Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 8:37:16 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./SbCl5.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 45 34 9 2249 1486 215 Max 46 35 10 2258 1504 222 Sum 3259 2491 685 162141 107651 15731 bravais-lattice index = 14 lattice parameter (alat) = 14.0112 a.u. unit-cell volume = 2550.9687 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.011184 celldm(2)= 1.000000 celldm(3)= 1.070903 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 1.070903 ) 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 0.933792 ) PseudoPot. # 1 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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 Cl 7.00 35.45300 Cl( 1.00) Sb 5.00 121.76000 Sb( 1.00) 12 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( -1 -1 0 ) ( 0 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 = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 0 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 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 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. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 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 D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 207 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 2) = ( 0.0200000 0.0115470 -0.0000000), wk = 0.0048309 k( 3) = ( 0.0400000 0.0230940 -0.0000000), wk = 0.0048309 k( 4) = ( 0.0600000 0.0346410 -0.0000000), wk = 0.0048309 k( 5) = ( 0.0800000 0.0461880 -0.0000000), wk = 0.0048309 k( 6) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0048309 k( 7) = ( 0.1200000 0.0692820 -0.0000000), wk = 0.0048309 k( 8) = ( 0.1400000 0.0808290 -0.0000000), wk = 0.0048309 k( 9) = ( 0.1600000 0.0923760 -0.0000000), wk = 0.0048309 k( 10) = ( 0.1800000 0.1039230 -0.0000000), wk = 0.0048309 k( 11) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0048309 k( 12) = ( 0.2200000 0.1270171 -0.0000000), wk = 0.0048309 k( 13) = ( 0.2400000 0.1385641 -0.0000000), wk = 0.0048309 k( 14) = ( 0.2600000 0.1501111 -0.0000000), wk = 0.0048309 k( 15) = ( 0.2800000 0.1616581 -0.0000000), wk = 0.0048309 k( 16) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0048309 k( 17) = ( 0.3200000 0.1847521 -0.0000000), wk = 0.0048309 k( 18) = ( 0.3400000 0.1962991 -0.0000000), wk = 0.0048309 k( 19) = ( 0.3600000 0.2078461 -0.0000000), wk = 0.0048309 k( 20) = ( 0.3800000 0.2193931 -0.0000000), wk = 0.0048309 k( 21) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0048309 k( 22) = ( 0.4200000 0.2424871 -0.0000000), wk = 0.0048309 k( 23) = ( 0.4400000 0.2540341 -0.0000000), wk = 0.0048309 k( 24) = ( 0.4600000 0.2655811 -0.0000000), wk = 0.0048309 k( 25) = ( 0.4800000 0.2771281 -0.0000000), wk = 0.0048309 k( 26) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0048309 k( 27) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0048309 k( 28) = ( 0.4888889 0.3079201 -0.0000000), wk = 0.0048309 k( 29) = ( 0.4777778 0.3271651 -0.0000000), wk = 0.0048309 k( 30) = ( 0.4666667 0.3464102 -0.0000000), wk = 0.0048309 k( 31) = ( 0.4555556 0.3656552 -0.0000000), wk = 0.0048309 k( 32) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0048309 k( 33) = ( 0.4333333 0.4041452 -0.0000000), wk = 0.0048309 k( 34) = ( 0.4222222 0.4233902 -0.0000000), wk = 0.0048309 k( 35) = ( 0.4111111 0.4426352 -0.0000000), wk = 0.0048309 k( 36) = ( 0.4000000 0.4618802 -0.0000000), wk = 0.0048309 k( 37) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0048309 k( 38) = ( 0.3777778 0.5003702 -0.0000000), wk = 0.0048309 k( 39) = ( 0.3666667 0.5196152 -0.0000000), wk = 0.0048309 k( 40) = ( 0.3555556 0.5388603 -0.0000000), wk = 0.0048309 k( 41) = ( 0.3444444 0.5581053 -0.0000000), wk = 0.0048309 k( 42) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0048309 k( 43) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0048309 k( 44) = ( 0.3218391 0.5574416 -0.0000000), wk = 0.0048309 k( 45) = ( 0.3103448 0.5375330 -0.0000000), wk = 0.0048309 k( 46) = ( 0.2988506 0.5176244 -0.0000000), wk = 0.0048309 k( 47) = ( 0.2873563 0.4977157 -0.0000000), wk = 0.0048309 k( 48) = ( 0.2758621 0.4778071 -0.0000000), wk = 0.0048309 k( 49) = ( 0.2643678 0.4578985 -0.0000000), wk = 0.0048309 k( 50) = ( 0.2528736 0.4379899 -0.0000000), wk = 0.0048309 k( 51) = ( 0.2413793 0.4180812 -0.0000000), wk = 0.0048309 k( 52) = ( 0.2298851 0.3981726 -0.0000000), wk = 0.0048309 k( 53) = ( 0.2183908 0.3782640 -0.0000000), wk = 0.0048309 k( 54) = ( 0.2068966 0.3583553 -0.0000000), wk = 0.0048309 k( 55) = ( 0.1954023 0.3384467 -0.0000000), wk = 0.0048309 k( 56) = ( 0.1839080 0.3185381 -0.0000000), wk = 0.0048309 k( 57) = ( 0.1724138 0.2986294 -0.0000000), wk = 0.0048309 k( 58) = ( 0.1609195 0.2787208 -0.0000000), wk = 0.0048309 k( 59) = ( 0.1494253 0.2588122 -0.0000000), wk = 0.0048309 k( 60) = ( 0.1379310 0.2389036 -0.0000000), wk = 0.0048309 k( 61) = ( 0.1264368 0.2189949 -0.0000000), wk = 0.0048309 k( 62) = ( 0.1149425 0.1990863 -0.0000000), wk = 0.0048309 k( 63) = ( 0.1034483 0.1791777 -0.0000000), wk = 0.0048309 k( 64) = ( 0.0919540 0.1592690 -0.0000000), wk = 0.0048309 k( 65) = ( 0.0804598 0.1393604 -0.0000000), wk = 0.0048309 k( 66) = ( 0.0689655 0.1194518 -0.0000000), wk = 0.0048309 k( 67) = ( 0.0574713 0.0995431 -0.0000000), wk = 0.0048309 k( 68) = ( 0.0459770 0.0796345 -0.0000000), wk = 0.0048309 k( 69) = ( 0.0344828 0.0597259 -0.0000000), wk = 0.0048309 k( 70) = ( 0.0229885 0.0398173 -0.0000000), wk = 0.0048309 k( 71) = ( 0.0114942 0.0199086 -0.0000000), wk = 0.0048309 k( 72) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 73) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 74) = ( 0.0000000 0.0000000 0.0233448), wk = 0.0048309 k( 75) = ( 0.0000000 0.0000000 0.0466896), wk = 0.0048309 k( 76) = ( 0.0000000 0.0000000 0.0700344), wk = 0.0048309 k( 77) = ( 0.0000000 0.0000000 0.0933792), wk = 0.0048309 k( 78) = ( 0.0000000 0.0000000 0.1167240), wk = 0.0048309 k( 79) = ( 0.0000000 0.0000000 0.1400688), wk = 0.0048309 k( 80) = ( 0.0000000 0.0000000 0.1634136), wk = 0.0048309 k( 81) = ( 0.0000000 0.0000000 0.1867584), wk = 0.0048309 k( 82) = ( 0.0000000 0.0000000 0.2101031), wk = 0.0048309 k( 83) = ( 0.0000000 0.0000000 0.2334479), wk = 0.0048309 k( 84) = ( 0.0000000 0.0000000 0.2567927), wk = 0.0048309 k( 85) = ( 0.0000000 0.0000000 0.2801375), wk = 0.0048309 k( 86) = ( 0.0000000 0.0000000 0.3034823), wk = 0.0048309 k( 87) = ( 0.0000000 0.0000000 0.3268271), wk = 0.0048309 k( 88) = ( 0.0000000 0.0000000 0.3501719), wk = 0.0048309 k( 89) = ( 0.0000000 0.0000000 0.3735167), wk = 0.0048309 k( 90) = ( 0.0000000 0.0000000 0.3968615), wk = 0.0048309 k( 91) = ( 0.0000000 0.0000000 0.4202063), wk = 0.0048309 k( 92) = ( 0.0000000 0.0000000 0.4435511), wk = 0.0048309 k( 93) = ( 0.0000000 0.0000000 0.4668959), wk = 0.0048309 k( 94) = ( 0.0000000 0.0000000 0.4668959), wk = 0.0048309 k( 95) = ( 0.0200000 0.0115470 0.4668959), wk = 0.0048309 k( 96) = ( 0.0400000 0.0230940 0.4668959), wk = 0.0048309 k( 97) = ( 0.0600000 0.0346410 0.4668959), wk = 0.0048309 k( 98) = ( 0.0800000 0.0461880 0.4668959), wk = 0.0048309 k( 99) = ( 0.1000000 0.0577350 0.4668959), wk = 0.0048309 k( 100) = ( 0.1200000 0.0692820 0.4668959), wk = 0.0048309 k( 101) = ( 0.1400000 0.0808290 0.4668959), wk = 0.0048309 k( 102) = ( 0.1600000 0.0923760 0.4668959), wk = 0.0048309 k( 103) = ( 0.1800000 0.1039230 0.4668959), wk = 0.0048309 k( 104) = ( 0.2000000 0.1154701 0.4668959), wk = 0.0048309 k( 105) = ( 0.2200000 0.1270171 0.4668959), wk = 0.0048309 k( 106) = ( 0.2400000 0.1385641 0.4668959), wk = 0.0048309 k( 107) = ( 0.2600000 0.1501111 0.4668959), wk = 0.0048309 k( 108) = ( 0.2800000 0.1616581 0.4668959), wk = 0.0048309 k( 109) = ( 0.3000000 0.1732051 0.4668959), wk = 0.0048309 k( 110) = ( 0.3200000 0.1847521 0.4668959), wk = 0.0048309 k( 111) = ( 0.3400000 0.1962991 0.4668959), wk = 0.0048309 k( 112) = ( 0.3600000 0.2078461 0.4668959), wk = 0.0048309 k( 113) = ( 0.3800000 0.2193931 0.4668959), wk = 0.0048309 k( 114) = ( 0.4000000 0.2309401 0.4668959), wk = 0.0048309 k( 115) = ( 0.4200000 0.2424871 0.4668959), wk = 0.0048309 k( 116) = ( 0.4400000 0.2540341 0.4668959), wk = 0.0048309 k( 117) = ( 0.4600000 0.2655811 0.4668959), wk = 0.0048309 k( 118) = ( 0.4800000 0.2771281 0.4668959), wk = 0.0048309 k( 119) = ( 0.5000000 0.2886751 0.4668959), wk = 0.0048309 k( 120) = ( 0.5000000 0.2886751 0.4668959), wk = 0.0048309 k( 121) = ( 0.4888889 0.3079201 0.4668959), wk = 0.0048309 k( 122) = ( 0.4777778 0.3271651 0.4668959), wk = 0.0048309 k( 123) = ( 0.4666667 0.3464102 0.4668959), wk = 0.0048309 k( 124) = ( 0.4555556 0.3656552 0.4668959), wk = 0.0048309 k( 125) = ( 0.4444444 0.3849002 0.4668959), wk = 0.0048309 k( 126) = ( 0.4333333 0.4041452 0.4668959), wk = 0.0048309 k( 127) = ( 0.4222222 0.4233902 0.4668959), wk = 0.0048309 k( 128) = ( 0.4111111 0.4426352 0.4668959), wk = 0.0048309 k( 129) = ( 0.4000000 0.4618802 0.4668959), wk = 0.0048309 k( 130) = ( 0.3888889 0.4811252 0.4668959), wk = 0.0048309 k( 131) = ( 0.3777778 0.5003702 0.4668959), wk = 0.0048309 k( 132) = ( 0.3666667 