11.7352 11.7352 11.9066 11.9066 12.1914 12.1914 k = 0.2815 0.4875 0.3005 ( 5492 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4923 -13.4923 -13.4884 -13.4884 -13.1220 -13.1220 -13.1193 -13.1193 -13.1122 -13.1122 -13.1067 -13.1067 -1.6128 -1.6128 -1.5967 -1.5967 3.5901 3.5901 3.6800 3.6800 3.7690 3.7690 3.9315 3.9315 4.0681 4.0681 4.1854 4.1854 4.7297 4.7297 5.1978 5.1978 5.3118 5.3118 5.3653 5.3653 5.5274 5.5274 5.7433 5.7433 6.5237 6.5237 6.7569 6.7569 7.9083 7.9083 8.1927 8.1927 10.4264 10.4264 10.5584 10.5584 11.7018 11.7018 11.8778 11.8778 12.2083 12.2084 k = 0.2741 0.4747 0.3005 ( 5488 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4922 -13.4922 -13.4884 -13.4884 -13.1221 -13.1221 -13.1193 -13.1193 -13.1117 -13.1117 -13.1065 -13.1065 -1.6208 -1.6208 -1.6051 -1.6051 3.5787 3.5787 3.6654 3.6654 3.7643 3.7643 3.9263 3.9263 4.0812 4.0812 4.1864 4.1864 4.7512 4.7512 5.1907 5.1907 5.3112 5.3112 5.3883 5.3883 5.5378 5.5378 5.7347 5.7347 6.5698 6.5698 6.7966 6.7966 7.9001 7.9001 8.1840 8.1840 10.4353 10.4353 10.5668 10.5668 11.6673 11.6673 11.8458 11.8458 12.2147 12.2147 k = 0.2667 0.4619 0.3005 ( 5492 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4921 -13.4921 -13.4883 -13.4883 -13.1221 -13.1221 -13.1194 -13.1194 -13.1113 -13.1113 -13.1063 -13.1063 -1.6299 -1.6299 -1.6148 -1.6148 3.5668 3.5668 3.6512 3.6512 3.7593 3.7593 3.9213 3.9213 4.0935 4.0935 4.1885 4.1885 4.7730 4.7730 5.1830 5.1830 5.3108 5.3108 5.4129 5.4129 5.5498 5.5498 5.7283 5.7283 6.6200 6.6200 6.8403 6.8403 7.8914 7.8914 8.1742 8.1742 10.4456 10.4456 10.5769 10.5769 11.6321 11.6321 11.8114 11.8114 12.2084 12.2084 k = 0.2593 0.4491 0.3005 ( 5490 PWs) bands (ev): -32.2033 -32.2033 -32.2033 -32.2033 -13.4919 -13.4919 -13.4883 -13.4883 -13.1222 -13.1222 -13.1194 -13.1194 -13.1108 -13.1108 -13.1061 -13.1061 -1.6402 -1.6402 -1.6257 -1.6257 3.5544 3.5544 3.6377 3.6377 3.7542 3.7542 3.9165 3.9165 4.1050 4.1050 4.1915 4.1915 4.7946 4.7946 5.1746 5.1746 5.3107 5.3107 5.4378 5.4378 5.5638 5.5638 5.7251 5.7251 6.6739 6.6739 6.8879 6.8879 7.8826 7.8826 8.1636 8.1636 10.4571 10.4571 10.5891 10.5891 11.5965 11.5965 11.7753 11.7753 12.1874 12.1874 k = 0.2519 0.4362 0.3005 ( 5494 PWs) bands (ev): -32.2034 -32.2034 -32.2033 -32.2033 -13.4918 -13.4918 -13.4882 -13.4882 -13.1223 -13.1223 -13.1194 -13.1194 -13.1104 -13.1104 -13.1059 -13.1059 -1.6517 -1.6517 -1.6378 -1.6378 3.5421 3.5421 3.6249 3.6249 3.7490 3.7490 3.9119 3.9119 4.1158 4.1158 4.1950 4.1950 4.8158 4.8158 5.1656 5.1656 5.3112 5.3112 5.4608 5.4608 5.5810 5.5810 5.7263 5.7263 6.7311 6.7311 6.9388 6.9388 7.8740 7.8740 8.1524 8.1524 10.4697 10.4697 10.6032 10.6032 11.5606 11.5606 11.7379 11.7379 12.1531 12.1531 k = 0.2444 0.4234 0.3005 ( 5502 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4916 -13.4916 -13.4881 -13.4881 -13.1224 -13.1224 -13.1194 -13.1194 -13.1099 -13.1099 -13.1056 -13.1056 -1.6643 -1.6643 -1.6511 -1.6511 3.5302 3.5302 3.6131 3.6131 3.7439 3.7439 3.9074 3.9074 4.1257 4.1257 4.1987 4.1987 4.8363 4.8363 5.1560 5.1560 5.3120 5.3120 5.4797 5.4797 5.6028 5.6028 5.7329 5.7329 6.7913 6.7913 6.9929 6.9929 7.8658 7.8658 8.1407 8.1407 10.4835 10.4835 10.6194 10.6194 11.5248 11.5248 11.6995 11.6995 12.1092 12.1092 k = 0.2370 0.4106 0.3005 ( 5506 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4914 -13.4914 -13.4880 -13.4880 -13.1224 -13.1224 -13.1194 -13.1194 -13.1094 -13.1094 -13.1053 -13.1053 -1.6780 -1.6780 -1.6655 -1.6655 3.5188 3.5188 3.6023 3.6023 3.7389 3.7389 3.9029 3.9029 4.1350 4.1350 4.2022 4.2022 4.8558 4.8558 5.1459 5.1459 5.3132 5.3132 5.4922 5.4922 5.6308 5.6308 5.7457 5.7457 6.8541 6.8541 7.0496 7.0496 7.8587 7.8587 8.1288 8.1288 10.4982 10.4982 10.6378 10.6378 11.4891 11.4891 11.6604 11.6604 12.0597 12.0597 k = 0.2296 0.3977 0.3005 ( 5518 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4913 -13.4913 -13.4879 -13.4879 -13.1225 -13.1225 -13.1193 -13.1193 -13.1089 -13.1089 -13.1050 -13.1050 -1.6929 -1.6929 -1.6809 -1.6809 3.5083 3.5083 3.5925 3.5925 3.7343 3.7343 3.8984 3.8984 4.1435 4.1435 4.2055 4.2055 4.8742 4.8742 5.1355 5.1355 5.3145 5.3145 5.4982 5.4982 5.6650 5.6650 5.7648 5.7648 6.9191 6.9191 7.1086 7.1086 7.8530 7.8530 8.1170 8.1170 10.5137 10.5137 10.6582 10.6582 11.4539 11.4539 11.6209 11.6209 12.0076 12.0076 k = 0.2222 0.3849 0.3005 ( 5522 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4911 -13.4911 -13.4878 -13.4878 -13.1225 -13.1225 -13.1193 -13.1193 -13.1083 -13.1083 -13.1047 -13.1047 -1.7086 -1.7086 -1.6973 -1.6973 3.4989 3.4989 3.5838 3.5838 3.7299 3.7299 3.8939 3.8939 4.1513 4.1513 4.2082 4.2082 4.8913 4.8913 5.1249 5.1249 5.3159 5.3159 5.4988 5.4988 5.7045 5.7045 5.7901 5.7901 6.9857 6.9857 7.1695 7.1695 7.8494 7.8494 8.1056 8.1056 10.5297 10.5297 10.6806 10.6806 11.4193 11.4193 11.5809 11.5809 11.9547 11.9547 k = 0.2148 0.3721 0.3005 ( 5522 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4909 -13.4909 -13.4877 -13.4877 -13.1225 -13.1225 -13.1192 -13.1192 -13.1078 -13.1078 -13.1044 -13.1044 -1.7253 -1.7253 -1.7146 -1.7146 3.4906 3.4906 3.5761 3.5761 3.7259 3.7259 3.8893 3.8893 4.1584 4.1584 4.2104 4.2104 4.9070 4.9070 5.1143 5.1143 5.3172 5.3172 5.4955 5.4955 5.7480 5.7480 5.8210 5.8210 7.0532 7.0532 7.2317 7.2317 7.8486 7.8486 8.0952 8.0952 10.5459 10.5459 10.7049 10.7049 11.3855 11.3855 11.5405 11.5405 11.9024 11.9024 k = 0.2074 0.3592 0.3005 ( 5516 PWs) bands (ev): -32.2035 -32.2035 -32.2035 -32.2035 -13.4906 -13.4906 -13.4875 -13.4875 -13.1225 -13.1225 -13.1191 -13.1191 -13.1072 -13.1072 -13.1040 -13.1040 -1.7427 -1.7427 -1.7326 -1.7326 3.4835 3.4835 3.5695 3.5695 3.7224 3.7224 3.8846 3.8846 4.1647 4.1647 4.2121 4.2121 4.9212 4.9212 5.1037 5.1037 5.3184 5.3184 5.4896 5.4896 5.7948 5.7948 5.8569 5.8569 7.1208 7.1208 7.2948 7.2948 7.8515 7.8515 8.0863 8.0863 10.5621 10.5621 10.7308 10.7308 11.3528 11.3528 11.4998 11.4998 11.8519 11.8519 k = 0.2000 0.3464 0.3005 ( 5512 PWs) bands (ev): -32.2036 -32.2036 -32.2035 -32.2035 -13.4904 -13.4904 -13.4873 -13.4873 -13.1224 -13.1224 -13.1190 -13.1190 -13.1066 -13.1066 -13.1037 -13.1037 -1.7609 -1.7609 -1.7514 -1.7514 3.4778 3.4778 3.5638 3.5638 3.7193 3.7193 3.8798 3.8798 4.1703 4.1703 4.2131 4.2131 4.9339 4.9339 5.0935 5.0935 5.3194 5.3194 5.4819 5.4819 5.8441 5.8441 5.8973 5.8973 7.1874 7.1874 7.3582 7.3582 7.8591 7.8591 8.0796 8.0796 10.5777 10.5777 10.7580 10.7580 11.3213 11.3213 11.4587 11.4587 11.8041 11.8041 k = 0.1926 0.3336 0.3005 ( 5516 PWs) bands (ev): -32.2036 -32.2036 -32.2036 -32.2036 -13.4902 -13.4902 -13.4871 -13.4871 -13.1224 -13.1224 -13.1189 -13.1189 -13.1061 -13.1061 -13.1033 -13.1033 -1.7798 -1.7798 -1.7708 -1.7708 3.4733 3.4733 3.5589 3.5589 3.7167 3.7167 3.8748 3.8748 4.1752 4.1752 4.2136 4.2136 4.9451 4.9451 5.0838 5.0838 5.3201 5.3201 5.4730 5.4730 5.8953 5.8953 5.9416 5.9416 7.2516 7.2516 7.4214 7.4214 7.8726 7.8726 8.0760 8.0760 10.5921 10.5921 10.7860 10.7860 11.2911 11.2911 11.4177 11.4177 11.7597 11.7597 k = 0.1852 0.3208 0.3005 ( 5508 PWs) bands (ev): -32.2036 -32.2036 -32.2036 -32.2036 -13.4899 -13.4899 -13.4869 -13.4869 -13.1223 -13.1223 -13.1188 -13.1188 -13.1054 -13.1054 -13.1029 -13.1029 -1.7991 -1.7991 -1.7906 -1.7906 3.4701 3.4701 3.5548 3.5548 3.7147 3.7147 3.8696 3.8696 4.1794 4.1794 4.2135 4.2135 4.9547 4.9547 5.0747 5.0747 5.3205 5.3205 5.4633 5.4633 5.9481 5.9481 5.9892 5.9892 7.3118 7.3118 7.4839 7.4839 7.8927 7.8927 8.0769 8.0769 10.6047 10.6047 10.8144 10.8144 11.2623 11.2623 11.3772 11.3772 11.7195 11.7195 k = 0.1778 0.3079 0.3005 ( 5508 PWs) bands (ev): -32.2037 -32.2037 -32.2036 -32.2036 -13.4897 -13.4897 -13.4867 -13.4867 -13.1222 -13.1222 -13.1187 -13.1187 -13.1048 -13.1048 -13.1025 -13.1025 -1.8189 -1.8189 -1.8108 -1.8108 3.4682 3.4682 3.5514 3.5514 3.7132 3.7132 3.8643 3.8643 4.1828 4.1828 4.2130 4.2130 4.9626 4.9626 5.0665 5.0665 5.3205 5.3205 5.4529 5.4529 6.0022 6.0022 6.0395 6.0395 7.3666 7.3666 7.5454 7.5454 7.9201 7.9201 8.0837 8.0837 10.6147 10.6147 10.8424 10.8424 11.2344 11.2344 11.3385 11.3385 11.6840 11.6840 k = 0.1704 0.2951 0.3005 ( 5502 PWs) bands (ev): -32.2037 -32.2037 -32.2037 -32.2037 -13.4894 -13.4894 -13.4865 -13.4865 -13.1221 -13.1221 -13.1186 -13.1186 -13.1042 -13.1042 -13.1021 -13.1021 -1.8389 -1.8389 -1.8313 -1.8313 3.4674 3.4674 3.5486 3.5486 3.7124 3.7124 3.8588 3.8588 4.1856 4.1856 4.2121 4.2121 4.9689 4.9689 5.0593 5.0593 5.3203 5.3203 5.4423 5.4423 6.0572 6.0572 6.0918 6.0918 7.4151 7.4151 7.6048 7.6048 7.9547 7.9547 8.0986 8.0986 10.6212 10.6212 10.8689 10.8689 11.2062 11.2062 11.3039 11.3039 11.6536 11.6536 k = 0.1630 0.2823 0.3005 ( 5502 PWs) bands (ev): -32.2037 -32.2037 -32.2037 -32.2037 -13.4892 -13.4892 -13.4863 -13.4863 -13.1220 -13.1220 -13.1185 -13.1185 -13.1036 -13.1036 -13.1017 -13.1017 -1.8591 -1.8591 -1.8519 -1.8519 3.4676 3.4676 3.5461 3.5461 3.7121 3.7121 3.8531 3.8531 4.1877 4.1877 4.2109 4.2109 4.9733 4.9733 5.0535 5.0535 5.3198 5.3198 5.4314 5.4314 6.1128 6.1128 6.1452 6.1452 7.4575 7.4575 7.6610 7.6610 7.9957 7.9957 8.1236 8.1236 10.6234 10.6234 10.8924 10.8924 11.1764 11.1764 11.2762 11.2762 11.6285 11.6285 k = 0.1556 0.2694 0.3005 ( 5498 PWs) bands (ev): -32.2037 -32.2037 -32.2037 -32.2037 -13.4889 -13.4889 -13.4861 -13.4861 -13.1218 -13.1218 -13.1184 -13.1184 -13.1030 -13.1030 -13.1012 -13.1012 -1.8794 -1.8794 -1.8726 -1.8726 3.4689 3.4689 3.5440 3.5440 3.7125 3.7125 3.8474 3.8474 4.1891 4.1891 4.2093 4.2093 4.9761 4.9761 5.0491 5.0491 5.3189 5.3189 5.4203 5.4203 6.1685 6.1685 6.1991 6.1991 7.4952 7.4952 7.7123 7.7123 8.0426 8.0426 8.1600 8.1600 10.6207 10.6207 10.9100 10.9100 11.1459 11.1459 11.2573 11.2573 11.6087 11.6087 k = 0.1481 0.2566 0.3005 ( 5500 PWs) bands (ev): -32.2038 -32.2038 -32.2038 -32.2038 -13.4887 -13.4887 -13.4859 -13.4859 -13.1217 -13.1217 -13.1183 -13.1183 -13.1024 -13.1024 -13.1008 -13.1008 -1.8996 -1.8996 -1.8932 -1.8932 3.4710 3.4710 3.5422 3.5422 3.7136 3.7136 3.8416 3.8416 4.1901 4.1901 4.2075 4.2075 4.9771 4.9771 5.0461 5.0461 5.3178 5.3178 5.4093 5.4093 6.2239 6.2239 6.2526 6.2526 7.5301 7.5301 7.7576 7.7576 8.0956 8.0956 8.2072 8.2072 10.6125 10.6125 10.9173 10.9173 11.1192 11.1192 11.2467 11.2467 11.5942 11.5942 k = 0.1407 0.2438 0.3005 ( 5500 PWs) bands (ev): -32.2038 -32.2038 -32.2038 -32.2038 -13.4884 -13.4884 -13.4857 -13.4857 -13.1216 -13.1216 -13.1182 -13.1182 -13.1017 -13.1017 -13.1004 -13.1004 -1.9197 -1.9197 -1.9135 -1.9135 3.4738 3.4738 3.5404 3.5404 3.7152 3.7152 3.8358 3.8358 4.1905 4.1905 4.2056 4.2056 4.9768 4.9768 5.0443 5.0443 5.3164 5.3164 5.3982 5.3982 6.2783 6.2783 6.3051 6.3051 7.5640 7.5640 7.7973 7.7973 8.1548 8.1548 8.2632 8.2632 10.5987 10.5987 10.9083 10.9083 11.1032 11.1032 11.2428 11.2428 11.5848 11.5848 k = 0.1333 0.2309 0.3005 ( 5512 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4882 -13.4882 -13.4855 -13.4855 -13.1215 -13.1215 -13.1182 -13.1182 -13.1012 -13.1012 -13.1000 -13.1000 -1.9394 -1.9394 -1.9336 -1.9336 3.4772 3.4772 3.5388 3.5388 3.7174 3.7174 3.8300 3.8300 4.1905 4.1905 4.2035 4.2035 4.9755 4.9755 5.0436 5.0436 5.3147 5.3147 5.3873 5.3873 6.3310 6.3310 6.3558 6.3558 7.5989 7.5989 7.8330 7.8330 8.2197 8.2197 8.3253 8.3253 10.5793 10.5793 10.8811 10.8811 