0.5196152 0.4668959), wk = 0.0048309 k( 133) = ( 0.3555556 0.5388603 0.4668959), wk = 0.0048309 k( 134) = ( 0.3444444 0.5581053 0.4668959), wk = 0.0048309 k( 135) = ( 0.3333333 0.5773503 0.4668959), wk = 0.0048309 k( 136) = ( 0.3333333 0.5773503 0.4668959), wk = 0.0048309 k( 137) = ( 0.3218391 0.5574416 0.4668959), wk = 0.0048309 k( 138) = ( 0.3103448 0.5375330 0.4668959), wk = 0.0048309 k( 139) = ( 0.2988506 0.5176244 0.4668959), wk = 0.0048309 k( 140) = ( 0.2873563 0.4977157 0.4668959), wk = 0.0048309 k( 141) = ( 0.2758621 0.4778071 0.4668959), wk = 0.0048309 k( 142) = ( 0.2643678 0.4578985 0.4668959), wk = 0.0048309 k( 143) = ( 0.2528736 0.4379899 0.4668959), wk = 0.0048309 k( 144) = ( 0.2413793 0.4180812 0.4668959), wk = 0.0048309 k( 145) = ( 0.2298851 0.3981726 0.4668959), wk = 0.0048309 k( 146) = ( 0.2183908 0.3782640 0.4668959), wk = 0.0048309 k( 147) = ( 0.2068966 0.3583553 0.4668959), wk = 0.0048309 k( 148) = ( 0.1954023 0.3384467 0.4668959), wk = 0.0048309 k( 149) = ( 0.1839080 0.3185381 0.4668959), wk = 0.0048309 k( 150) = ( 0.1724138 0.2986294 0.4668959), wk = 0.0048309 k( 151) = ( 0.1609195 0.2787208 0.4668959), wk = 0.0048309 k( 152) = ( 0.1494253 0.2588122 0.4668959), wk = 0.0048309 k( 153) = ( 0.1379310 0.2389036 0.4668959), wk = 0.0048309 k( 154) = ( 0.1264368 0.2189949 0.4668959), wk = 0.0048309 k( 155) = ( 0.1149425 0.1990863 0.4668959), wk = 0.0048309 k( 156) = ( 0.1034483 0.1791777 0.4668959), wk = 0.0048309 k( 157) = ( 0.0919540 0.1592690 0.4668959), wk = 0.0048309 k( 158) = ( 0.0804598 0.1393604 0.4668959), wk = 0.0048309 k( 159) = ( 0.0689655 0.1194518 0.4668959), wk = 0.0048309 k( 160) = ( 0.0574713 0.0995431 0.4668959), wk = 0.0048309 k( 161) = ( 0.0459770 0.0796345 0.4668959), wk = 0.0048309 k( 162) = ( 0.0344828 0.0597259 0.4668959), wk = 0.0048309 k( 163) = ( 0.0229885 0.0398173 0.4668959), wk = 0.0048309 k( 164) = ( 0.0114942 0.0199086 0.4668959), wk = 0.0048309 k( 165) = ( 0.0000000 0.0000000 0.4668959), wk = 0.0048309 k( 166) = ( 0.5000000 0.2886751 0.4668959), wk = 0.0048309 k( 167) = ( 0.5000000 0.2886751 0.4435511), wk = 0.0048309 k( 168) = ( 0.5000000 0.2886751 0.4202063), wk = 0.0048309 k( 169) = ( 0.5000000 0.2886751 0.3968615), wk = 0.0048309 k( 170) = ( 0.5000000 0.2886751 0.3735167), wk = 0.0048309 k( 171) = ( 0.5000000 0.2886751 0.3501719), wk = 0.0048309 k( 172) = ( 0.5000000 0.2886751 0.3268271), wk = 0.0048309 k( 173) = ( 0.5000000 0.2886751 0.3034823), wk = 0.0048309 k( 174) = ( 0.5000000 0.2886751 0.2801375), wk = 0.0048309 k( 175) = ( 0.5000000 0.2886751 0.2567927), wk = 0.0048309 k( 176) = ( 0.5000000 0.2886751 0.2334479), wk = 0.0048309 k( 177) = ( 0.5000000 0.2886751 0.2101031), wk = 0.0048309 k( 178) = ( 0.5000000 0.2886751 0.1867584), wk = 0.0048309 k( 179) = ( 0.5000000 0.2886751 0.1634136), wk = 0.0048309 k( 180) = ( 0.5000000 0.2886751 0.1400688), wk = 0.0048309 k( 181) = ( 0.5000000 0.2886751 0.1167240), wk = 0.0048309 k( 182) = ( 0.5000000 0.2886751 0.0933792), wk = 0.0048309 k( 183) = ( 0.5000000 0.2886751 0.0700344), wk = 0.0048309 k( 184) = ( 0.5000000 0.2886751 0.0466896), wk = 0.0048309 k( 185) = ( 0.5000000 0.2886751 0.0233448), wk = 0.0048309 k( 186) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0048309 k( 187) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0048309 k( 188) = ( 0.3333333 0.5773503 0.0233448), wk = 0.0048309 k( 189) = ( 0.3333333 0.5773503 0.0466896), wk = 0.0048309 k( 190) = ( 0.3333333 0.5773503 0.0700344), wk = 0.0048309 k( 191) = ( 0.3333333 0.5773503 0.0933792), wk = 0.0048309 k( 192) = ( 0.3333333 0.5773503 0.1167240), wk = 0.0048309 k( 193) = ( 0.3333333 0.5773503 0.1400688), wk = 0.0048309 k( 194) = ( 0.3333333 0.5773503 0.1634136), wk = 0.0048309 k( 195) = ( 0.3333333 0.5773503 0.1867584), wk = 0.0048309 k( 196) = ( 0.3333333 0.5773503 0.2101031), wk = 0.0048309 k( 197) = ( 0.3333333 0.5773503 0.2334479), wk = 0.0048309 k( 198) = ( 0.3333333 0.5773503 0.2567927), wk = 0.0048309 k( 199) = ( 0.3333333 0.5773503 0.2801375), wk = 0.0048309 k( 200) = ( 0.3333333 0.5773503 0.3034823), wk = 0.0048309 k( 201) = ( 0.3333333 0.5773503 0.3268271), wk = 0.0048309 k( 202) = ( 0.3333333 0.5773503 0.3501719), wk = 0.0048309 k( 203) = ( 0.3333333 0.5773503 0.3735167), wk = 0.0048309 k( 204) = ( 0.3333333 0.5773503 0.3968615), wk = 0.0048309 k( 205) = ( 0.3333333 0.5773503 0.4202063), wk = 0.0048309 k( 206) = ( 0.3333333 0.5773503 0.4435511), wk = 0.0048309 k( 207) = ( 0.3333333 0.5773503 0.4668959), wk = 0.0048309 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 2) = ( 0.0200000 -0.0000000 -0.0000000), wk = 0.0048309 k( 3) = ( 0.0400000 -0.0000000 -0.0000000), wk = 0.0048309 k( 4) = ( 0.0600000 -0.0000000 -0.0000000), wk = 0.0048309 k( 5) = ( 0.0800000 -0.0000000 -0.0000000), wk = 0.0048309 k( 6) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0048309 k( 7) = ( 0.1200000 -0.0000000 -0.0000000), wk = 0.0048309 k( 8) = ( 0.1400000 -0.0000000 0.0000000), wk = 0.0048309 k( 9) = ( 0.1600000 -0.0000000 -0.0000000), wk = 0.0048309 k( 10) = ( 0.1800000 0.0000000 -0.0000000), wk = 0.0048309 k( 11) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0048309 k( 12) = ( 0.2200000 0.0000000 -0.0000000), wk = 0.0048309 k( 13) = ( 0.2400000 -0.0000000 -0.0000000), wk = 0.0048309 k( 14) = ( 0.2600000 -0.0000000 0.0000000), wk = 0.0048309 k( 15) = ( 0.2800000 -0.0000000 0.0000000), wk = 0.0048309 k( 16) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0048309 k( 17) = ( 0.3200000 -0.0000000 -0.0000000), wk = 0.0048309 k( 18) = ( 0.3400000 0.0000000 -0.0000000), wk = 0.0048309 k( 19) = ( 0.3600000 0.0000000 -0.0000000), wk = 0.0048309 k( 20) = ( 0.3800000 -0.0000000 -0.0000000), wk = 0.0048309 k( 21) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0048309 k( 22) = ( 0.4200000 -0.0000000 -0.0000000), wk = 0.0048309 k( 23) = ( 0.4400000 0.0000000 -0.0000000), wk = 0.0048309 k( 24) = ( 0.4600000 -0.0000000 -0.0000000), wk = 0.0048309 k( 25) = ( 0.4800000 -0.0000000 -0.0000000), wk = 0.0048309 k( 26) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0048309 k( 27) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0048309 k( 28) = ( 0.4888889 0.0222222 -0.0000000), wk = 0.0048309 k( 29) = ( 0.4777778 0.0444444 0.0000000), wk = 0.0048309 k( 30) = ( 0.4666667 0.0666667 -0.0000000), wk = 0.0048309 k( 31) = ( 0.4555556 0.0888889 -0.0000000), wk = 0.0048309 k( 32) = ( 0.4444444 0.1111111 -0.0000000), wk = 0.0048309 k( 33) = ( 0.4333333 0.1333333 0.0000000), wk = 0.0048309 k( 34) = ( 0.4222222 0.1555556 0.0000000), wk = 0.0048309 k( 35) = ( 0.4111111 0.1777778 0.0000000), wk = 0.0048309 k( 36) = ( 0.4000000 0.2000000 0.0000000), wk = 0.0048309 k( 37) = ( 0.3888889 0.2222222 -0.0000000), wk = 0.0048309 k( 38) = ( 0.3777778 0.2444444 -0.0000000), wk = 0.0048309 k( 39) = ( 0.3666667 0.2666667 -0.0000000), wk = 0.0048309 k( 40) = ( 0.3555556 0.2888889 -0.0000000), wk = 0.0048309 k( 41) = ( 0.3444444 0.3111111 0.0000000), wk = 0.0048309 k( 42) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0048309 k( 43) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0048309 k( 44) = ( 0.3218391 0.3218391 -0.0000000), wk = 0.0048309 k( 45) = ( 0.3103448 0.3103448 -0.0000000), wk = 0.0048309 k( 46) = ( 0.2988506 0.2988506 0.0000000), wk = 0.0048309 k( 47) = ( 0.2873563 0.2873563 -0.0000000), wk = 0.0048309 k( 48) = ( 0.2758621 0.2758621 0.0000000), wk = 0.0048309 k( 49) = ( 0.2643678 0.2643678 -0.0000000), wk = 0.0048309 k( 50) = ( 0.2528736 0.2528736 -0.0000000), wk = 0.0048309 k( 51) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0048309 k( 52) = ( 0.2298851 0.2298851 -0.0000000), wk = 0.0048309 k( 53) = ( 0.2183908 0.2183908 -0.0000000), wk = 0.0048309 k( 54) = ( 0.2068966 0.2068965 -0.0000000), wk = 0.0048309 k( 55) = ( 0.1954023 0.1954023 0.0000000), wk = 0.0048309 k( 56) = ( 0.1839080 0.1839081 -0.0000000), wk = 0.0048309 k( 57) = ( 0.1724138 0.1724138 -0.0000000), wk = 0.0048309 k( 58) = ( 0.1609195 0.1609195 -0.0000000), wk = 0.0048309 k( 59) = ( 0.1494253 0.1494253 -0.0000000), wk = 0.0048309 k( 60) = ( 0.1379310 0.1379310 -0.0000000), wk = 0.0048309 k( 61) = ( 0.1264368 0.1264368 -0.0000000), wk = 0.0048309 k( 62) = ( 0.1149425 0.1149425 -0.0000000), wk = 0.0048309 k( 63) = ( 0.1034483 0.1034483 -0.0000000), wk = 0.0048309 k( 64) = ( 0.0919540 0.0919540 -0.0000000), wk = 0.0048309 k( 65) = ( 0.0804598 0.0804598 -0.0000000), wk = 0.0048309 k( 66) = ( 0.0689655 0.0689655 0.0000000), wk = 0.0048309 k( 67) = ( 0.0574713 0.0574713 -0.0000000), wk = 0.0048309 k( 68) = ( 0.0459770 0.0459770 -0.0000000), wk = 0.0048309 k( 69) = ( 0.0344828 0.0344828 0.0000000), wk = 0.0048309 k( 70) = ( 0.0229885 0.0229885 -0.0000000), wk = 0.0048309 k( 71) = ( 0.0114942 0.0114943 0.0000000), wk = 0.0048309 k( 72) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 73) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0048309 k( 74) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0048309 k( 75) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0048309 k( 76) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0048309 k( 77) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0048309 k( 78) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0048309 k( 79) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0048309 k( 80) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0048309 k( 81) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0048309 k( 82) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0048309 k( 83) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0048309 k( 84) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0048309 k( 85) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0048309 k( 86) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0048309 k( 87) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0048309 k( 88) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0048309 k( 89) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0048309 k( 90) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0048309 k( 91) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0048309 k( 92) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0048309 k( 93) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0048309 k( 94) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0048309 k( 95) = ( 0.0200000 -0.0000000 0.5000000), wk = 0.0048309 k( 96) = ( 0.0400000 -0.0000000 0.5000000), wk = 0.0048309 k( 97) = ( 0.0600000 -0.0000000 0.5000000), wk = 0.0048309 k( 98) = ( 0.0800000 -0.0000000 0.5000000), wk = 0.0048309 k( 99) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0048309 k( 100) = ( 0.1200000 -0.0000000 0.5000000), wk = 0.0048309 k( 101) = ( 0.1400000 -0.0000000 0.5000000), wk = 0.0048309 k( 102) = ( 0.1600000 -0.0000000 0.5000000), wk = 0.0048309 k( 103) = ( 0.1800000 0.0000000 0.5000000), wk = 0.0048309 k( 104) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0048309 k( 105) = ( 0.2200000 0.0000000 0.5000000), wk = 0.0048309 k( 106) = ( 0.2400000 -0.0000000 0.5000000), wk = 0.0048309 k( 107) = ( 0.2600000 -0.0000000 0.5000000), wk = 0.0048309 k( 108) = ( 0.2800000 -0.0000000 0.5000000), wk = 0.0048309 k( 109) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0048309 k( 110) = ( 0.3200000 -0.0000000 0.5000000), wk = 0.0048309 k( 111) = ( 0.3400000 0.0000000 0.5000000), wk = 0.0048309 k( 112) = ( 0.3600000 0.0000000 0.5000000), wk = 0.0048309 k( 113) = ( 0.3800000 -0.0000000 0.5000000), wk = 0.0048309 k( 114) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0048309 k( 115) = ( 0.4200000 -0.0000000 0.5000000), wk = 0.0048309 k( 116) = ( 0.4400000 0.0000000 0.5000000), wk = 0.0048309 k( 117) = ( 0.4600000 -0.0000000 0.5000000), wk = 0.0048309 k( 118) = ( 0.4800000 -0.0000000 0.5000000), wk = 0.0048309 k( 119) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0048309 k( 120) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0048309 k( 121) = ( 0.4888889 0.0222222 0.5000000), wk = 0.0048309 k( 122) = ( 0.4777778 0.0444444 0.5000000), wk = 0.0048309 k( 123) = ( 0.4666667 0.0666667 0.5000000), wk = 0.0048309 k( 124) = ( 0.4555556 0.0888889 0.5000000), wk = 0.0048309 k( 125) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0048309 k( 126) = ( 0.4333333 0.1333333 0.5000000), wk = 0.0048309 k( 127) = ( 0.4222222 0.1555556 0.5000000), wk = 0.0048309 k( 128) = ( 0.4111111 0.1777778 0.5000000), wk = 0.0048309 k( 129) = ( 0.4000000 0.2000000 0.5000000), wk = 0.0048309 k( 130) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0048309 k( 131) = ( 0.3777778 0.2444444 0.5000000), wk = 0.0048309 k( 132) = ( 0.3666667 0.2666667 0.5000000), wk = 0.0048309 k( 133) = ( 0.3555556 0.2888889 0.5000000), wk = 0.0048309 k( 134) = ( 0.3444444 0.3111111 0.5000000), wk = 0.0048309 k( 135) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0048309 k( 136) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0048309 k( 137) = ( 0.3218391 0.3218391 0.5000000), wk = 0.0048309 k( 138) = ( 0.3103448 0.3103448 0.5000000), wk = 0.0048309 k( 139) = ( 0.2988506 0.2988506 0.5000000), wk = 0.0048309 k( 140) = ( 0.2873563 0.2873563 0.5000000), wk = 0.0048309 k( 141) = ( 0.2758621 0.2758621 0.5000000), wk = 0.0048309 k( 142) = ( 0.2643678 0.2643678 0.5000000), wk = 0.0048309 k( 143) = ( 0.2528736 0.2528736 0.5000000), wk = 0.0048309 k( 144) = ( 0.2413793 0.2413793 0.5000000), wk = 0.0048309 k( 145) = ( 0.2298851 0.2298851 0.5000000), wk = 0.0048309 k( 146) = ( 0.2183908 0.2183908 0.5000000), wk = 0.0048309 k( 147) = ( 0.2068966 0.2068965 0.5000000), wk = 0.0048309 k( 148) = ( 0.1954023 0.1954023 0.5000000), wk = 0.0048309 k( 149) = ( 0.1839080 0.1839081 0.5000000), wk = 0.0048309 k( 150) = ( 0.1724138 0.1724138 0.5000000), wk = 0.0048309 k( 151) = ( 0.1609195 0.1609195 0.5000000), wk = 0.0048309 k( 152) = ( 0.1494253 0.1494253 0.5000000), wk = 0.0048309 k( 153) = ( 0.1379310 0.1379310 0.5000000), wk = 0.0048309 k( 154) = ( 0.1264368 0.1264368 0.5000000), wk = 0.0048309 k( 155) = ( 0.1149425 0.1149425 0.5000000), wk = 0.0048309 k( 156) = ( 0.1034483 0.1034483 0.5000000), wk = 0.0048309 k( 157) = ( 0.0919540 0.0919540 0.5000000), wk = 0.0048309 k( 158) = ( 0.0804598 0.0804598 0.5000000), wk = 0.0048309 k( 159) = ( 0.0689655 0.0689655 0.5000000), wk = 0.0048309 k( 160) = ( 0.0574713 0.0574713 0.5000000), wk = 0.0048309 k( 161) = ( 0.0459770 0.0459770 0.5000000), wk = 0.0048309 k( 162) = ( 0.0344828 0.0344828 0.5000000), wk = 0.0048309 k( 163) = ( 0.0229885 0.0229885 0.5000000), wk = 0.0048309 k( 164) = ( 0.0114942 0.0114943 0.5000000), wk = 0.0048309 k( 165) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0048309 k( 166) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0048309 k( 167) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0048309 k( 168) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0048309 k( 169) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0048309 k( 170) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0048309 k( 171) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0048309 k( 172) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0048309 k( 173) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0048309 k( 174) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0048309 k( 175) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0048309 k( 176) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0048309 k( 177) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0048309 k( 178) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0048309 k( 179) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0048309 k( 180) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0048309 k( 181) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0048309 k( 182) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0048309 k( 183) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0048309 k( 184) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0048309 k( 185) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0048309 k( 186) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0048309 k( 187) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0048309 k( 188) = ( 0.3333333 0.3333333 0.0250000), wk = 0.0048309 k( 189) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0048309 k( 190) = ( 0.3333333 0.3333333 0.0750000), wk = 0.0048309 k( 191) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0048309 k( 192) = ( 0.3333333 0.3333333 0.1250000), wk = 0.0048309 k( 193) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0048309 k( 194) = ( 0.3333333 0.3333333 0.1750000), wk = 0.0048309 k( 195) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0048309 k( 196) = ( 0.3333333 0.3333333 0.2250000), wk = 0.0048309 k( 197) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0048309 k( 198) = ( 0.3333333 0.3333333 0.2750000), wk = 0.0048309 k( 199) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0048309 k( 200) = ( 0.3333333 0.3333333 0.3250000), wk = 0.0048309 k( 201) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0048309 k( 202) = ( 0.3333333 0.3333333 0.3750000), wk = 0.0048309 k( 203) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0048309 k( 204) = ( 0.3333333 0.3333333 0.4250000), wk = 0.0048309 k( 205) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0048309 k( 206) = ( 0.3333333 0.3333333 0.4750000), wk = 0.0048309 k( 207) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0048309 Dense grid: 162141 G-vectors FFT dimensions: ( 72, 72, 75) Smooth grid: 107651 G-vectors FFT dimensions: ( 64, 64, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 374, 96) NL pseudopotentials 1.16 Mb ( 187, 408) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2251) G-vector shells 0.01 Mb ( 1148) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.19 Mb ( 374, 384) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each matrix 1.20 Mb ( 408, 2, 96) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./SbCl5.