11.1009 11.1009 11.2437 11.2437 11.5798 11.5798 k = 0.1259 0.2181 0.3005 ( 5518 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4879 -13.4879 -13.4854 -13.4854 -13.1213 -13.1213 -13.1182 -13.1182 -13.1006 -13.1006 -13.0995 -13.0995 -1.9588 -1.9588 -1.9532 -1.9532 3.4811 3.4811 3.5372 3.5372 3.7202 3.7202 3.8243 3.8243 4.1902 4.1902 4.2012 4.2012 4.9737 4.9737 5.0434 5.0434 5.3129 5.3129 5.3766 5.3766 6.3815 6.3815 6.4040 6.4040 7.6363 7.6363 7.8671 7.8671 8.2891 8.2891 8.3912 8.3912 10.5547 10.5547 10.8397 10.8397 11.1088 11.1088 11.2481 11.2481 11.5787 11.5787 k = 0.1185 0.2053 0.3005 ( 5516 PWs) bands (ev): -32.2039 -32.2039 -32.2039 -32.2039 -13.4877 -13.4877 -13.4852 -13.4852 -13.1212 -13.1212 -13.1181 -13.1181 -13.1000 -13.1000 -13.0991 -13.0991 -1.9776 -1.9776 -1.9724 -1.9724 3.4852 3.4852 3.5356 3.5356 3.7234 3.7234 3.8189 3.8189 4.1896 4.1896 4.1989 4.1989 4.9716 4.9716 5.0435 5.0435 5.3108 5.3108 5.3661 5.3661 6.4289 6.4289 6.4493 6.4493 7.6775 7.6775 7.9018 7.9018 8.3613 8.3613 8.4592 8.4592 10.5250 10.5250 10.7894 10.7894 11.1223 11.1223 11.2547 11.2547 11.5804 11.5804 k = 0.1111 0.1925 0.3005 ( 5512 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4874 -13.4874 -13.4850 -13.4850 -13.1210 -13.1210 -13.1181 -13.1181 -13.0994 -13.0994 -13.0986 -13.0986 -1.9958 -1.9958 -1.9908 -1.9908 3.4896 3.4896 3.5340 3.5340 3.7269 3.7269 3.8137 3.8137 4.1887 4.1887 4.1966 4.1966 4.9697 4.9697 5.0436 5.0436 5.3086 5.3086 5.3560 5.3560 6.4725 6.4725 6.4912 6.4912 7.7231 7.7231 7.9389 7.9389 8.4350 8.4350 8.5282 8.5282 10.4906 10.4906 10.7333 10.7333 11.1387 11.1387 11.2629 11.2629 11.5836 11.5836 k = 0.1037 0.1796 0.3005 ( 5516 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4872 -13.4872 -13.4849 -13.4849 -13.1208 -13.1208 -13.1181 -13.1181 -13.0988 -13.0988 -13.0982 -13.0982 -2.0133 -2.0133 -2.0086 -2.0086 3.4940 3.4940 3.5325 3.5325 3.7307 3.7307 3.8088 3.8088 4.1876 4.1876 4.1942 4.1942 4.9681 4.9681 5.0436 5.0436 5.3062 5.3062 5.3462 5.3462 6.5119 6.5119 6.5294 6.5294 7.7738 7.7738 7.9795 7.9795 8.5090 8.5090 8.5971 8.5971 10.4515 10.4515 10.6730 10.6730 11.1568 11.1568 11.2723 11.2723 11.5870 11.5870 k = 0.0963 0.1668 0.3005 ( 5520 PWs) bands (ev): -32.2040 -32.2040 -32.2040 -32.2040 -13.4869 -13.4869 -13.4847 -13.4847 -13.1207 -13.1207 -13.1181 -13.1181 -13.0983 -13.0983 -13.0978 -13.0978 -2.0300 -2.0300 -2.0256 -2.0256 3.4983 3.4983 3.5309 3.5309 3.7347 3.7347 3.8043 3.8043 4.1864 4.1864 4.1918 4.1918 4.9669 4.9669 5.0433 5.0433 5.3038 5.3038 5.3370 5.3370 6.5467 6.5467 6.5638 6.5638 7.8295 7.8295 8.0245 8.0245 8.5822 8.5822 8.6652 8.6652 10.4078 10.4078 10.6090 10.6090 11.1763 11.1763 11.2830 11.2830 11.5894 11.5894 k = 0.0889 0.1540 0.3005 ( 5516 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4867 -13.4867 -13.4846 -13.4846 -13.1205 -13.1205 -13.1181 -13.1181 -13.0978 -13.0978 -13.0974 -13.0974 -2.0458 -2.0458 -2.0417 -2.0417 3.5025 3.5025 3.5295 3.5295 3.7389 3.7389 3.8003 3.8003 4.1851 4.1851 4.1895 4.1895 4.9663 4.9663 5.0426 5.0426 5.3012 5.3012 5.3283 5.3283 6.5768 6.5768 6.5942 6.5942 7.8902 7.8902 8.0741 8.0741 8.6541 8.6541 8.7323 8.7323 10.3595 10.3595 10.5416 10.5416 11.1971 11.1971 11.2949 11.2949 11.5898 11.5898 k = 0.0815 0.1411 0.3005 ( 5524 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4865 -13.4865 -13.4845 -13.4845 -13.1204 -13.1204 -13.1181 -13.1181 -13.0973 -13.0973 -13.0970 -13.0970 -2.0606 -2.0606 -2.0568 -2.0568 3.5063 3.5063 3.5281 3.5281 3.7430 3.7430 3.7968 3.7968 4.1837 4.1837 4.1872 4.1872 4.9663 4.9663 5.0414 5.0414 5.2987 5.2987 5.3202 5.3202 6.6025 6.6025 6.6207 6.6207 7.9551 7.9551 8.1281 8.1281 8.7241 8.7241 8.7979 8.7979 10.3064 10.3064 10.4708 10.4708 11.2191 11.2191 11.3082 11.3082 11.5874 11.5875 k = 0.0741 0.1283 0.3005 ( 5530 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4862 -13.4862 -13.4844 -13.4844 -13.1202 -13.1202 -13.1181 -13.1181 -13.0969 -13.0969 -13.0967 -13.0967 -2.0744 -2.0744 -2.0709 -2.0709 3.5097 3.5097 3.5267 3.5267 3.7471 3.7471 3.7937 3.7937 4.1823 4.1823 4.1851 4.1851 4.9668 4.9668 5.0398 5.0398 5.2961 5.2961 5.3127 5.3127 6.6242 6.6242 6.6431 6.6431 8.0236 8.0236 8.1858 8.1858 8.7919 8.7919 8.8619 8.8619 10.2487 10.2487 10.3965 10.3965 11.2424 11.2424 11.3231 11.3231 11.5822 11.5823 k = 0.0667 0.1155 0.3005 ( 5514 PWs) bands (ev): -32.2041 -32.2041 -32.2041 -32.2041 -13.4860 -13.4860 -13.4843 -13.4843 -13.1200 -13.1200 -13.1182 -13.1182 -13.0965 -13.0965 -13.0963 -13.0963 -2.0870 -2.0870 -2.0838 -2.0838 3.5127 3.5127 3.5256 3.5256 3.7511 3.7511 3.7912 3.7912 4.1809 4.1809 4.1831 4.1831 4.9681 4.9681 5.0377 5.0377 5.2935 5.2935 5.3060 5.3060 6.6424 6.6424 6.6618 6.6618 8.0944 8.0944 8.2462 8.2462 8.8578 8.8578 8.9244 8.9244 10.1864 10.1864 10.3188 10.3188 11.2668 11.2668 11.3393 11.3393 11.5746 11.5746 k = 0.0593 0.1026 0.3005 ( 5520 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4858 -13.4858 -13.4843 -13.4843 -13.1199 -13.1199 -13.1182 -13.1182 -13.0961 -13.0961 -13.0960 -13.0960 -2.0984 -2.0984 -2.0956 -2.0956 3.5152 3.5152 3.5245 3.5245 3.7550 3.7550 3.7891 3.7891 4.1796 4.1796 4.1812 4.1812 4.9699 4.9699 5.0351 5.0351 5.2910 5.2910 5.3000 5.3000 6.6576 6.6576 6.6768 6.6768 8.1665 8.1665 8.3078 8.3078 8.9220 8.9220 8.9857 8.9857 10.1196 10.1196 10.2376 10.2376 11.2917 11.2917 11.3563 11.3563 11.5655 11.5659 k = 0.0519 0.0898 0.3005 ( 5516 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4856 -13.4856 -13.4842 -13.4842 -13.1198 -13.1198 -13.1183 -13.1183 -13.0958 -13.0958 -13.0957 -13.0957 -2.1086 -2.1086 -2.1061 -2.1061 3.5172 