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 6.7 secs Computing kpt #: 3 total cpu time spent up to now is 8.9 secs Computing kpt #: 4 total cpu time spent up to now is 11.0 secs Computing kpt #: 5 total cpu time spent up to now is 13.2 secs Computing kpt #: 6 total cpu time spent up to now is 15.3 secs Computing kpt #: 7 total cpu time spent up to now is 17.5 secs Computing kpt #: 8 total cpu time spent up to now is 19.7 secs Computing kpt #: 9 total cpu time spent up to now is 21.9 secs Computing kpt #: 10 total cpu time spent up to now is 24.1 secs Computing kpt #: 11 total cpu time spent up to now is 26.3 secs Computing kpt #: 12 total cpu time spent up to now is 28.5 secs Computing kpt #: 13 total cpu time spent up to now is 30.7 secs Computing kpt #: 14 total cpu time spent up to now is 33.0 secs Computing kpt #: 15 total cpu time spent up to now is 35.2 secs Computing kpt #: 16 total cpu time spent up to now is 37.5 secs Computing kpt #: 17 total cpu time spent up to now is 39.8 secs Computing kpt #: 18 total cpu time spent up to now is 41.7 secs Computing kpt #: 19 total cpu time spent up to now is 43.6 secs Computing kpt #: 20 total cpu time spent up to now is 45.5 secs Computing kpt #: 21 total cpu time spent up to now is 47.4 secs Computing kpt #: 22 total cpu time spent up to now is 49.2 secs Computing kpt #: 23 total cpu time spent up to now is 51.0 secs Computing kpt #: 24 total cpu time spent up to now is 52.8 secs Computing kpt #: 25 total cpu time spent up to now is 54.6 secs Computing kpt #: 26 total cpu time spent up to now is 56.4 secs Computing kpt #: 27 total cpu time spent up to now is 58.2 secs Computing kpt #: 28 total cpu time spent up to now is 60.0 secs Computing kpt #: 29 total cpu time spent up to now is 61.8 secs Computing kpt #: 30 total cpu time spent up to now is 63.6 secs Computing kpt #: 31 total cpu time spent up to now is 65.5 secs Computing kpt #: 32 total cpu time spent up to now is 67.3 secs Computing kpt #: 33 total cpu time spent up to now is 69.1 secs Computing kpt #: 34 total cpu time spent up to now is 70.9 secs Computing kpt #: 35 total cpu time spent up to now is 72.6 secs Computing kpt #: 36 total cpu time spent up to now is 74.4 secs Computing kpt #: 37 total cpu time spent up to now is 76.3 secs Computing kpt #: 38 total cpu time spent up to now is 78.1 secs Computing kpt #: 39 total cpu time spent up to now is 79.8 secs Computing kpt #: 40 total cpu time spent up to now is 81.6 secs Computing kpt #: 41 total cpu time spent up to now is 83.3 secs Computing kpt #: 42 total cpu time spent up to now is 85.1 secs Computing kpt #: 43 total cpu time spent up to now is 86.8 secs Computing kpt #: 44 total cpu time spent up to now is 88.6 secs Computing kpt #: 45 total cpu time spent up to now is 90.3 secs Computing kpt #: 46 total cpu time spent up to now is 92.1 secs Computing kpt #: 47 total cpu time spent up to now is 93.9 secs Computing kpt #: 48 total cpu time spent up to now is 95.7 secs Computing kpt #: 49 total cpu time spent up to now is 97.5 secs Computing kpt #: 50 total cpu time spent up to now is 99.3 secs Computing kpt #: 51 total cpu time spent up to now is 101.1 secs Computing kpt #: 52 total cpu time spent up to now is 102.9 secs Computing kpt #: 53 total cpu time spent up to now is 104.8 secs Computing kpt #: 54 total cpu time spent up to now is 106.7 secs Computing kpt #: 55 total cpu time spent up to now is 108.6 secs Computing kpt #: 56 total cpu time spent up to now is 110.9 secs Computing kpt #: 57 total cpu time spent up to now is 113.1 secs Computing kpt #: 58 total cpu time spent up to now is 115.4 secs Computing kpt #: 59 total cpu time spent up to now is 117.6 secs Computing kpt #: 60 total cpu time spent up to now is 119.8 secs Computing kpt #: 61 total cpu time spent up to now is 122.1 secs Computing kpt #: 62 total cpu time spent up to now is 124.3 secs Computing kpt #: 63 total cpu time spent up to now is 126.5 secs Computing kpt #: 64 total cpu time spent up to now is 128.7 secs Computing kpt #: 65 total cpu time spent up to now is 130.8 secs Computing kpt #: 66 total cpu time spent up to now is 133.0 secs Computing kpt #: 67 total cpu time spent up to now is 135.2 secs Computing kpt #: 68 total cpu time spent up to now is 137.4 secs Computing kpt #: 69 total cpu time spent up to now is 139.5 secs Computing kpt #: 70 total cpu time spent up to now is 141.7 secs Computing kpt #: 71 total cpu time spent up to now is 143.8 secs Computing kpt #: 72 total cpu time spent up to now is 146.0 secs Computing kpt #: 73 total cpu time spent up to now is 148.2 secs Computing kpt #: 74 total cpu time spent up to now is 150.4 secs Computing kpt #: 75 total cpu time spent up to now is 152.5 secs Computing kpt #: 76 total cpu time spent up to now is 154.7 secs Computing kpt #: 77 total cpu time spent up to now is 156.9 secs Computing kpt #: 78 total cpu time spent up to now is 159.1 secs Computing kpt #: 79 total cpu time spent up to now is 161.2 secs Computing kpt #: 80 total cpu time spent up to now is 163.4 secs Computing kpt #: 81 total cpu time spent up to now is 165.2 secs Computing kpt #: 82 total cpu time spent up to now is 167.1 secs Computing kpt #: 83 total cpu time spent up to now is 168.9 secs Computing kpt #: 84 total cpu time spent up to now is 170.6 secs Computing kpt #: 85 total cpu time spent up to now is 172.4 secs Computing kpt #: 86 total cpu time spent up to now is 174.1 secs Computing kpt #: 87 total cpu time spent up to now is 175.9 secs Computing kpt #: 88 total cpu time spent up to now is 177.6 secs Computing kpt #: 89 total cpu time spent up to now is 179.4 secs Computing kpt #: 90 total cpu time spent up to now is 181.1 secs Computing kpt #: 91 total cpu time spent up to now is 182.8 secs Computing kpt #: 92 total cpu time spent up to now is 184.5 secs Computing kpt #: 93 total cpu time spent up to now is 186.2 secs Computing kpt #: 94 total cpu time spent up to now is 188.0 secs Computing kpt #: 95 total cpu time spent up to now is 189.7 secs Computing kpt #: 96 total cpu time spent up to now is 191.4 secs Computing kpt #: 97 total cpu time spent up to now is 193.1 secs Computing kpt #: 98 total cpu time spent up to now is 194.9 secs Computing kpt #: 99 total cpu time spent up to now is 196.6 secs Computing kpt #: 100 total cpu time spent up to now is 198.3 secs Computing kpt #: 101 total cpu time spent up to now is 200.0 secs Computing kpt #: 102 total cpu time spent up to now is 201.8 secs Computing kpt #: 103 total cpu time spent up to now is 203.7 secs Computing kpt #: 104 total cpu time spent up to now is 205.6 secs Computing kpt #: 105 total cpu time spent up to now is 207.4 secs Computing kpt #: 106 total cpu time spent up to now is 209.1 secs Computing kpt #: 107 total cpu time spent up to now is 210.8 secs Computing kpt #: 108 total cpu time spent up to now is 212.5 secs Computing kpt #: 109 total cpu time spent up to now is 214.3 secs Computing kpt #: 110 total cpu time spent up to now is 216.3 secs Computing kpt #: 111 total cpu time spent up to now is 218.1 secs Computing kpt #: 112 total cpu time spent up to now is 219.8 secs Computing kpt #: 113 total cpu time spent up to now is 221.5 secs Computing kpt #: 114 total cpu time spent up to now is 223.2 secs Computing kpt #: 115 total cpu time spent up to now is 224.9 secs Computing kpt #: 116 total cpu time spent up to now is 226.6 secs Computing kpt #: 117 total cpu time spent up to now is 228.4 secs Computing kpt #: 118 total cpu time spent up to now is 230.1 secs Computing kpt #: 119 total cpu time spent up to now is 231.8 secs Computing kpt #: 120 total cpu time spent up to now is 233.4 secs Computing kpt #: 121 total cpu time spent up to now is 235.1 secs Computing kpt #: 122 total cpu time spent up to now is 236.8 secs Computing kpt #: 123 total cpu time spent up to now is 238.5 secs Computing kpt #: 124 total cpu time spent up to now is 240.2 secs Computing kpt #: 125 total cpu time spent up to now is 241.9 secs Computing kpt #: 126 total cpu time spent up to now is 243.5 secs Computing kpt #: 127 total cpu time spent up to now is 245.2 secs Computing kpt #: 128 total cpu time spent up to now is 246.9 secs Computing kpt #: 129 total cpu time spent up to now is 248.5 secs Computing kpt #: 130 total cpu time spent up to now is 250.2 secs Computing kpt #: 131 total cpu time spent up to now is 251.9 secs Computing kpt #: 132 total cpu time spent up to now is 253.5 secs Computing kpt #: 133 total cpu time spent up to now is 255.2 secs Computing kpt #: 134 total cpu time spent up to now is 256.8 secs Computing kpt #: 135 total cpu time spent up to now is 258.5 secs Computing kpt #: 136 total cpu time spent up to now is 260.2 secs Computing kpt #: 137 total cpu time spent up to now is 261.8 secs Computing kpt #: 138 total cpu time spent up to now is 263.5 secs Computing kpt #: 139 total cpu time spent up to now is 265.2 secs Computing kpt #: 140 total cpu time spent up to now is 266.8 secs Computing kpt #: 141 total cpu time spent up to now is 268.5 secs Computing kpt #: 142 total cpu time spent up to now is 270.2 secs Computing kpt #: 143 total cpu time spent up to now is 272.0 secs Computing kpt #: 144 total cpu time spent up to now is 273.7 secs Computing kpt #: 145 total cpu time spent up to now is 275.4 secs Computing kpt #: 146 total cpu time spent up to now is 277.1 secs Computing kpt #: 147 total cpu time spent up to now is 278.8 secs Computing kpt #: 148 total cpu time spent up to now is 280.5 secs Computing kpt #: 149 total cpu time spent up to now is 282.2 secs Computing kpt #: 150 total cpu time spent up to now is 284.0 secs Computing kpt #: 151 total cpu time spent up to now is 285.7 secs Computing kpt #: 152 total cpu time spent up to now is 287.5 secs Computing kpt #: 153 total cpu time spent up to now is 289.2 secs Computing kpt #: 154 total cpu time spent up to now is 290.9 secs Computing kpt #: 155 total cpu time spent up to now is 292.6 secs Computing kpt #: 156 total cpu time spent up to now is 294.4 secs Computing kpt #: 157 total cpu time spent up to now is 296.1 secs Computing kpt #: 158 total cpu time spent up to now is 297.9 secs Computing kpt #: 159 total cpu time spent up to now is 299.6 secs Computing kpt #: 160 total cpu time spent up to now is 301.3 secs Computing kpt #: 161 total cpu time spent up to now is 303.1 secs Computing kpt #: 162 total cpu time spent up to now is 304.8 secs Computing kpt #: 163 total cpu time spent up to now is 306.5 secs Computing kpt #: 164 total cpu time spent up to now is 308.2 secs Computing kpt #: 165 total cpu time spent up to now is 310.0 secs Computing kpt #: 166 total cpu time spent up to now is 311.7 secs Computing kpt #: 167 total cpu time spent up to now is 313.4 secs Computing kpt #: 168 total cpu time spent up to now is 315.1 secs Computing kpt #: 169 total cpu time spent up to now is 316.8 secs Computing kpt #: 170 total cpu time spent up to now is 318.5 secs Computing kpt #: 171 total cpu time spent up to now is 320.3 secs Computing kpt #: 172 total cpu time spent up to now is 322.1 secs Computing kpt #: 173 total cpu time spent up to now is 323.8 secs Computing kpt #: 174 total cpu time spent up to now is 325.6 secs Computing kpt #: 175 total cpu time spent up to now is 327.4 secs Computing kpt #: 176 total cpu time spent up to now is 329.1 secs Computing kpt #: 177 total cpu time spent up to now is 331.0 secs Computing kpt #: 178 total cpu time spent up to now is 334.1 secs Computing kpt #: 179 total cpu time spent up to now is 335.9 secs Computing kpt #: 180 total cpu time spent up to now is 337.7 secs Computing kpt #: 181 total cpu time spent up to now is 339.5 secs Computing kpt #: 182 total cpu time spent up to now is 341.4 secs Computing kpt #: 183 total cpu time spent up to now is 343.2 secs Computing kpt #: 184 total cpu time spent up to now is 345.0 secs Computing kpt #: 185 total cpu time spent up to now is 346.8 secs Computing kpt #: 186 total cpu time spent up to now is 348.6 secs Computing kpt #: 187 total cpu time spent up to now is 350.4 secs Computing kpt #: 188 total cpu time spent up to now is 352.1 secs Computing kpt #: 189 total cpu time spent up to now is 353.9 secs Computing kpt #: 190 total cpu time spent up to now is 355.6 secs Computing kpt #: 191 total cpu time spent up to now is 357.4 secs Computing kpt #: 192 total cpu time spent up to now is 359.2 secs Computing kpt #: 193 total cpu time spent up to now is 360.9 secs Computing kpt #: 194 total cpu time spent up to now is 362.7 secs Computing kpt #: 195 total cpu time spent up to now is 364.4 secs Computing kpt #: 196 total cpu time spent up to now is 366.2 secs Computing kpt #: 197 total cpu time spent up to now is 367.9 secs Computing kpt #: 198 total cpu time spent up to now is 369.6 secs Computing kpt #: 199 total cpu time spent up to now is 371.3 secs Computing kpt #: 200 total cpu time spent up to now is 373.1 secs Computing kpt #: 201 total cpu time spent up to now is 374.8 secs Computing kpt #: 202 total cpu time spent up to now is 376.5 secs Computing kpt #: 203 total cpu time spent up to now is 378.3 secs Computing kpt #: 204 total cpu time spent up to now is 379.9 secs Computing kpt #: 205 total cpu time spent up to now is 381.6 secs Computing kpt #: 206 total cpu time spent up to now is 383.3 secs Computing kpt #: 207 total cpu time spent up to now is 384.9 secs ethr = 1.25E-08, avg # of iterations = 16.3 total cpu time spent up to now is 384.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13425 PWs) bands (ev): -15.1222 -15.1222 -15.0188 -15.0188 -13.7927 -13.7927 -13.7767 -13.7767 -13.7708 -13.7708 -13.7544 -13.7544 -13.3095 -13.3095 -13.2525 -13.2525 -13.0430 -13.0430 -12.9647 -12.9647 -8.0316 -8.0316 -7.9642 -7.9642 -4.0397 -4.0397 -3.9290 -3.9290 -3.8905 -3.8905 -3.7551 -3.7551 -3.5683 -3.5683 -3.5039 -3.5039 -1.9502 -1.9502 -1.9274 -1.9274 -1.7500 -1.7500 -1.7384 -1.7384 -1.7336 -1.7336 -1.7105 -1.7105 -1.6014 -1.6014 -1.5225 -1.5225 -1.5123 -1.5123 -1.4665 -1.4665 -1.1192 -1.1192 -0.8544 -0.8544 -0.7836 -0.7836 -0.6155 -0.6155 -0.5298 -0.5298 -0.5135 -0.5135 -0.4853 -0.4853 -0.4836 -0.4836 -0.1626 -0.1626 -0.1169 -0.1169 -0.0437 -0.0437 0.0183 0.0183 1.8722 1.8722 1.9964 1.9964 5.3108 5.3108 5.3207 5.3207 5.6061 5.6061 5.6135 5.6135 6.8564 6.8564 7.0420 7.0420 k = 0.0200 0.0115-0.0000 ( 13429 PWs) bands (ev): -15.1220 -15.1220 -15.0187 -15.0187 -13.7930 -13.7930 -13.7771 -13.7771 -13.7709 -13.7709 -13.7547 -13.7547 -13.3095 -13.3095 -13.2525 -13.2525 -13.0427 -13.0427 -12.9646 -12.9646 -8.0308 -8.0308 -7.9635 -7.9635 -4.0400 -4.0400 -3.9297 -3.9297 -3.8907 -3.8907 -3.7559 -3.7559 -3.5683 -3.5683 -3.5039 -3.5039 -1.9489 -1.9489 -1.9288 -1.9288 -1.7555 -1.7555 -1.7506 -1.7506 -1.7218 -1.7218 -1.7058 -1.7058 -1.6007 -1.6007 -1.5240 -1.5240 -1.5104 -1.5104 -1.4664 -1.4664 -1.1175 -1.1175 -0.8555 -0.8555 -0.7847 -0.7847 -0.6157 -0.6157 -0.5300 -0.5300 -0.5140 -0.5140 -0.4860 -0.4860 -0.4838 -0.4838 -0.1625 -0.1625 -0.1169 -0.1169 -0.0440 -0.0440 0.0180 0.0180 1.8750 1.8750 1.9986 1.9986 5.3115 5.3115 5.3213 5.3213 5.6071 5.6071 5.6145 5.6145 6.8590 6.8590 7.0431 7.0431 k = 0.0400 0.0231-0.0000 ( 13417 PWs) bands (ev): -15.1212 -15.1212 -15.0184 -15.0184 -13.7937 -13.7937 -13.7782 -13.7782 -13.7712 -13.7712 -13.7554 -13.7554 -13.3093 -13.3093 -13.2527 -13.2527 -13.0419 -13.0419 -12.9642 -12.9642 -8.0286 -8.0286 -7.9616 -7.9616 -4.0409 -4.0409 -3.9319 -3.9319 -3.8914 -3.8914 -3.7581 -3.7581 -3.5682 -3.5682 -3.5040 -3.5040 -1.9448 -1.9448 -1.9331 -1.9331 -1.7687 -1.7687 -1.7644 -1.7644 -1.7084 -1.7084 -1.6959 -1.6959 -1.5986 -1.5986 -1.5270 -1.5270 -1.5061 -1.5061 -1.4664 -1.4664 -1.1125 -1.1125 -0.8586 -0.8586 -0.7881 -0.7881 -0.6167 -0.6167 -0.5306 -0.5306 -0.5156 -0.5156 -0.4880 -0.4880 -0.4843 -0.4843 -0.1624 -0.1624 -0.1167 -0.1167 -0.0449 -0.0449 0.0171 0.0171 1.8834 1.8834 2.0053 2.0053 5.3135 5.3135 5.3232 5.3232 5.6100 5.6100 5.6175 5.6175 6.8668 6.8668 7.0462 7.0462 k = 0.0600 0.0346-0.0000 ( 13417 PWs) bands (ev): -15.1200 -15.1200 -15.0180 -15.0180 -13.7950 -13.7950 -13.7800 -13.7800 -13.7717 -13.7717 -13.7564 -13.7564 -13.3091 -13.3091 -13.2529 -13.2529 -13.0405 -13.0405 -12.9636 -12.9636 -8.0249 -8.0249 -7.9585 -7.9585 -4.0427 -4.0427 -3.9358 -3.9358 -3.8924 -3.8924 -3.7615 -3.7615 -3.5681 -3.5681 -3.5042 -3.5042 -1.9399 -1.9399 -1.9382 -1.9382 -1.7854 -1.7854 -1.7776 -1.7776 -1.6959 -1.6959 -1.6844 -1.6844 -1.5960 -1.5960 -1.5300 -1.5300 -1.5009 -1.5009 -1.4663 -1.4663 -1.1043 -1.1043 -0.8637 -0.8637 -0.7935 -0.7935 -0.6183 -0.6183 -0.5317 -0.5317 -0.5186 -0.5186 -0.4906 -0.4906 -0.4852 -0.4852 -0.1622 -0.1622 -0.1165 -0.1165 -0.0463 -0.0463 0.0157 0.0157 1.8971 1.8971 2.0162 2.0162 5.3164 5.3164 5.3263 5.3263 5.6149 5.6149 5.6228 5.6228 6.8798 6.8798 7.0514 7.0514 k = 0.0800 0.0462-0.0000 ( 13407 PWs) bands (ev): -15.1183 -15.1183 -15.0174 -15.0174 -13.7971 -13.7971 -13.7824 -13.7824 -13.7725 -13.7725 -13.7577 -13.7577 -13.3088 -13.3088 -13.2532 -13.2532 -13.0386 -13.0386 -12.9627 -12.9627 -8.0199 -8.0199 -7.9541 -7.9541 -4.0454 -4.0454 -3.9417 -3.9417 -3.8934 -3.8934 -3.7657 -3.7657 -3.5679 -3.5679 -3.5044 -3.5044 -1.9484 -1.9484 -1.9294 -1.9294 -1.8034 -1.8034 -1.7905 -1.7905 -1.6845 -1.6845 -1.6723 -1.6723 -1.5936 -1.5936 -1.5326 -1.5326 -1.4949 -1.4949 -1.4661 -1.4661 -1.0933 -1.0933 -0.8705 -0.8705 -0.8008 -0.8008 -0.6209 -0.6209 -0.5333 -0.5333 -0.5235 -0.5235 -0.4931 -0.4931 -0.4862 -0.4862 -0.1620 -0.1620 -0.1161 -0.1161 -0.0483 -0.0483 0.0137 0.0137 1.9160 1.9160 2.0313 2.0313 5.3196 5.3196 5.3307 5.3307 5.6214 5.6214 5.6309 5.6309 6.8979 6.8979 7.0586 7.0586 k = 0.1000 0.0577-0.0000 ( 13394 PWs) bands (ev): -15.1161 -15.1161 -15.0166 -15.0166 -13.8000 -13.8000 -13.7854 -13.7854 -13.7735 -13.7735 -13.7590 -13.7590 -13.3083 -13.3083 -13.2537 -13.2537 -13.0361 -13.0361 -12.9616 -12.9616 -8.0135 -8.0135 -7.9487 -7.9487 -4.0494 -4.0494 -3.9497 -3.9497 -3.8944 -3.8944 -3.7702 -3.7702 -3.5676 -3.5676 -3.5046 -3.5046 -1.9581 -1.9581 -1.9189 -1.9189 -1.8220 -1.8220 -1.8029 -1.8029 -1.6747 -1.6747 -1.6597 -1.6597 -1.5923 -1.5923 -1.5347 -1.5347 -1.4881 -1.4881 -1.4657 -1.4657 -1.0796 -1.0796 -0.8790 -0.8790 -0.8097 -0.8097 -0.6248 -0.6248 -0.5358 -0.5358 -0.5303 -0.5303 -0.4950 -0.4950 -0.4873 -0.4873 -0.1617 -0.1617 -0.1157 -0.1157 -0.0510 -0.0510 0.0113 0.0113 1.9396 1.9396 2.0503 2.0503 5.3222 5.3222 5.3365 5.3365 