3.5172 3.5236 3.5236 3.7586 3.7586 3.7873 3.7873 4.1783 4.1783 4.1795 4.1795 4.9723 4.9723 5.0320 5.0320 5.2886 5.2886 5.2948 5.2948 6.6701 6.6701 6.6887 6.6887 8.2383 8.2383 8.3686 8.3686 8.9854 8.9854 9.0460 9.0460 10.0488 10.0488 10.1531 10.1531 11.3165 11.3165 11.3734 11.3734 11.5561 11.5561 k = 0.0444 0.0770 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4854 -13.4854 -13.4842 -13.4842 -13.1196 -13.1196 -13.1184 -13.1184 -13.0955 -13.0955 -13.0954 -13.0954 -2.1176 -2.1176 -2.1154 -2.1154 3.5188 3.5188 3.5229 3.5229 3.7621 3.7621 3.7858 3.7858 4.1771 4.1771 4.1780 4.1780 4.9752 4.9752 5.0284 5.0284 5.2864 5.2864 5.2904 5.2904 6.6804 6.6804 6.6978 6.6978 8.3080 8.3080 8.4263 8.4263 9.0491 9.0491 9.1059 9.1059 9.9745 9.9745 10.0654 10.0654 11.3401 11.3401 11.3889 11.3889 11.5488 11.5497 k = 0.0370 0.0642 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4852 -13.4852 -13.4842 -13.4842 -13.1195 -13.1195 -13.1184 -13.1184 -13.0952 -13.0952 -13.0952 -13.0952 -2.1252 -2.1252 -2.1233 -2.1233 3.5199 3.5199 3.5223 3.5223 3.7653 3.7653 3.7846 3.7846 4.1760 4.1760 4.1767 4.1767 4.9786 4.9786 5.0245 5.0245 5.2844 5.2844 5.2867 5.2867 6.6890 6.6890 6.7044 6.7044 8.3740 8.3740 8.4785 8.4785 9.1147 9.1147 9.1661 9.1661 9.8976 9.8976 9.9752 9.9752 11.3612 11.3612 11.4012 11.4012 11.5453 11.5455 k = 0.0296 0.0513 0.3005 ( 5532 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4850 -13.4850 -13.4843 -13.4843 -13.1194 -13.1194 -13.1185 -13.1185 -13.0950 -13.0950 -13.0950 -13.0950 -2.1314 -2.1314 -2.1299 -2.1299 3.5207 3.5207 3.5219 3.5219 3.7683 3.7683 3.7834 3.7834 4.1751 4.1751 4.1756 4.1756 4.9825 4.9825 5.0201 5.0201 5.2826 5.2826 5.2838 5.2838 6.6959 6.6959 6.7089 6.7089 8.4341 8.4341 8.5225 8.5225 9.1834 9.1834 9.2274 9.2274 9.8190 9.8190 9.8831 9.8831 11.3785 11.3785 11.4090 11.4090 11.5470 11.5485 k = 0.0222 0.0385 0.3005 ( 5528 PWs) bands (ev): -32.2042 -32.2042 -32.2042 -32.2042 -13.4849 -13.4849 -13.4843 -13.4843 -13.1192 -13.1192 -13.1186 -13.1186 -13.0949 -13.0949 -13.0948 -13.0948 -2.1362 -2.1362 -2.1351 -2.1351 3.5212 3.5212 3.5217 3.5217 3.7710 3.7710 3.7822 3.7822 4.1743 4.1743 4.1748 4.1748 4.9867 4.9867 5.0155 5.0155 5.2811 5.2811 5.2816 5.2816 6.7015 6.7015 6.7117 6.7117 8.4865 8.4865 8.5559 8.5559 9.2564 9.2564 9.2906 9.2906 9.7397 9.7397 9.7900 9.7900 11.3910 11.3910 11.4124 11.4124 11.5528 11.5554 k = 0.0148 0.0257 0.3005 ( 5532 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4847 -13.4847 -13.4843 -13.4843 -13.1191 -13.1191 -13.1187 -13.1187 -13.0947 -13.0947 -13.0947 -13.0947 -2.1396 -2.1396 -2.1389 -2.1389 3.5214 3.5214 3.5216 3.5216 3.7735 3.7735 3.7808 3.7808 4.1738 4.1738 4.1741 4.1741 4.9912 4.9912 5.0108 5.0108 5.2800 5.2800 5.2801 5.2801 6.7060 6.7060 6.7129 6.7129 8.5292 8.5292 8.5772 8.5772 9.3338 9.3338 9.3560 9.3560 9.6613 9.6613 9.6972 9.6972 11.3992 11.3992 11.4125 11.4125 11.5590 11.5598 k = 0.0074 0.0128 0.3005 ( 5552 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4847 -13.4847 -13.4845 -13.4845 -13.1191 -13.1191 -13.1188 -13.1188 -13.0947 -13.0947 -13.0947 -13.0947 -2.1416 -2.1416 -2.1413 -2.1413 3.5215 3.5215 3.5215 3.5215 3.7757 3.7757 3.7793 3.7793 4.1736 4.1736 4.1737 4.1737 4.9960 4.9960 5.0058 5.0058 5.2793 5.2793 5.2793 5.2793 6.7093 6.7093 6.7128 6.7128 8.5606 8.5606 8.5851 8.5851 9.4138 9.4138 9.4225 9.4225 9.5865 9.5865 9.6073 9.6073 11.4045 11.4045 11.4108 11.4108 11.5630 11.5631 k = 0.0000 0.0000 0.3005 ( 5552 PWs) bands (ev): -32.2043 -32.2043 -32.2043 -32.2043 -13.4845 -13.4845 -13.4845 -13.4845 -13.1189 -13.1189 -13.1189 -13.1189 -13.0947 -13.0947 -13.0947 -13.0947 -2.1422 -2.1422 -2.1422 -2.1422 3.5215 3.5215 3.5215 3.5215 3.7776 3.7776 3.7776 3.7776 4.1735 4.1735 4.1735 4.1735 5.0009 5.0009 5.0009 5.0009 5.2790 5.2790 5.2790 5.2790 6.7116 6.7116 6.7116 6.7116 8.5795 8.5795 8.5795 8.5795 9.4705 9.4705 9.4705 9.4705 9.5414 9.5414 9.5414 9.5414 11.4081 11.4081 11.4081 11.4081 11.5646 11.5646 k = 0.5000 0.2887 0.3005 ( 5524 PWs) bands (ev): -32.2034 -32.2034 -32.2034 -32.2034 -13.4901 -13.4901 -13.4901 -13.4901 -13.1225 -13.1225 -13.1225 -13.1225 -13.1064 -13.1064 -13.1064 -13.1064 -1.6433 -1.6433 -1.6433 -1.6433 3.4784 3.4784 3.4784 3.4784 3.8946 3.8946 3.8946 3.8946 4.0623 4.0623 4.0623 4.0623 5.0347 5.0347 5.0347 5.0347 5.4413 5.4413 5.4413 5.4413 5.5476 5.5476 5.5476 5.5476 7.3809 7.3809 7.3809 7.3809 7.9656 7.9656 7.9656 7.9656 10.3322 10.3322 10.3322 10.3322 10.7320 10.7320 10.7320 10.7320 12.4237 12.4237 k = 0.5000 0.2887 0.2855 ( 5528 PWs) bands (ev): -32.2035 -32.2035 -32.2032 -32.2032 -13.4908 -13.4908 -13.4894 -13.4894 -13.1240 -13.1240 -13.1211 -13.1211 -13.1065 -13.1065 -13.1062 -13.1062 -1.6466 -1.6466 -1.6400 -1.6400 3.4696 3.4696 3.4878 3.4878 3.8890 3.8890 3.9007 3.9007 4.0540 4.0540 4.0713 4.0713 5.0299 5.0299 5.0398 5.0398 5.4354 5.4354 5.4474 5.4474 5.5408 5.5408 5.5542 5.5542 7.3534 7.3534 7.4044 7.4044 7.9040 7.9040 8.0266 8.0266 10.2358 10.2358 10.4221 10.4221 10.6928 10.6928 10.7871 10.7871 12.4124 12.4145 k = 0.5000 0.2887 0.2705 ( 5532 PWs) bands (ev): -32.2037 -32.2037 -32.2030 -32.2030 -13.4915 -13.4915 -13.4888 -13.4888 -13.1254 -13.1254 -13.1199 -13.1199 -13.1065 -13.1065 -13.1060 -13.1060 -1.6499 -1.6499 -1.6369 -1.6369 3.4613 3.4613 3.4976 3.4976 3.8840 3.8840 3.9073 3.9073 4.0464 4.0464 4.0811 4.0811 5.0251 5.0251 5.0450 5.0450 5.4298 5.4298 5.4536 5.4536 5.5340 5.5340 5.5608 5.5608 7.3214 7.3214 7.4244 7.4244 7.8438 7.8438 8.0851 8.0851 10.1430 10.1430 10.4772 10.4772 10.6966 10.6966 10.8492 10.8492 12.3991 12.4045 k = 0.5000 0.2887 0.2554 ( 5524 PWs) bands (ev): -32.2039 -32.2039 -32.2029 -32.2029 -13.4922 -13.4922 -13.4881 -13.4881 -13.1269 -13.1269 -13.1188 -13.1188 -13.1063 -13.1063 -13.1057 -13.1057 -1.6533 -1.6533 -1.6339 -1.6339 3.4537 3.4537 3.5077 3.5077 3.8797 3.8797 3.9144 3.9144 4.0396 4.0396 4.0916 4.0916 5.0204 5.0204 5.0506 5.0506 5.4244 5.4244 5.4600 5.4600 5.5272 5.5272 5.5673 5.5673 7.2843 7.2843 7.4412 7.4412 7.7869 7.7869 8.1390 8.1390 10.0578 10.0578 10.4728 10.4728 10.7667 10.7667 10.9157 10.9157 12.3857 12.3858 k = 0.5000 0.2887 0.2404 ( 5526 PWs) bands (ev): -32.2040 -32.2040 -32.2027 -32.2027 -13.4929 -13.4929 -13.4875 -13.4875 -13.1284 -13.1284 -13.1179 -13.1179 -13.1060 -13.1060 -13.1053 -13.1053 -1.6567 -1.6567 -1.6310 -1.6310 3.4468 3.4468 3.5178 3.5178 3.8761 3.8761 3.9217 3.9217 4.0334 4.0334 4.1030 4.1030 5.0158 5.0158 5.0564 5.0564 5.4193 5.4193 5.4664 5.4664 5.5206 5.5206 5.5736 5.5736 7.2417 7.2417 7.4548 7.4548 7.7349 7.7349 8.1867 8.1867 9.9825 9.9825 10.4390 10.4390 10.8716 10.8716 10.9855 10.9855 12.3725 12.3725 k = 0.5000 0.2887 0.2254 ( 5520 PWs) bands (ev): -32.2042 -32.2042 -32.2026 -32.2026 -13.4936 -13.4936 -13.4869 -13.4869 -13.1299 -13.1299 -13.1171 -13.1171 -13.1056 -13.1056 -13.1048 -13.1048 -1.6600 -1.6600 -1.6283 -1.6283 3.4407 3.4407 3.5279 3.5279 3.8731 3.8731 3.9291 3.9291 4.0280 4.0280 4.1152 4.1152 5.0111 5.0111 5.0627 5.0627 5.4145 5.4145 5.4725 5.4725 5.5142 5.5142 5.5798 5.5798 7.1937 7.1937 7.4652 7.4652 7.6893 7.6893 8.2264 8.2264 9.9189 9.9189 10.3983 10.3983 10.9860 10.9860 11.0595 11.0595 12.3600 12.3600 k = 0.5000 0.2887 0.2104 ( 5512 PWs) bands (ev): -32.2043 -32.2043 -32.2024 -32.2024 -13.4943 -13.4943 -13.4863 -13.4863 -13.1313 -13.1313 -13.1166 -13.1166 -13.1051 -13.1051 -13.1043 -13.1043 -1.6634 -1.6634 -1.6257 -1.6257 3.4354 3.4354 3.5378 3.5378 3.8708 3.8708 3.9364 3.9364 4.0235 4.0235 4.1283 4.1283 5.0063 5.0063 5.0692 5.0692 5.4100 5.4100 5.4778 5.4778 5.5089 5.5089 5.5858 5.5858 7.1405 7.1405 7.4719 7.4719 7.6509 7.6509 8.2568 8.2568 9.8683 9.8683 10.3574 10.3574 11.0944 11.0944 11.1441 11.1441 12.3489 12.3489 k = 0.5000 0.2887 0.1953 ( 5504 PWs) bands (ev): -32.2045 -32.2045 -32.2023 -32.2023 -13.4950 -13.4950 -13.4857 -13.4857 -13.1326 -13.1326 -13.1162 -13.1162 -13.1046 -13.1046 -13.1035 -13.1035 -1.6666 -1.6666 -1.6233 -1.6233 3.4308 3.4308 3.5473 3.5473 3.8693 3.8693 3.9432 3.9432 4.0201 4.0201 4.1422 4.1422 5.0013 5.0013 5.0761 5.0761 5.4058 5.4058 5.4806 5.4806 5.5062 5.5062 5.5917 5.5917 7.0832 7.0832 7.4747 7.4747 7.6202 7.6202 8.2772 8.2772 9.8311 9.8311 10.3186 10.3186 11.1814 11.1814 11.2500 11.2500 12.3403 12.3403 k = 0.5000 0.2887 0.1803 ( 5492 PWs) bands (ev): -32.2046 -32.2046 -32.2021 -32.2021 -13.4956 -13.4956 -13.4852 -13.4852 -13.1339 -13.1339 -13.1160 -13.1160 -13.1043 -13.1043 -13.1025 -13.1025 -1.6697 -1.6697 -1.6210 -1.6210 3.4269 3.4269 3.5563 3.5563 3.8683 3.8683 3.9493 3.9493 4.0179 4.0179 4.1569 4.1569 4.9963 4.9963 5.0834 5.0834 5.4019 5.4019 5.4792 5.4792 5.5080 5.5080 5.5973 5.5973 7.0230 7.0230 7.4729 7.4729 7.5971 7.5971 8.2876 8.2876 9.8069 9.8069 10.2831 10.2831 11.2567 11.2567 11.3640 11.3640 12.3349 12.3349 k = 0.5000 0.2887 0.1653 ( 5500 PWs) bands (ev): -32.2047 -32.2047 -32.2020 -32.2020 -13.4963 -13.4963 -13.4847 -13.4847 -13.1351 -13.1351 -13.1160 -13.1160 -13.1039 -13.1039 -13.1015 -13.1015 -1.6727 -1.6727 -1.6190 -1.6190 3.4237 3.4237 3.5646 3.5646 3.8680 3.8680 3.9540 3.9540 4.0173 4.0173 4.1722 4.1722 4.9911 4.9911 5.0910 5.0910 5.3983 5.3983 5.4745 5.4745 5.5133 5.5133 5.6027 5.6027 6.9614 6.9614 7.4669 7.4669 7.5808 7.5808 8.2888 8.2888 9.7947 9.7947 10.2514 10.2514 11.3279 11.3279 11.4745 11.4745 12.3334 12.3334 k = 0.5000 0.2887 0.1503 ( 5494 PWs) bands (ev): -32.2048 -32.2048 -32.2019 -32.2019 -13.4969 -13.4969 -13.4843 -13.4843 -13.1363 -13.1363 -13.1159 -13.1159 -13.1036 -13.1036 -13.1005 -13.1005 -1.6756 -1.6756 -1.6170 -1.6170 3.4211 3.4211 3.5723 3.5723 3.8683 3.8683 3.9572 3.9572 4.0184 4.0184 4.1880 4.1880 4.9857 4.9857 5.0988 5.0988 5.3950 5.3950 5.4683 5.4683 5.5203 5.5203 5.6078 5.6078 6.8998 6.8998 7.4577 7.4577 7.5696 7.5696 8.2823 8.2823 9.7922 9.7922 10.2242 10.2242 11.3961 11.3961 11.5765 11.5765 12.3355 12.3355 k = 0.5000 0.2887 0.1352 ( 5478 PWs) bands (ev): -32.2049 -32.2049 -32.2018 -32.2018 -13.4974 -13.4974 -13.4838 -13.4838 -13.1373 -13.1373 -13.1160 -13.1160 -13.1033 -13.1033 -13.0994 -13.0994 -1.6782 -1.6782 -1.6153 -1.6153 3.4190 3.4190 3.5791 3.5791 3.8690 3.8690 3.9587 3.9587 4.0212 4.0212 4.2041 4.2041 4.9802 4.9802 5.1067 5.1067 5.3920 5.3920 5.4617 5.4617 5.5282 5.5282 5.6126 5.6126 6.8395 6.8395 7.4468 7.4468 7.5617 7.5617 8.2700 8.2700 9.7971 9.7971 10.2019 10.2019 11.4611 11.4611 11.6663 11.6663 12.3394 12.3394 k = 0.5000 0.2887 0.1202 ( 5500 PWs) bands (ev): -32.2051 -32.2051 -32.2017 -32.2017 -13.4980 -13.4980 -13.4835 -13.4835 -13.1383 -13.1383 -13.1161 -13.1161 -13.1031 -13.1031 -13.0985 -13.0985 -1.6807 -1.6807 -1.6139 -1.6139 3.4173 3.4173 3.5852 3.5852 3.8701 3.8701 3.9589 3.9589 4.0252 4.0252 4.2202 4.2202 4.9746 4.9746 5.1146 5.1146 5.3892 5.3892 5.4550 5.4550 5.5364 5.5364 5.6170 5.6170 6.7817 6.7817 7.4355 7.4355 7.5553 7.5553 8.2540 8.2540 9.8065 9.8065 10.1849 10.1849 11.5219 11.5219 11.7414 11.7414 12.3423 12.3423 k = 0.5000 0.2887 0.1052 ( 5506 PWs) bands (ev): -32.2052 -32.2052 -32.2016 -32.2016 -13.4984 -13.4984 -13.4832 -13.4832 -13.1392 -13.1392 -13.1162 -13.1162 -13.1028 -13.1028 -13.0976 -13.0976 -1.6830 -1.6830 -1.6125 -1.6125 3.4161 3.4161 3.5904 3.5904 3.8716 3.8716 3.9580 3.9580 4.0299 4.0299 4.2359 4.2359 4.9691 4.9691 5.1224 5.1224 5.3867 5.3867 5.4485 5.4485 5.5448 5.5448 5.6209 5.6209 6.7275 6.7275 7.4248 7.4248 7.5494 7.5494 8.2362 8.2362 9.8177 9.8177 10.1733 10.1733 11.5777 11.5777 11.8009 11.8009 12.3430 12.3430 k = 0.5000 0.2887 0.0902 ( 5514 PWs) bands (ev): -32.2052 -32.2052 -32.2015 -32.2015 -13.4989 -13.4989 -13.4830 -13.4830 -13.1400 -13.1400 -13.1163 -13.1163 -13.1026 -13.1026 -13.0968 -13.0968 -1.6850 -1.6850 -1.6114 -1.6114 3.4152 3.4152 3.5948 3.5948 3.8732 3.8732 3.9565 3.9565 4.0348 4.0348 4.2509 4.2509 4.9637 4.9637 5.1298 5.1298 5.3845 5.3845 5.4425 5.4425 5.5531 5.5531 5.6243 5.6243 6.6780 6.6780 7.4152 7.4152 7.5437 7.5437 8.2182 8.2182 9.8285 9.8285 10.1670 10.1670 11.6276 11.6276 11.8461 11.8461 12.3423 12.3423 k = 0.5000 0.2887 0.0751 ( 5510 PWs) bands (ev): -32.2053 -32.2053 -32.2014 -32.2014 -13.4992 -13.4992 -13.4827 -13.4827 -13.1406 -13.1406 -13.1164 -13.1164 -13.1024 -13.1024 -13.0961 -13.0961 -1.6867 -1.6867 -1.6104 -1.6104 3.4145 3.4145 3.5985 3.5985 3.8749 3.8749 3.9548 3.9548 4.0395 4.0395 4.2647 4.2647 4.9587 4.9587 5.1366 5.1366 5.3825 5.3825 5.4370 5.4370 5.5611 5.5611 5.6272 5.6272 6.6340 6.6340 7.4068 7.4068 7.5381 7.5381 8.2014 8.2014 9.8377 9.8377 10.1655 10.1655 11.6707 11.6707 11.8796 11.8796 12.3407 12.3407 k = 0.5000 0.2887 0.0601 ( 5506 PWs) bands (ev): -32.2054 -32.2054 -32.2014 -32.2014 -13.4995 -13.4995 -13.4825 -13.4825 -13.1411 -13.1411 -13.1165 -13.1165 -13.1023 -13.1023 -13.0955 -13.0955 -1.6881 -1.6881 -1.6096 -1.6096 3.4141 3.4141 3.6014 3.6014 3.8766 3.8766 3.9530 3.9530 4.0438 4.0438 4.2768 4.2768 4.9542 4.9542 5.1426 5.1426 5.3807 5.3807 5.4323 5.4323 5.5684 5.5684 5.6294 5.6294 6.5965 6.5965 7.3999 7.3999 7.5329 7.5329 8.1868 8.1868 9.8444 9.8444 10.1674 10.1674 11.7061 11.7061 11.9044 11.9044 12.3391 12.3391 k = 0.5000 0.2887 0.0451 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2013 -32.2013 -13.4997 -13.4997 -13.4824 -13.4824 -13.1415 -13.1415 -13.1166 -13.1166 -13.1021 -13.1021 -13.0950 -13.0950 -1.6892 -1.6892 -1.6090 -1.6090 3.4138 3.4138 3.6036 3.6036 3.8781 3.8781 3.9514 3.9514 4.0473 4.0473 4.2868 4.2868 4.9504 4.9504 5.1477 5.1477 5.3793 5.3793 5.4285 5.4285 5.5747 5.5747 5.6311 5.6311 6.5664 6.5664 7.3945 7.3945 7.5283 7.5283 8.1749 8.1749 9.8490 9.8490 10.1713 10.1713 11.7334 11.7334 11.9225 11.9225 12.3376 12.3376 k = 0.5000 0.2887 0.0301 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2013 -32.2013 -13.4999 -13.4999 -13.4823 -13.4823 -13.1418 -13.1418 -13.1166 -13.1166 -13.1021 -13.1021 -13.0946 -13.0946 -1.6900 -1.6900 -1.6086 -1.6086 3.4136 3.4136 3.6051 3.6051 3.8792 3.8792 3.9502 3.9502 4.0499 4.0499 4.2943 4.2943 4.9476 4.9476 5.1514 5.1514 5.3782 5.3782 5.4257 5.4257 5.5796 5.5796 5.6321 5.6321 6.5442 6.5442 7.3906 7.3906 7.5246 7.5246 8.1662 8.1662 9.8516 9.8516 10.1754 10.1754 11.7527 11.7527 11.9354 11.9354 12.3364 12.3364 k = 0.5000 0.2887 0.0150 ( 5504 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5000 -13.5000 -13.4822 -13.4822 -13.1420 -13.1420 -13.1167 -13.1167 -13.1020 -13.1020 -13.0944 -13.0944 -1.6905 -1.6905 -1.6083 -1.6083 3.4135 3.4135 3.6061 3.6061 3.8800 3.8800 3.9494 3.9494 4.0515 4.0515 4.2989 4.2989 4.9458 4.9458 5.1537 5.1537 5.3776 5.3776 5.4240 5.4240 5.5828 5.5828 5.6327 5.6327 6.5307 6.5307 7.3883 7.3883 7.5223 7.5223 8.1609 8.1609 9.8530 9.8530 10.1785 10.1785 11.7640 11.7640 11.9431 11.9431 12.3357 12.3357 k = 0.5000 0.2887-0.0000 ( 5510 PWs) bands (ev): -32.2055 -32.2055 -32.2013 -32.2013 -13.5001 -13.5001 -13.4822 -13.4822 -13.1421 -13.1421 -13.1167 -13.1167 -13.1020 -13.1020 -13.0944 -13.0944 -1.6907 -1.6907 -1.6083 -1.6083 3.4135 3.4135 3.6064 3.6064 3.8802 3.8802 3.9491 3.9491 4.0520 4.0520 4.3005 4.3005 4.9451 4.9451 5.1545 5.1545 5.3773 5.3773 5.4235 5.4235 5.5839 5.5839 5.6329 5.6329 6.5262 6.5262 7.3875 7.3875 7.5215 7.5215 8.1591 8.1591 9.8534 9.8534 10.1796 10.1796 11.7677 11.7677 11.9457 11.9457 12.3355 12.3355 k = 0.3333 0.5774-0.0000 ( 5502 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5005 -13.5005 -13.4829 -13.4829 -13.1413 -13.1413 -13.1179 -13.1178 -13.1034 -13.1033 -13.0967 -13.0967 -1.6041 -1.5859 -1.5770 -1.5770 3.6044 3.7107 3.7107 3.8194 3.8734 3.8734 4.0247 4.0377 4.0377 4.0780 4.3628 4.3628 4.5268 4.5268 5.0542 5.2057 5.2057 5.3572 5.3572 5.4669 5.4746 5.4746 5.6201 5.8727 5.8803 5.8803 7.1171 7.1171 7.3618 7.4981 7.7797 7.7797 10.4994 11.0233 11.1209 11.1209 11.5520 11.5520 11.8346 11.8346 11.8518 12.1118 k = 0.3333 0.5774 0.0150 ( 5505 PWs) bands (ev): -32.2054 -32.2054 -32.2011 -32.2011 -13.5005 -13.5005 -13.4829 -13.4829 -13.1412 -13.1412 -13.1179 -13.1178 -13.1035 -13.1034 -13.0967 -13.0967 -1.6041 -1.5859 -1.5770 -1.5770 3.6043 3.7108 3.7108 3.8186 3.8731 3.8731 4.0241 4.0372 4.0372 4.0774 4.3608 4.3608 4.5284 4.5284 5.0551 5.2060 5.2060 5.3571 5.3571 5.4653 5.4746 5.4746 5.6217 5.8724 5.8821 5.8821 7.1161 7.1161 7.3647 7.5007 7.7808 7.7808 10.4986 11.0212 11.1182 11.1182 11.5535 11.5535 11.8375 11.8375 11.8511 12.1120 k = 0.3333 0.5774 0.0301 ( 5499 PWs) bands (ev): -32.2053 -32.2053 -32.2012 -32.2012 -13.5003 -13.5003 -13.4830 -13.4830 -13.1410 -13.1410 -13.1178 -13.1177 -13.1035 -13.1034 -13.0970 -13.0970 -1.6039 -1.5859 -1.5768 -1.5768 3.6041 3.7112 3.7112 3.8164 3.8722 3.8722 4.0223 4.0359 4.0359 4.0754 4.3551 4.3551 4.5327 4.5327 5.0577 5.2069 5.2069 5.3568 5.3568 5.4609 5.4745 5.4745 5.6264 5.8716 5.8873 5.8873 7.1131 7.1131 7.3734 7.5084 7.7845 7.7845 10.4960 11.0146 11.1102 11.1102 11.5582 11.5582 11.8462 11.8462 11.8494 12.1127 k = 0.3333 0.5774 