5.6292 5.6292 5.6425 5.6425 6.9211 6.9211 7.0678 7.0678 k = 0.1200 0.0693-0.0000 ( 13396 PWs) bands (ev): -15.1135 -15.1135 -15.0158 -15.0158 -13.8038 -13.8038 -13.7888 -13.7888 -13.7747 -13.7747 -13.7602 -13.7602 -13.3078 -13.3078 -13.2542 -13.2542 -13.0333 -13.0333 -12.9604 -12.9604 -8.0058 -8.0058 -7.9421 -7.9421 -4.0549 -4.0549 -3.9604 -3.9604 -3.8949 -3.8949 -3.7744 -3.7744 -3.5670 -3.5670 -3.5050 -3.5050 -1.9684 -1.9684 -1.9076 -1.9076 -1.8405 -1.8405 -1.8144 -1.8144 -1.6661 -1.6661 -1.6469 -1.6469 -1.5923 -1.5923 -1.5367 -1.5367 -1.4807 -1.4807 -1.4650 -1.4650 -1.0637 -1.0637 -0.8889 -0.8889 -0.8201 -0.8201 -0.6303 -0.6303 -0.5398 -0.5398 -0.5374 -0.5374 -0.4963 -0.4963 -0.4884 -0.4884 -0.1614 -0.1614 -0.1152 -0.1152 -0.0542 -0.0542 0.0085 0.0085 1.9676 1.9676 2.0729 2.0729 5.3237 5.3237 5.3437 5.3437 5.6384 5.6384 5.6579 5.6579 6.9492 6.9492 7.0789 7.0789 k = 0.1400 0.0808-0.0000 ( 13416 PWs) bands (ev): -15.1105 -15.1105 -15.0148 -15.0148 -13.8087 -13.8087 -13.7928 -13.7928 -13.7760 -13.7760 -13.7611 -13.7611 -13.3072 -13.3072 -13.2549 -13.2549 -13.0300 -13.0300 -12.9590 -12.9590 -7.9970 -7.9970 -7.9346 -7.9346 -4.0621 -4.0621 -3.9737 -3.9737 -3.8948 -3.8948 -3.7778 -3.7778 -3.5662 -3.5662 -3.5053 -3.5053 -1.9787 -1.9787 -1.8982 -1.8982 -1.8572 -1.8572 -1.8241 -1.8241 -1.6587 -1.6587 -1.6343 -1.6343 -1.5936 -1.5936 -1.5388 -1.5388 -1.4732 -1.4732 -1.4636 -1.4636 -1.0460 -1.0460 -0.8999 -0.8999 -0.8316 -0.8316 -0.6378 -0.6378 -0.5473 -0.5473 -0.5424 -0.5424 -0.4973 -0.4973 -0.4894 -0.4894 -0.1610 -0.1610 -0.1146 -0.1146 -0.0581 -0.0581 0.0053 0.0053 1.9994 1.9994 2.0989 2.0989 5.3238 5.3238 5.3517 5.3517 5.6492 5.6492 5.6771 5.6771 6.9822 6.9822 7.0919 7.0919 k = 0.1600 0.0924-0.0000 ( 13420 PWs) bands (ev): -15.1071 -15.1071 -15.0137 -15.0137 -13.8144 -13.8144 -13.7975 -13.7975 -13.7772 -13.7772 -13.7618 -13.7618 -13.3065 -13.3065 -13.2556 -13.2556 -13.0265 -13.0265 -12.9575 -12.9575 -7.9871 -7.9871 -7.9262 -7.9262 -4.0712 -4.0712 -3.9896 -3.9896 -3.8938 -3.8938 -3.7802 -3.7802 -3.5652 -3.5652 -3.5058 -3.5058 -1.9883 -1.9883 -1.8980 -1.8980 -1.8670 -1.8670 -1.8296 -1.8296 -1.6522 -1.6522 -1.6225 -1.6225 -1.5955 -1.5955 -1.5413 -1.5413 -1.4675 -1.4675 -1.4601 -1.4601 -1.0270 -1.0270 -0.9117 -0.9117 -0.8440 -0.8440 -0.6474 -0.6474 -0.5551 -0.5551 -0.5474 -0.5474 -0.4982 -0.4982 -0.4902 -0.4902 -0.1607 -0.1607 -0.1140 -0.1140 -0.0626 -0.0626 0.0019 0.0019 2.0346 2.0346 2.1277 2.1277 5.3226 5.3226 5.3600 5.3600 5.6619 5.6619 5.6997 5.6997 7.0200 7.0200 7.1066 7.1066 k = 0.1800 0.1039-0.0000 ( 13426 PWs) bands (ev): -15.1033 -15.1033 -15.0126 -15.0126 -13.8207 -13.8207 -13.8027 -13.8027 -13.7783 -13.7783 -13.7623 -13.7623 -13.3057 -13.3057 -13.2564 -13.2564 -13.0226 -13.0226 -12.9559 -12.9559 -7.9764 -7.9764 -7.9171 -7.9171 -4.0823 -4.0823 -4.0080 -4.0080 -3.8918 -3.8918 -3.7814 -3.7814 -3.5639 -3.5639 -3.5062 -3.5062 -1.9970 -1.9970 -1.9108 -1.9108 -1.8706 -1.8706 -1.8267 -1.8267 -1.6469 -1.6469 -1.6133 -1.6133 -1.5957 -1.5957 -1.5444 -1.5444 -1.4650 -1.4650 -1.4534 -1.4534 -1.0071 -1.0071 -0.9239 -0.9239 -0.8570 -0.8570 -0.6593 -0.6593 -0.5619 -0.5619 -0.5533 -0.5533 -0.4992 -0.4992 -0.4907 -0.4907 -0.1605 -0.1605 -0.1134 -0.1134 -0.0676 -0.0676 -0.0018 -0.0018 2.0725 2.0725 2.1590 2.1590 5.3199 5.3199 5.3680 5.3680 5.6766 5.6766 5.7256 5.7256 7.0624 7.0624 7.1231 7.1231 k = 0.2000 0.1155-0.0000 ( 13432 PWs) bands (ev): -15.0993 -15.0993 -15.0115 -15.0115 -13.8276 -13.8276 -13.8084 -13.8084 -13.7792 -13.7792 -13.7627 -13.7627 -13.3048 -13.3048 -13.2573 -13.2573 -13.0186 -13.0186 -12.9543 -12.9543 -7.9648 -7.9648 -7.9074 -7.9074 -4.0952 -4.0952 -4.0283 -4.0283 -3.8889 -3.8889 -3.7814 -3.7814 -3.5624 -3.5624 -3.5067 -3.5067 -2.0042 -2.0042 -1.9281 -1.9281 -1.8767 -1.8767 -1.8155 -1.8155 -1.6429 -1.6429 -1.6104 -1.6104 -1.5902 -1.5902 -1.5480 -1.5480 -1.4638 -1.4638 -1.4458 -1.4458 -0.9872 -0.9872 -0.9356 -0.9356 -0.8703 -0.8703 -0.6730 -0.6730 -0.5676 -0.5676 -0.5598 -0.5598 -0.5004 -0.5004 -0.4911 -0.4911 -0.1603 -0.1603 -0.1127 -0.1127 -0.0732 -0.0732 -0.0055 -0.0055 2.1126 2.1126 2.1923 2.1923 5.3160 5.3160 5.3752 5.3752 5.6935 5.6935 5.7541 5.7541 7.1093 7.1093 7.1411 7.1411 k = 0.2200 0.1270-0.0000 ( 13430 PWs) bands (ev): -15.0949 -15.0949 -15.0104 -15.0104 -13.8349 -13.8349 -13.8146 -13.8146 -13.7800 -13.7800 -13.7629 -13.7629 -13.3039 -13.3039 -13.2582 -13.2582 -13.0144 -13.0144 -12.9527 -12.9527 -7.9527 -7.9527 -7.8972 -7.8972 -4.1099 -4.1099 -4.0502 -4.0502 -3.8849 -3.8849 -3.7803 -3.7803 -3.5606 -3.5606 -3.5073 -3.5073 -2.0099 -2.0099 -1.9461 -1.9461 -1.8848 -1.8848 -1.8003 -1.8003 -1.6411 -1.6411 -1.6109 -1.6109 -1.5809 -1.5809 -1.5519 -1.5519 -1.4629 -1.4629 -1.4387 -1.4387 -0.9709 -0.9709 -0.9437 -0.9437 -0.8836 -0.8836 -0.6879 -0.6879 -0.5725 -0.5725 -0.5667 -0.5667 -0.5017 -0.5017 -0.4913 -0.4913 -0.1603 -0.1603 -0.1120 -0.1120 -0.0792 -0.0792 -0.0094 -0.0094 2.1543 2.1543 2.2271 2.2271 5.3111 5.3111 5.3812 5.3812 5.7125 5.7125 5.7847 5.7847 7.1592 7.1592 7.1617 7.1617 k = 0.2400 0.1386-0.0000 ( 13434 PWs) bands (ev): -15.0903 -15.0903 -15.0093 -15.0093 -13.8424 -13.8424 -13.8210 -13.8210 -13.7807 -13.7807 -13.7631 -13.7631 -13.3029 -13.3029 -13.2592 -13.2592 -13.0102 -13.0102 -12.9511 -12.9511 -7.9401 -7.9401 -7.8868 -7.8868 -4.1261 -4.1261 -4.0730 -4.0730 -3.8802 -3.8802 -3.7784 -3.7784 -3.5587 -3.5587 -3.5079 -3.5079 -2.0137 -2.0137 -1.9638 -1.9638 -1.8935 -1.8935 -1.7841 -1.7841 -1.6421 -1.6421 -1.6108 -1.6108 -1.5722 -1.5722 -1.5547 -1.5547 -1.4623 -1.4623 -1.4323 -1.4323 -0.9705 -0.9705 -0.9363 -0.9363 -0.8963 -0.8963 -0.7034 -0.7034 -0.5780 -0.5780 -0.5726 -0.5726 -0.5032 -0.5032 -0.4915 -0.4915 -0.1603 -0.1603 -0.1113 -0.1113 -0.0856 -0.0856 -0.0133 -0.0133 2.1968 2.1968 2.2629 2.2629 5.3054 5.3054 5.3857 5.3857 5.7335 5.7335 5.8170 5.8170 7.1809 7.1809 7.2158 7.2158 k = 0.2600 0.1501-0.0000 ( 13450 PWs) bands (ev): -15.0856 -15.0856 -15.0084 -15.0084 -13.8500 -13.8500 -13.8275 -13.8275 -13.7812 -13.7812 -13.7632 -13.7632 -13.3018 -13.3018 -13.2603 -13.2603 -13.0059 -13.0059 -12.9496 -12.9496 -7.9273 -7.9273 -7.8762 -7.8762 -4.1436 -4.1436 -4.0960 -4.0960 -3.8748 -3.8748 -3.7759 -3.7759 -3.5566 -3.5566 -3.5085 -3.5085 -2.0158 -2.0158 -1.9806 -1.9806 -1.9022 -1.9022 -1.7685 -1.7685 -1.6457 -1.6457 -1.6090 -1.6090 -1.5684 -1.5684 -1.5528 -1.5528 -1.4620 -1.4620 -1.4269 -1.4269 -0.9803 -0.9803 -0.9227 -0.9227 -0.9044 -0.9044 -0.7190 -0.7190 -0.5856 -0.5856 -0.5761 -0.5761 -0.5047 -0.5047 -0.4917 -0.4917 -0.1605 -0.1605 -0.1106 -0.1106 -0.0921 -0.0921 -0.0173 -0.0173 2.2397 2.2397 2.2991 2.2991 5.2990 5.2990 5.3887 5.3887 5.7562 5.7562 5.8501 5.8501 7.2026 7.2026 7.2749 7.2749 k = 0.2800 0.1617-0.0000 ( 13442 PWs) bands (ev): -15.0807 -15.0807 -15.0075 -15.0075 -13.8576 -13.8576 -13.8341 -13.8341 -13.7817 -13.7817 -13.7633 -13.7633 -13.3007 -13.3007 -13.2614 -13.2614 -13.0017 -13.0017 -12.9482 -12.9482 -7.9145 -7.9145 -7.8657 -7.8657 -4.1619 -4.1619 -4.1188 -4.1188 -3.8690 -3.8690 -3.7729 -3.7729 -3.5545 -3.5545 -3.5091 -3.5091 -2.0167 -2.0167 -1.9958 -1.9958 -1.9105 -1.9105 -1.7546 -1.7546 -1.6513 -1.6513 -1.6060 -1.6060 -1.5697 -1.5697 -1.5454 -1.5454 -1.4619 -1.4619 -1.4226 -1.4226 -0.9914 -0.9914 -0.9270 -0.9270 -0.8929 -0.8929 -0.7341 -0.7341 -0.5942 -0.5942 -0.5783 -0.5783 -0.5063 -0.5063 -0.4919 -0.4919 -0.1608 -0.1608 -0.1102 -0.1102 -0.0985 -0.0985 -0.0212 -0.0212 2.2822 2.2822 2.3352 2.3352 5.2923 5.2923 5.3901 5.3901 5.7801 5.7801 5.8836 5.8836 7.2251 7.2251 7.3374 7.3374 k = 0.3000 0.1732-0.0000 ( 13442 PWs) bands (ev): -15.0758 -15.0758 -15.0068 -15.0068 -13.8649 -13.8649 -13.8405 -13.8405 -13.7822 -13.7822 -13.7633 -13.7633 -13.2996 -13.2996 -13.2626 -13.2626 -12.9976 -12.9976 -12.9469 -12.9469 -7.9017 -7.9017 -7.8553 -7.8553 -4.1808 -4.1808 -4.1408 -4.1408 -3.8629 -3.8629 -3.7695 -3.7695 -3.5522 -3.5522 -3.5098 -3.5098 -2.0199 -2.0199 -2.0056 -2.0056 -1.9182 -1.9182 -1.7436 -1.7436 -1.6580 -1.6580 -1.6023 -1.6023 -1.5713 -1.5713 -1.5369 -1.5369 -1.4622 -1.4622 -1.4194 -1.4194 -1.0022 -1.0022 -0.9381 -0.9381 -0.8744 -0.8744 -0.7483 -0.7483 -0.6032 -0.6032 -0.5797 -0.5797 -0.5079 -0.5079 -0.4922 -0.4922 -0.1613 -0.1613 -0.1114 -0.1114 -0.1033 -0.1033 -0.0250 -0.0250 2.3238 2.3238 2.3705 2.3705 5.2853 5.2853 5.3901 5.3901 5.8048 5.8048 5.9168 5.9168 7.2482 7.2482 7.4026 7.4026 k = 0.3200 0.1848-0.0000 ( 13454 PWs) bands (ev): -15.0709 -15.0709 -15.0063 -15.0063 -13.8719 -13.8719 -13.8467 -13.8467 -13.7826 -13.7826 -13.7633 -13.7633 -13.2984 -13.2984 -13.2638 -13.2638 -12.9936 -12.9936 -12.9457 -12.9457 -7.8894 -7.8894 -7.8454 -7.8454 -4.1999 -4.1999 -4.1616 -4.1616 -3.8567 -3.8567 -3.7661 -3.7661 -3.5499 -3.5499 -3.5105 -3.5105 -2.0304 -2.0304 -2.0050 -2.0050 -1.9254 -1.9254 -1.7364 -1.7364 -1.6653 -1.6653 -1.5987 -1.5987 -1.5709 -1.5709 -1.5286 -1.5286 -1.4628 -1.4628 -1.4173 -1.4173 -1.0122 -1.0122 -0.9492 -0.9492 -0.8560 -0.8560 -0.7613 -0.7613 -0.6122 -0.6122 -0.5806 -0.5806 -0.5095 -0.5095 -0.4926 -0.4926 -0.1619 -0.1619 -0.1161 -0.1161 -0.1045 -0.1045 -0.0288 -0.0288 2.3638 2.3638 2.4045 2.4045 5.2784 5.2784 5.3889 5.3889 5.8296 5.8296 5.9491 5.9491 