0.0451 ( 5493 PWs) bands (ev): -32.2053 -32.2053 -32.2012 -32.2012 -13.5001 -13.5001 -13.4831 -13.4831 -13.1407 -13.1407 -13.1178 -13.1177 -13.1036 -13.1035 -13.0973 -13.0973 -1.6035 -1.5858 -1.5766 -1.5766 3.6037 3.7118 3.7118 3.8126 3.8707 3.8707 4.0194 4.0337 4.0337 4.0723 4.3463 4.3463 4.5392 4.5392 5.0620 5.2083 5.2083 5.3561 5.3561 5.4541 5.4745 5.4745 5.6336 5.8703 5.8960 5.8960 7.1077 7.1077 7.3877 7.5212 7.7909 7.7909 10.4916 11.0036 11.0968 11.0968 11.5659 11.5659 11.8465 11.8602 11.8602 12.1139 k = 0.3333 0.5774 0.0601 ( 5502 PWs) bands (ev): -32.2053 -32.2053 -32.2012 -32.2012 -13.5000 -13.5000 -13.4832 -13.4832 -13.1403 -13.1403 -13.1176 -13.1176 -13.1037 -13.1036 -13.0978 -13.0978 -1.6031 -1.5858 -1.5764 -1.5764 3.6033 3.7127 3.7127 3.8074 3.8685 3.8685 4.0157 4.0307 4.0307 4.0680 4.3354 4.3354 4.5472 4.5472 5.0679 5.2102 5.2102 5.3552 5.3552 5.4455 5.4746 5.4746 5.6426 5.8685 5.9081 5.9081 7.0994 7.0994 7.4074 7.5387 7.8007 7.8007 10.4855 10.9881 11.0781 11.0781 11.5767 11.5767 11.8428 11.8793 11.8793 12.1157 k = 0.3333 0.5774 0.0751 ( 5496 PWs) bands (ev): -32.2052 -32.2052 -32.2013 -32.2013 -13.4997 -13.4997 -13.4834 -13.4834 -13.1398 -13.1398 -13.1175 -13.1174 -13.1039 -13.1038 -13.0985 -13.0985 -1.6025 -1.5857 -1.5761 -1.5761 3.6027 3.7138 3.7138 3.8006 3.8657 3.8657 4.0113 4.0270 4.0270 4.0628 4.3231 4.3231 4.5559 4.5559 5.0752 5.2124 5.2124 5.3541 5.3541 5.4357 5.4749 5.4749 5.6529 5.8662 5.9233 5.9233 7.0877 7.0877 7.4321 7.5607 7.8142 7.8142 10.4778 10.9681 11.0541 11.0541 11.5906 11.5906 11.8386 11.9027 11.9027 12.1183 k = 0.3333 0.5774 0.0902 ( 5499 PWs) bands (ev): -32.2051 -32.2051 -32.2014 -32.2014 -13.4994 -13.4994 -13.4836 -13.4836 -13.1391 -13.1391 -13.1173 -13.1172 -13.1041 -13.1040 -13.0993 -13.0993 -1.6019 -1.5856 -1.5757 -1.5757 3.6021 3.7152 3.7152 3.7925 3.8623 3.8623 4.0066 4.0228 4.0228 4.0567 4.3102 4.3102 4.5649 4.5649 5.0837 5.2149 5.2149 5.3527 5.3527 5.4250 5.4754 5.4754 5.6639 5.8635 5.9417 5.9417 7.0722 7.0722 7.4615 7.5868 7.8318 7.8318 10.4685 10.9436 11.0252 11.0252 11.6073 11.6073 11.8340 11.9297 11.9297 12.1219 k = 0.3333 0.5774 0.1052 ( 5514 PWs) bands (ev): -32.2051 -32.2051 -32.2015 -32.2015 -13.4990 -13.4990 -13.4839 -13.4839 -13.1384 -13.1384 -13.1171 -13.1170 -13.1043 -13.1042 -13.1003 -13.1003 -1.6011 -1.5856 -1.5753 -1.5753 3.6015 3.7167 3.7167 3.7829 3.8581 3.8581 4.0017 4.0182 4.0182 4.0501 4.2970 4.2970 4.5738 4.5738 5.0933 5.2176 5.2176 5.3510 5.3510 5.4138 5.4762 5.4762 5.6753 5.8604 5.9630 5.9630 7.0524 7.0524 7.4949 7.6163 7.8539 7.8539 10.4577 10.9146 10.9915 10.9915 11.6268 11.6268 11.8295 11.9592 11.9592 12.1062 k = 0.3333 0.5774 0.1202 ( 5496 PWs) bands (ev): -32.2050 -32.2050 -32.2015 -32.2015 -13.4986 -13.4986 -13.4841 -13.4841 -13.1375 -13.1375 -13.1168 -13.1167 -13.1045 -13.1045 -13.1013 -13.1013 -1.6002 -1.5855 -1.5748 -1.5748 3.6010 3.7186 3.7186 3.7723 3.8533 3.8533 3.9969 4.0134 4.0134 4.0430 4.2841 4.2841 4.5825 4.5825 5.1039 5.2204 5.2204 5.3491 5.3491 5.4023 5.4773 5.4773 5.6867 5.8570 5.9872 5.9872 7.0283 7.0283 7.5318 7.6488 7.8804 7.8804 10.4457 10.8815 10.9537 10.9537 11.6490 11.6490 11.8254 11.9898 11.9898 12.0889 k = 0.3333 0.5774 0.1352 ( 5496 PWs) bands (ev): -32.2048 -32.2048 -32.2017 -32.2017 -13.4981 -13.4981 -13.4844 -13.4844 -13.1365 -13.1365 -13.1165 -13.1164 -13.1048 -13.1048 -13.1024 -13.1024 -1.5993 -1.5854 -1.5743 -1.5743 3.6007 3.7206 3.7206 3.7606 3.8479 3.8479 3.9923 4.0084 4.0084 4.0357 4.2716 4.2716 4.5906 4.5906 5.1151 5.2232 5.2232 5.3470 5.3470 5.3905 5.4787 5.4787 5.6981 5.8533 6.0140 6.0140 7.0000 7.0000 7.5716 7.6835 7.9108 7.9108 10.4327 10.8444 10.9122 10.9122 11.6736 11.6736 11.8219 12.0201 12.0201 12.0703 k = 0.3333 0.5774 0.1503 ( 5487 PWs) bands (ev): -32.2047 -32.2047 -32.2018 -32.2018 -13.4976 -13.4976 -13.4847 -13.4847 -13.1354 -13.1354 -13.1162 -13.1162 -13.1051 -13.1050 -13.1037 -13.1037 -1.5983 -1.5854 -1.5738 -1.5738 3.6005 3.7228 3.7228 3.7481 3.8419 3.8419 3.9882 4.0035 4.0035 4.0283 4.2600 4.2600 4.5982 4.5982 5.1269 5.2259 5.2259 5.3449 5.3449 5.3787 5.4803 5.4803 5.7092 5.8493 6.0433 6.0433 6.9677 6.9677 7.6134 7.7196 7.9447 7.9447 10.4190 10.8038 10.8680 10.8680 11.7004 11.7004 11.8193 12.0485 12.0485 12.0506 k = 0.3333 0.5774 0.1653 ( 5493 PWs) bands (ev): -32.2046 -32.2046 -32.2019 -32.2019 -13.4970 -13.4970 -13.4851 -13.4851 -13.1342 -13.1342 -13.1160 -13.1159 -13.1054 -13.1053 -13.1051 -13.1051 -1.5973 -1.5854 -1.5733 -1.5733 3.6006 3.7253 3.7253 3.7351 3.8354 3.8354 3.9845 3.9988 3.9988 4.0211 4.2492 4.2492 4.6051 4.6051 5.1392 5.2285 5.2285 5.3427 5.3427 5.3667 5.4820 5.4820 5.7200 5.8450 6.0748 6.0748 6.9320 6.9320 7.6564 7.7562 7.9812 7.9812 10.4052 10.7603 10.8219 10.8219 11.7292 11.7292 11.8177 12.0302 12.0732 12.0732 k = 0.3333 0.5774 0.1803 ( 5502 PWs) bands (ev): -32.2045 -32.2045 -32.2020 -32.2020 -13.4965 -13.4965 -13.4855 -13.4855 -13.1330 -13.1330 -13.1157 -13.1156 -13.1065 -13.1065 -13.1057 -13.1056 -1.5963 -1.5855 -1.5728 -1.5728 3.6012 3.7218 3.7279 3.7279 3.8286 3.8286 3.9814 3.9944 3.9944 4.0141 4.2394 4.2394 4.6113 4.6113 5.1518 5.2309 5.2309 5.3405 5.3405 5.3546 5.4838 5.4838 5.7303 5.8406 6.1084 6.1084 6.8935 6.8935 7.6998 7.7923 8.0191 8.0191 10.3918 10.7148 10.7752 10.7752 11.7597 11.7597 11.8175 12.0096 12.0932 12.0932 k = 0.3333 0.5774 0.1953 ( 5502 PWs) bands (ev): -32.2044 -32.2044 -32.2022 -32.2022 -13.4959 -13.4959 -13.4860 -13.4860 -13.1316 -13.1316 -13.1154 -13.1153 -13.1081 -13.1081 -13.1060 -13.1059 -1.5952 -1.5857 -1.5724 -1.5724 3.6022 3.7085 3.7307 3.7307 3.8215 3.8215 