7.2717 7.2717 7.4659 7.4659 k = 0.3400 0.1963-0.0000 ( 13440 PWs) bands (ev): -15.0660 -15.0660 -15.0059 -15.0059 -13.8786 -13.8786 -13.8525 -13.8525 -13.7829 -13.7829 -13.7633 -13.7633 -13.2972 -13.2972 -13.2650 -13.2650 -12.9899 -12.9899 -12.9447 -12.9447 -7.8776 -7.8776 -7.8360 -7.8360 -4.2186 -4.2186 -4.1808 -4.1808 -3.8505 -3.8505 -3.7626 -3.7626 -3.5477 -3.5477 -3.5112 -3.5112 -2.0425 -2.0425 -1.9998 -1.9998 -1.9319 -1.9319 -1.7336 -1.7336 -1.6728 -1.6728 -1.5954 -1.5954 -1.5675 -1.5675 -1.5209 -1.5209 -1.4636 -1.4636 -1.4162 -1.4162 -1.0213 -1.0213 -0.9597 -0.9597 -0.8386 -0.8386 -0.7729 -0.7729 -0.6211 -0.6211 -0.5812 -0.5812 -0.5110 -0.5110 -0.4930 -0.4930 -0.1626 -0.1626 -0.1224 -0.1224 -0.1038 -0.1038 -0.0325 -0.0325 2.4016 2.4016 2.4367 2.4367 5.2717 5.2717 5.3866 5.3866 5.8540 5.8540 5.9798 5.9798 7.2952 7.2952 7.4896 7.4896 k = 0.3600 0.2078-0.0000 ( 13424 PWs) bands (ev): -15.0613 -15.0613 -15.0058 -15.0058 -13.8847 -13.8847 -13.8579 -13.8579 -13.7832 -13.7832 -13.7633 -13.7633 -13.2960 -13.2960 -13.2662 -13.2662 -12.9864 -12.9864 -12.9438 -12.9438 -7.8665 -7.8665 -7.8274 -7.8274 -4.2365 -4.2365 -4.1984 -4.1984 -3.8447 -3.8447 -3.7593 -3.7593 -3.5455 -3.5455 -3.5120 -3.5120 -2.0538 -2.0538 -1.9924 -1.9924 -1.9377 -1.9377 -1.7351 -1.7351 -1.6802 -1.6802 -1.5926 -1.5926 -1.5611 -1.5611 -1.5140 -1.5140 -1.4645 -1.4645 -1.4161 -1.4161 -1.0293 -1.0293 -0.9693 -0.9693 -0.8229 -0.8229 -0.7830 -0.7830 -0.6296 -0.6296 -0.5815 -0.5815 -0.5123 -0.5123 -0.4934 -0.4934 -0.1633 -0.1633 -0.1289 -0.1289 -0.1026 -0.1026 -0.0360 -0.0360 2.4367 2.4367 2.4665 2.4665 5.2653 5.2653 5.3836 5.3836 5.8772 5.8772 6.0084 6.0084 7.3185 7.3185 7.4921 7.4921 k = 0.3800 0.2194-0.0000 ( 13442 PWs) bands (ev): -15.0569 -15.0569 -15.0059 -15.0059 -13.8902 -13.8902 -13.8628 -13.8628 -13.7834 -13.7834 -13.7633 -13.7633 -13.2949 -13.2949 -13.2674 -13.2674 -12.9832 -12.9832 -12.9432 -12.9432 -7.8564 -7.8564 -7.8196 -7.8196 -4.2530 -4.2530 -4.2140 -4.2140 -3.8392 -3.8392 -3.7563 -3.7563 -3.5434 -3.5434 -3.5127 -3.5127 -2.0639 -2.0639 -1.9835 -1.9835 -1.9427 -1.9427 -1.7406 -1.7406 -1.6870 -1.6870 -1.5903 -1.5903 -1.5527 -1.5527 -1.5080 -1.5080 -1.4656 -1.4656 -1.4167 -1.4167 -1.0363 -1.0363 -0.9778 -0.9778 -0.8093 -0.8093 -0.7910 -0.7910 -0.6375 -0.6375 -0.5815 -0.5815 -0.5135 -0.5135 -0.4939 -0.4939 -0.1639 -0.1639 -0.1351 -0.1351 -0.1013 -0.1013 -0.0393 -0.0393 2.4685 2.4685 2.4934 2.4934 5.2595 5.2595 5.3803 5.3803 5.8988 5.8988 6.0344 6.0344 7.3412 7.3412 7.4919 7.4919 k = 0.4000 0.2309-0.0000 ( 13454 PWs) bands (ev): -15.0528 -15.0528 -15.0062 -15.0062 -13.8950 -13.8950 -13.8671 -13.8671 -13.7836 -13.7836 -13.7633 -13.7633 -13.2938 -13.2938 -13.2685 -13.2685 -12.9804 -12.9804 -12.9426 -12.9426 -7.8475 -7.8475 -7.8128 -7.8128 -4.2677 -4.2677 -4.2275 -4.2275 -3.8343 -3.8343 -3.7535 -3.7535 -3.5414 -3.5414 -3.5134 -3.5134 -2.0726 -2.0726 -1.9737 -1.9737 -1.9468 -1.9468 -1.7489 -1.7489 -1.6930 -1.6930 -1.5884 -1.5884 -1.5432 -1.5432 -1.5029 -1.5029 -1.4667 -1.4667 -1.4181 -1.4181 -1.0420 -1.0420 -0.9853 -0.9853 -0.8026 -0.8026 -0.7927 -0.7927 -0.6446 -0.6446 -0.5814 -0.5814 -0.5145 -0.5145 -0.4944 -0.4944 -0.1644 -0.1644 -0.1409 -0.1409 -0.0999 -0.0999 -0.0424 -0.0424 2.4965 2.4965 2.5168 2.5168 5.2544 5.2544 5.3767 5.3767 5.9181 5.9181 6.0573 6.0573 7.3631 7.3631 7.4900 7.4900 k = 0.4200 0.2425-0.0000 ( 13464 PWs) bands (ev): -15.0491 -15.0491 -15.0066 -15.0066 -13.8990 -13.8990 -13.8707 -13.8707 -13.7838 -13.7838 -13.7633 -13.7633 -13.2928 -13.2928 -13.2695 -13.2695 -12.9780 -12.9780 -12.9423 -12.9423 -7.8399 -7.8399 -7.8072 -7.8072 -4.2803 -4.2803 -4.2389 -4.2389 -3.8301 -3.8301 -3.7512 -3.7512 -3.5397 -3.5397 -3.5141 -3.5141 -2.0799 -2.0799 -1.9639 -1.9639 -1.9499 -1.9499 -1.7589 -1.7589 -1.6979 -1.6979 -1.5867 -1.5867 -1.5337 -1.5337 -1.4988 -1.4988 -1.4678 -1.4678 -1.4198 -1.4198 -1.0467 -1.0467 -0.9915 -0.9915 -0.8063 -0.8063 -0.7846 -0.7846 -0.6506 -0.6506 -0.5812 -0.5812 -0.5152 -0.5152 -0.4948 -0.4948 -0.1646 -0.1646 -0.1461 -0.1461 -0.0985 -0.0985 -0.0451 -0.0451 2.5204 2.5204 2.5364 2.5364 5.2500 5.2500 5.3734 5.3734 5.9347 5.9347 6.0767 6.0767 7.3838 7.3838 7.4862 7.4862 k = 0.4400 0.2540-0.0000 ( 13470 PWs) bands (ev): -15.0460 -15.0460 -15.0072 -15.0072 -13.9022 -13.9022 -13.8736 -13.8736 -13.7839 -13.7839 -13.7633 -13.7633 -13.2919 -13.2919 -13.2703 -13.2703 -12.9761 -12.9761 -12.9420 -12.9420 -7.8338 -7.8338 -7.8027 -7.8027 -4.2903 -4.2903 -4.2479 -4.2479 -3.8267 -3.8267 -3.7493 -3.7493 -3.5382 -3.5382 -3.5147 -3.5147 -2.0855 -2.0855 -1.9571 -1.9571 -1.9494 -1.9494 -1.7692 -1.7692 -1.7019 -1.7019 -1.5854 -1.5854 -1.5251 -1.5251 -1.4957 -1.4957 -1.4686 -1.4686 -1.4218 -1.4218 -1.0502 -1.0502 -0.9964 -0.9964 -0.8103 -0.8103 -0.7769 -0.7769 -0.6555 -0.6555 -0.5810 -0.5810 -0.5158 -0.5158 -0.4952 -0.4952 -0.1645 -0.1645 -0.1507 -0.1507 -0.0972 -0.0972 -0.0473 -0.0473 2.5396 2.5396 2.5518 2.5518 5.2465 5.2465 5.3705 5.3705 5.9480 5.9480 6.0921 6.0921 7.4031 7.4031 7.4807 7.4807 k = 0.4600 0.2656-0.0000 ( 13480 PWs) bands (ev): -15.0436 -15.0436 -15.0076 -15.0076 -13.9045 -13.9045 -13.8756 -13.8756 -13.7840 -13.7840 -13.7633 -13.7633 -13.2912 -13.2912 -13.2710 -13.2710 -12.9747 -12.9747 -12.9418 -12.9418 -7.8293 -7.8293 -7.7994 -7.7994 -4.2977 -4.2977 -4.2544 -4.2544 -3.8242 -3.8242 -3.7480 -3.7480 -3.5371 -3.5371 -3.5152 -3.5152 -2.0896 -2.0896 -1.9569 -1.9569 -1.9429 -1.9429 -1.7783 -1.7783 -1.7047 -1.7047 -1.5844 -1.5844 -1.5181 -1.5181 -1.4936 -1.4936 -1.4693 -1.4693 -1.4237 -1.4237 -1.0527 -1.0527 -1.0000 -1.0000 -0.8132 -0.8132 -0.7714 -0.7714 -0.6591 -0.6591 -0.5808 -0.5808 -0.5162 -0.5162 -0.4955 -0.4955 -0.1639 -0.1639 -0.1546 -0.1546 -0.0962 -0.0962 -0.0491 -0.0491 2.5539 2.5539 2.5627 2.5627 5.2440 5.2440 5.3682 5.3682 5.9579 5.9579 6.1034 6.1034 7.4206 7.4206 7.4733 7.4733 k = 0.4800 0.2771-0.0000 ( 13484 PWs) bands (ev): -15.0421 -15.0421 -15.0080 -15.0080 -13.9059 -13.9059 -13.8769 -13.8769 -13.7841 -13.7841 -13.7633 -13.7633 -13.2908 -13.2908 -13.2715 -13.2715 -12.9738 -12.9738 -12.9417 -12.9417 -7.8266 -7.8266 -7.7975 -7.7975 -4.3021 -4.3021 -4.2584 -4.2584 -3.8227 -3.8227 -3.7471 -3.7471 -3.5365 -3.5365 -3.5155 -3.5155 -2.0921 -2.0921 -1.9578 -1.9578 -1.9373 -1.9373 -1.7847 -1.7847 -1.7064 -1.7064 -1.5838 -1.5838 -1.5135 -1.5135 -1.4924 -1.4924 -1.4697 -1.4697 -1.4250 -1.4250 -1.0542 -1.0542 -1.0021 -1.0021 -0.8149 -0.8149 -0.7680 -0.7680 -0.6613 -0.6613 -0.5807 -0.5807 -0.5164 -0.5164 -0.4957 -0.4957 -0.1629 -0.1629 -0.1577 -0.1577 -0.0956 -0.0956 -0.0502 -0.0502 2.5629 2.5629 2.5689 2.5689 5.2424 5.2424 5.3668 5.3668 5.9639 5.9639 6.1102 6.1102 7.4358 7.4358 7.4643 7.4643 k = 0.5000 0.2887-0.0000 ( 13474 PWs) bands (ev): -15.0416 -15.0416 -15.0081 -15.0081 -13.9064 -13.9064 -13.8773 -13.8773 -13.7841 -13.7841 -13.7633 -13.7633 -13.2906 -13.2906 -13.2716 -13.2716 -12.9735 -12.9735 -12.9417 -12.9417 -7.8256 -7.8256 -7.7968 -7.7968 -4.3036 -4.3036 -4.2597 -4.2597 -3.8222 -3.8222 -3.7468 -3.7468 -3.5362 -3.5362 -3.5156 -3.5156 -2.0929 -2.0929 -1.9581 -1.9581 -1.9352 -1.9352 -1.7870 -1.7870 -1.7070 -1.7070 -1.5836 -1.5836 -1.5119 -1.5119 -1.4920 -1.4920 -1.4699 -1.4699 -1.4255 -1.4255 -1.0547 -1.0547 -1.0028 -1.0028 -0.8154 -0.8154 -0.7669 -0.7669 -0.6620 -0.6620 -0.5806 -0.5806 -0.5165 -0.5165 -0.4958 -0.4958 -0.1620 -0.1620 -0.1592 -0.1592 -0.0954 -0.0954 -0.0505 -0.0505 2.5661 2.5661 2.5709 2.5709 5.2419 5.2419 5.3663 5.3663 5.9659 5.9659 6.1125 6.1125 7.4449 7.4449 7.4572 7.4572 k = 0.5000 0.2887-0.0000 ( 13474 PWs) bands (ev): -15.0416 -15.0416 -15.0081 -15.0081 -13.9064 -13.9064 -13.8773 -13.8773 -13.7841 -13.7841 -13.7633 -13.7633 -13.2906 -13.2906 -13.2716 -13.2716 -12.9735 -12.9735 -12.9417 -12.9417 -7.8256 -7.8256 -7.7968 -7.7968 -4.3036 -4.3036 -4.2597 -4.2597 -3.8222 -3.8222 -3.7468 -3.7468 -3.5362 -3.5362 -3.5156 -3.5156 -2.0929 -2.0929 -1.9581 -1.9581 -1.9352 -1.9352 -1.7870 -1.7870 -1.7070 -1.7070 -1.5836 -1.5836 -1.5119 -1.5119 -1.4920 -1.4920 -1.4699 -1.4699 -1.4255 -1.4255 -1.0547 -1.0547 -1.0028 -1.0028 -0.8154 -0.8154 -0.7669 -0.7669 -0.6620 -0.6620 -0.5806 -0.5806 -0.5165 -0.5165 -0.4958 -0.4958 -0.1620 -0.1620 -0.1592 -0.1592 -0.0954 -0.0954 -0.0505 -0.0505 2.5661 2.5661 2.5709 2.5709 5.2419 5.2419 5.3663 5.3663 5.9659 5.9659 6.1125 6.1125 7.4449 7.4449 7.4572 7.4572 k = 0.4889 0.3079-0.0000 ( 13476 PWs) bands (ev): -15.0415 -15.0415 -15.0082 -15.0082 -13.9066 -13.9066 -13.8773 -13.8773 -13.7841 -13.7841 -13.7633 -13.7633 -13.2906 -13.2906 -13.2716 -13.2716 -12.9734 -12.9734 -12.9417 -12.9417 -7.8253 -7.8253 -7.7966 -7.7966 -4.3061 -4.3061 -4.2582 -4.2582 -3.8232 -3.8232 -3.7453 -3.7453 -3.5363 -3.5363 -3.5156 -3.5156 -2.0946 -2.0946 -1.9559 -1.9559 -1.9350 -1.9350 -1.7876 -1.7876 -1.7063 -1.7063 -1.5850 -1.5850 -1.5122 -1.5122 -1.4914 -1.4914 -1.4679 -1.4679 -1.4262 -1.4262 -1.0573 -1.0573 -1.0043 -1.0043 -0.8132 -0.8132 -0.7660 -0.7660 -0.6617 -0.6617 -0.5809 -0.5809 -0.5170 -0.5170 -0.4964 -0.4964 -0.1650 -0.1650 -0.1566 -0.1566 -0.0953 -0.0953 -0.0505 -0.0505 2.5673 2.5673 2.5721 2.5721 5.2402 5.2402 5.3686 5.3686 5.9645 5.9645 6.1126 6.1126 7.4452 7.4452 7.4577 