3.9788 3.9905 3.9905 4.0075 4.2307 4.2307 4.6169 4.6169 5.1646 5.2331 5.2331 5.3384 5.3384 5.3425 5.4855 5.4855 5.7402 5.8359 6.1438 6.1438 6.8527 6.8527 7.7425 7.8269 8.0573 8.0573 10.3797 10.6681 10.7289 10.7289 11.7915 11.7915 11.8186 11.9890 12.1080 12.1080 k = 0.3333 0.5774 0.2104 ( 5502 PWs) bands (ev): -32.2042 -32.2042 -32.2023 -32.2023 -13.4953 -13.4953 -13.4864 -13.4864 -13.1302 -13.1302 -13.1151 -13.1150 -13.1097 -13.1097 -13.1063 -13.1062 -1.5942 -1.5859 -1.5719 -1.5719 3.6039 3.6954 3.7337 3.7337 3.8144 3.8144 3.9768 3.9870 3.9870 4.0014 4.2231 4.2231 4.6217 4.6217 5.1776 5.2350 5.2350 5.3303 5.3365 5.3365 5.4872 5.4872 5.7496 5.8310 6.1804 6.1804 6.8105 6.8105 7.7836 7.8588 8.0945 8.0945 10.3696 10.6213 10.6846 10.6846 11.8212 11.8242 11.8242 11.9687 12.1177 12.1177 k = 0.3333 0.5774 0.2254 ( 5514 PWs) bands (ev): -32.2041 -32.2041 -32.2025 -32.2025 -13.4947 -13.4947 -13.4869 -13.4869 -13.1287 -13.1287 -13.1148 -13.1147 -13.1113 -13.1113 -13.1066 -13.1066 -1.5932 -1.5862 -1.5716 -1.5716 3.6063 3.6828 3.7368 3.7368 3.8075 3.8075 3.9753 3.9840 3.9840 3.9958 4.2167 4.2167 4.6257 4.6257 5.1906 5.2366 5.2366 5.3180 5.3348 5.3348 5.4887 5.4887 5.7585 5.8259 6.2178 6.2178 6.7679 6.7679 7.8220 7.8870 8.1292 8.1292 10.3625 10.5755 10.6437 10.6437 11.8252 11.8570 11.8570 11.9492 12.1226 12.1226 k = 0.3333 0.5774 0.2404 ( 5499 PWs) bands (ev): -32.2039 -32.2039 -32.2026 -32.2026 -13.4941 -13.4941 -13.4873 -13.4873 -13.1271 -13.1271 -13.1145 -13.1144 -13.1130 -13.1130 -13.1069 -13.1068 -1.5921 -1.5865 -1.5712 -1.5712 3.6094 3.6708 3.7399 3.7399 3.8011 3.8011 3.9745 3.9815 3.9815 3.9908 4.2114 4.2114 4.6291 4.6291 5.2037 5.2379 5.2379 5.3057 5.3334 5.3334 5.4901 5.4901 5.7670 5.8206 6.2551 6.2551 6.7259 6.7259 7.8567 7.9104 8.1602 8.1602 10.3592 10.5319 10.6075 10.6075 11.8309 11.8894 11.8894 11.9306 12.1227 12.1227 k = 0.3333 0.5774 0.2554 ( 5493 PWs) bands (ev): -32.2037 -32.2037 -32.2028 -32.2028 -13.4936 -13.4936 -13.4878 -13.4878 -13.1256 -13.1256 -13.1146 -13.1146 -13.1142 -13.1142 -13.1071 -13.1070 -1.5912 -1.5869 -1.5709 -1.5709 3.6135 3.6597 3.7429 3.7429 3.7953 3.7953 3.9743 3.9796 3.9796 3.9865 4.2073 4.2073 4.6317 4.6317 5.2167 5.2390 5.2390 5.2933 5.3322 5.3322 5.4912 5.4912 5.7750 5.8150 6.2907 6.2907 6.6863 6.6863 7.8867 7.9280 8.1859 8.1859 10.3606 10.4915 10.5776 10.5776 11.8380 11.9131 11.9200 11.9200 12.1180 12.1180 k = 0.3333 0.5774 0.2705 ( 5502 PWs) bands (ev): -32.2036 -32.2036 -32.2029 -32.2029 -13.4932 -13.4932 -13.4882 -13.4882 -13.1240 -13.1240 -13.1163 -13.1163 -13.1141 -13.1140 -13.1073 -13.1072 -1.5903 -1.5874 -1.5708 -1.5708 3.6186 3.6494 3.7456 3.7456 3.7905 3.7905 3.9747 3.9782 3.9782 3.9828 4.2044 4.2044 4.6335 4.6335 5.2297 5.2398 5.2398 5.2807 5.3314 5.3314 5.4920 5.4920 5.7826 5.8091 6.3221 6.3221 6.6520 6.6520 7.9109 7.9390 8.2053 8.2053 10.3674 10.4554 10.5552 10.5552 11.8467 11.8969 11.9469 11.9469 12.1097 12.1097 k = 0.3333 0.5774 0.2855 ( 5496 PWs) bands (ev): -32.2034 -32.2034 -32.2031 -32.2031 -13.4929 -13.4929 -13.4884 -13.4884 -13.1225 -13.1225 -13.1178 -13.1178 -13.1139 -13.1139 -13.1074 -13.1073 -1.5895 -1.5880 -1.5706 -1.5706 3.6247 3.6401 3.7476 3.7476 3.7873 3.7873 3.9758 3.9773 3.9773 3.9798 4.2027 4.2027 4.6346 4.6346 5.2402 5.2402 5.2426 5.2681 5.3309 5.3309 5.4924 5.4924 5.7897 5.8030 6.3450 6.3450 6.6273 6.6273 7.9287 7.9429 8.2173 8.2173 10.3802 10.4244 10.5414 10.5414 11.8570 11.8821 11.9668 11.9668 12.1011 12.1011 k = 0.3333 0.5774 0.3005 ( 5496 PWs) bands (ev): -32.2033 -32.2033 -32.2032 -32.2032 -13.4927 -13.4927 -13.4885 -13.4885 -13.1217 -13.1217 -13.1186 -13.1186 -13.1139 -13.1139 -13.1074 -13.1074 -1.5887 -1.5887 -1.5706 -1.5706 3.6319 3.6319 3.7483 3.7483 3.7861 3.7861 3.9771 3.9771 3.9775 3.9775 4.2021 4.2021 4.6350 4.6350 5.2404 5.2404 5.2554 5.2554 5.3307 5.3307 5.4926 5.4926 5.7965 5.7965 6.3537 6.3537 6.6180 6.6180 7.9395 7.9395 8.2214 8.2214 10.3993 10.3993 10.5367 10.5367 11.8688 11.8688 11.9744 11.9744 12.0971 12.0971 Writing output data file CaBiAu.save init_run : 4.74s CPU 14.23s WALL ( 1 calls) electrons : 2012.18s CPU 2026.27s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.51s CPU 1.52s WALL ( 1 calls) Called by electrons: c_bands : 2012.14s CPU 2025.91s WALL ( 1 calls) v_of_rho : 0.15s CPU 0.96s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.13s CPU 0.58s WALL ( 1 calls) newd : 0.81s CPU 0.89s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.13s WALL ( 283 calls) cegterg : 1950.85s CPU 1961.62s WALL ( 1571 calls) Called by sum_band: Called by *egterg: h_psi : 748.23s CPU 766.38s WALL ( 32350 calls) s_psi : 80.19s CPU 81.35s WALL ( 32350 calls) g_psi : 1.90s CPU 1.92s WALL ( 30496 calls) cdiaghg : 820.81s CPU 813.86s WALL ( 30779 calls) cegterg:over : 156.76s CPU 150.14s WALL ( 30496 calls) cegterg:upda : 41.75s CPU 50.72s WALL ( 30496 calls) cegterg:last : 30.08s CPU 31.32s WALL ( 3552 calls) Called by h_psi: h_psi:vloc : 576.57s CPU 592.21s WALL ( 32350 calls) h_psi:vnl : 170.80s CPU 171.93s WALL ( 32350 calls) add_vuspsi : 60.69s CPU 71.09s WALL ( 32350 calls) General routines calbec : 109.96s CPU 100.61s WALL ( 32350 calls) fft : 0.36s CPU 1.51s WALL ( 19 calls) ffts : 0.05s CPU 0.05s WALL ( 4 calls) fftw : 529.09s CPU 543.38s WALL ( 2576908 calls) interpolate : 0.08s CPU 0.08s WALL ( 4 calls) davcio : 0.02s CPU 1.81s WALL ( 566 calls) Parallel routines fft_scatter : 346.96s CPU 349.11s WALL ( 2576931 calls) PWSCF : 34m38.23s CPU 36m57.63s WALL This run was terminated on: 22:43:53 13Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=