7.4577 k = 0.4778 0.3272-0.0000 ( 13464 PWs) bands (ev): -15.0411 -15.0411 -15.0082 -15.0082 -13.9073 -13.9073 -13.8773 -13.8773 -13.7842 -13.7842 -13.7633 -13.7633 -13.2905 -13.2905 -13.2718 -13.2718 -12.9730 -12.9730 -12.9418 -12.9418 -7.8244 -7.8244 -7.7961 -7.7961 -4.3127 -4.3127 -4.2545 -4.2545 -3.8261 -3.8261 -3.7408 -3.7408 -3.5364 -3.5364 -3.5155 -3.5155 -2.0993 -2.0993 -1.9500 -1.9500 -1.9342 -1.9342 -1.7894 -1.7894 -1.7042 -1.7042 -1.5891 -1.5891 -1.5129 -1.5129 -1.4897 -1.4897 -1.4622 -1.4622 -1.4281 -1.4281 -1.0647 -1.0647 -1.0087 -1.0087 -0.8067 -0.8067 -0.7633 -0.7633 -0.6609 -0.6609 -0.5819 -0.5819 -0.5186 -0.5186 -0.4981 -0.4981 -0.1692 -0.1692 -0.1533 -0.1533 -0.0951 -0.0951 -0.0504 -0.0504 2.5711 2.5711 2.5759 2.5759 5.2356 5.2356 5.3751 5.3751 5.9604 5.9604 6.1129 6.1129 7.4461 7.4461 7.4591 7.4591 k = 0.4667 0.3464-0.0000 ( 13466 PWs) bands (ev): -15.0404 -15.0404 -15.0083 -15.0083 -13.9085 -13.9085 -13.8773 -13.8773 -13.7843 -13.7843 -13.7634 -13.7634 -13.2902 -13.2902 -13.2720 -13.2720 -12.9723 -12.9723 -12.9420 -12.9420 -7.8228 -7.8228 -7.7953 -7.7953 -4.3217 -4.3217 -4.2502 -4.2502 -3.8300 -3.8300 -3.7343 -3.7343 -3.5366 -3.5366 -3.5154 -3.5154 -2.1062 -2.1062 -1.9417 -1.9417 -1.9321 -1.9321 -1.7924 -1.7924 -1.7009 -1.7009 -1.5954 -1.5954 -1.5137 -1.5137 -1.4872 -1.4872 -1.4534 -1.4534 -1.4314 -1.4314 -1.0761 -1.0761 -1.0160 -1.0160 -0.7969 -0.7969 -0.7589 -0.7589 -0.6595 -0.6595 -0.5834 -0.5834 -0.5211 -0.5211 -0.5010 -0.5010 -0.1738 -0.1738 -0.1503 -0.1503 -0.0949 -0.0949 -0.0501 -0.0501 2.5771 2.5771 2.5819 2.5819 5.2287 5.2287 5.3850 5.3850 5.9538 5.9538 6.1133 6.1133 7.4475 7.4475 7.4613 7.4613 k = 0.4556 0.3657-0.0000 ( 13456 PWs) bands (ev): -15.0395 -15.0395 -15.0084 -15.0084 -13.9100 -13.9100 -13.8774 -13.8774 -13.7845 -13.7845 -13.7635 -13.7635 -13.2899 -13.2899 -13.2723 -13.2723 -12.9713 -12.9713 -12.9423 -12.9423 -7.8207 -7.8207 -7.7942 -7.7942 -4.3320 -4.3320 -4.2463 -4.2463 -3.8344 -3.8344 -3.7264 -3.7264 -3.5369 -3.5369 -3.5152 -3.5152 -2.1144 -2.1144 -1.9355 -1.9355 -1.9252 -1.9252 -1.7963 -1.7963 -1.6964 -1.6964 -1.6034 -1.6034 -1.5141 -1.5141 -1.4843 -1.4843 -1.4423 -1.4423 -1.4356 -1.4356 -1.0902 -1.0902 -1.0259 -1.0259 -0.7848 -0.7848 -0.7530 -0.7530 -0.6575 -0.6575 -0.5856 -0.5856 -0.5246 -0.5246 -0.5051 -0.5051 -0.1785 -0.1785 -0.1477 -0.1477 -0.0947 -0.0947 -0.0498 -0.0498 2.5852 2.5852 2.5900 2.5900 5.2205 5.2205 5.3974 5.3974 5.9449 5.9449 6.1139 6.1139 7.4494 7.4494 7.4643 7.4643 k = 0.4444 0.3849-0.0000 ( 13448 PWs) bands (ev): -15.0383 -15.0383 -15.0086 -15.0086 -13.9118 -13.9118 -13.8776 -13.8776 -13.7847 -13.7847 -13.7637 -13.7637 -13.2895 -13.2895 -13.2727 -13.2727 -12.9702 -12.9702 -12.9426 -12.9426 -7.8180 -7.8180 -7.7929 -7.7929 -4.3429 -4.3429 -4.2433 -4.2433 -3.8386 -3.8386 -3.7178 -3.7178 -3.5372 -3.5372 -3.5150 -3.5150 -2.1233 -2.1233 -1.9326 -1.9326 -1.9130 -1.9130 -1.8010 -1.8010 -1.6910 -1.6910 -1.6126 -1.6126 -1.5143 -1.5143 -1.4811 -1.4811 -1.4418 -1.4418 -1.4282 -1.4282 -1.1060 -1.1060 -1.0383 -1.0383 -0.7714 -0.7714 -0.7455 -0.7455 -0.6550 -0.6550 -0.5883 -0.5883 -0.5289 -0.5289 -0.5101 -0.5101 -0.1832 -0.1832 -0.1454 -0.1454 -0.0945 -0.0945 -0.0493 -0.0493 2.5950 2.5950 2.6000 2.6000 5.2116 5.2116 5.4116 5.4116 5.9340 5.9340 6.1147 6.1147 7.4518 7.4518 7.4680 7.4680 k = 0.4333 0.4041-0.0000 ( 13451 PWs) bands (ev): -15.0369 -15.0369 -15.0089 -15.0089 -13.9138 -13.9138 -13.8778 -13.8778 -13.7849 -13.7849 -13.7638 -13.7638 -13.2890 -13.2890 -13.2732 -13.2732 -12.9688 -12.9688 -12.9430 -12.9430 -7.8150 -7.8150 -7.7914 -7.7914 -4.3540 -4.3540 -4.2413 -4.2413 -3.8425 -3.8425 -3.7089 -3.7089 -3.5376 -3.5376 -3.5147 -3.5147 -2.1323 -2.1323 -1.9302 -1.9302 -1.8989 -1.8989 -1.8063 -1.8063 -1.6852 -1.6852 -1.6222 -1.6222 -1.5142 -1.5142 -1.4780 -1.4780 -1.4485 -1.4485 -1.4129 -1.4129 -1.1227 -1.1227 -1.0529 -1.0529 -0.7576 -0.7576 -0.7367 -0.7367 -0.6520 -0.6520 -0.5915 -0.5915 -0.5340 -0.5340 -0.5161 -0.5161 -0.1878 -0.1878 -0.1435 -0.1435 -0.0946 -0.0946 -0.0487 -0.0487 2.6061 2.6061 2.6114 2.6114 5.2024 5.2024 5.4269 5.4269 5.9215 5.9215 6.1156 6.1156 7.4547 7.4547 7.4721 7.4721 k = 0.4222 0.4234-0.0000 ( 13447 PWs) bands (ev): -15.0353 -15.0353 -15.0093 -15.0093 -13.9159 -13.9159 -13.8781 -13.8781 -13.7852 -13.7852 -13.7639 -13.7639 -13.2884 -13.2884 -13.2738 -13.2738 -12.9673 -12.9673 -12.9436 -12.9436 -7.8116 -7.8116 -7.7898 -7.7898 -4.3649 -4.3649 -4.2404 -4.2404 -3.8457 -3.8457 -3.7001 -3.7001 -3.5380 -3.5380 -3.5145 -3.5145 -2.1410 -2.1410 -1.9275 -1.9275 -1.8841 -1.8841 -1.8118 -1.8118 -1.6802 -1.6802 -1.6307 -1.6307 -1.5140 -1.5140 -1.4750 -1.4750 -1.4559 -1.4559 -1.3960 -1.3960 -1.1394 -1.1394 -1.0695 -1.0695 -0.7438 -0.7438 -0.7267 -0.7267 -0.6485 -0.6485 -0.5953 -0.5953 -0.5397 -0.5397 -0.5230 -0.5230 -0.1923 -0.1923 -0.1419 -0.1419 -0.0948 -0.0948 -0.0481 -0.0481 2.6181 2.6181 2.6238 2.6238 5.1934 5.1934 5.4429 5.4429 5.9078 5.9078 6.1168 6.1168 7.4580 7.4580 7.4766 7.4766 k = 0.4111 0.4426-0.0000 ( 13447 PWs) bands (ev): -15.0336 -15.0336 -15.0098 -15.0098 -13.9181 -13.9181 -13.8785 -13.8785 -13.7855 -13.7855 -13.7641 -13.7641 -13.2878 -13.2878 -13.2745 -13.2745 -12.9656 -12.9656 -12.9442 -12.9442 -7.8079 -7.8079 -7.7883 -7.7883 -4.3754 -4.3754 -4.2405 -4.2405 -3.8483 -3.8483 -3.6917 -3.6917 -3.5383 -3.5383 -3.5143 -3.5143 -2.1491 -2.1491 -1.9244 -1.9244 -1.8694 -1.8694 -1.8174 -1.8174 -1.6786 -1.6786 -1.6356 -1.6356 -1.5140 -1.5140 -1.4726 -1.4726 -1.4636 -1.4636 -1.3777 -1.3777 -1.1558 -1.1558 -1.0876 -1.0876 -0.7306 -0.7306 -0.7159 -0.7159 -0.6445 -0.6445 -0.5995 -0.5995 -0.5459 -0.5459 -0.5305 -0.5305 -0.1965 -0.1965 -0.1405 -0.1405 -0.0951 -0.0951 -0.0473 -0.0473 2.6305 2.6305 2.6367 2.6367 5.1848 5.1848 5.4591 5.4591 5.8936 5.8936 6.1181 6.1181 7.4617 7.4617 7.4811 7.4811 k = 0.4000 0.4619-0.0000 ( 13451 PWs) bands (ev): -15.0316 -15.0316 -15.0105 -15.0105 -13.9203 -13.9203 -13.8790 -13.8790 -13.7857 -13.7857 -13.7642 -13.7642 -13.2870 -13.2870 -13.2752 -13.2752 -12.9638 -12.9638 -12.9450 -12.9450 -7.8042 -7.8042 -7.7868 -7.7868 -4.3851 -4.3851 -4.2414 -4.2414 -3.8502 -3.8502 -3.6840 -3.6840 -3.5386 -3.5386 -3.5142 -3.5142 -2.1565 -2.1565 -1.9209 -1.9209 -1.8557 -1.8557 -1.8220 -1.8220 -1.6831 -1.6831 -1.6343 -1.6343 -1.5145 -1.5145 -1.4735 -1.4735 -1.4682 -1.4682 -1.3584 -1.3584 -1.1714 -1.1714 -1.1068 -1.1068 -0.7180 -0.7180 -0.7048 -0.7048 -0.6400 -0.6400 -0.6041 -0.6041 -0.5526 -0.5526 -0.5385 -0.5385 -0.2003 -0.2003 -0.1393 -0.1393 -0.0957 -0.0957 -0.0466 -0.0466 2.6427 2.6427 2.6496 2.6496 5.1768 5.1768 5.4749 5.4749 5.8793 5.8793 6.1197 6.1197 7.4656 7.4656 7.4854 7.4854 k = 0.3889 0.4811-0.0000 ( 13443 PWs) bands (ev): -15.0296 -15.0296 -15.0113 -15.0113 -13.9223 -13.9223 -13.8796 -13.8796 -13.7859 -13.7859 -13.7643 -13.7643 -13.2862 -13.2862 -13.2761 -13.2761 -12.9619 -12.9619 -12.9458 -12.9458 -7.8004 -7.8004 -7.7855 -7.7855 -4.3939 -4.3939 -4.2429 -4.2429 -3.8515 -3.8515 -3.6770 -3.6770 -3.5389 -3.5389 -3.5141 -3.5141 -2.1630 -2.1630 -1.9168 -1.9168 -1.8464 -1.8464 -1.8225 -1.8225 -1.6924 -1.6924 -1.6280 -1.6280 -1.5160 -1.5160 -1.4798 -1.4798 -1.4668 -1.4668 -1.3382 -1.3382 -1.1859 -1.1859 -1.1268 -1.1268 -0.7061 -0.7061 -0.6939 -0.6939 -0.6351 -0.6351 -0.6090 -0.6090 -0.5597 -0.5597 -0.5466 -0.5466 -0.2038 -0.2038 -0.1384 -0.1384 -0.0964 -0.0964 -0.0458 -0.0458 2.6543 2.6543 2.6619 2.6619 5.1697 5.1697 5.4899 5.4899 5.8656 5.8656 6.1214 6.1214 7.4698 7.4698 7.4893 7.4893 k = 0.3778 0.5004-0.0000 ( 13443 PWs) bands (ev): -15.0274 -15.0274 -15.0123 -15.0123 -13.9241 -13.9241 -13.8801 -13.8801 -13.7862 -13.7862 -13.7644 -13.7644 -13.2853 -13.2853 -13.2770 -13.2770 -12.9599 -12.9599 -12.9468 -12.9468 -7.7967 -7.7967 -7.7845 -7.7845 -4.4014 -4.4014 -4.2447 -4.2447 -3.8523 -3.8523 -3.6711 -3.6711 -3.5391 -3.5391 -3.5140 -3.5140 -2.1685 -2.1685 -1.9121 -1.9121 -1.8462 -1.8462 -1.8143 -1.8143 -1.7041 -1.7041 -1.6194 -1.6194 -1.5191 -1.5191 -1.4851 -1.4851 -1.4651 -1.4651 -1.3175 -1.3175 -1.1992 -1.1992 -1.1470 -1.1470 -0.6949 -0.6949 -0.6839 -0.6839 -0.6299 -0.6299 -0.6138 -0.6138 -0.5672 -0.5672 -0.5544 -0.5544 -0.2068 -0.2068 -0.1377 -0.1377 -0.0971 -0.0971 -0.0452 -0.0452 2.6647 2.6647 2.6731 2.6731 5.1635 5.1635 5.5033 5.5033 5.8533 5.8533 6.1231 6.1231 7.4740 7.4740 7.4925 7.4925 k = 0.3667 0.5196-0.0000 ( 13447 PWs) bands (ev): -15.0253 -15.0253 -15.0135 -15.0135 -13.9256 -13.9256 -13.8806 -13.8806 -13.7863 -13.7863 -13.7644 -13.7644 -13.2844 -13.2844 -13.2779 -13.2779 -12.9580 -12.9580 -12.9480 -12.9480 -7.7933 -7.7933 -7.7839 -7.7839 -4.4076 -4.4076 -4.2466 -4.2466 -3.8528 -3.8528 -3.6664 -3.6664 -3.5392 -3.5392 -3.5139 -3.5139 -2.1728 -2.1728 -1.9071 -1.9071 -1.8508 -1.8508 -1.8020 -1.8020 -1.7165 -1.7165 -1.6106 -1.6106 -1.5235 -1.5235 -1.4884 -1.4884 -1.4637 -1.4637 -1.2964 -1.2964 -1.2109 -1.2109 -1.1670 -1.1670 -0.6845 -0.6845 -0.6754 -0.6754 -0.6256 -0.6256 -0.6172 -0.6172 -0.5750 -0.5750 -0.5614 -0.5614 -0.2091 -0.2091 -0.1371 -0.1371 -0.0977 -0.0977 -0.0447 -0.0447 2.6735 2.6735 2.6826 2.6826 5.1586 5.1586 5.5144 5.5144 5.8430 5.8430 6.1249 6.1249 7.4783 7.4783 7.4946 7.4946 k = 0.3556 0.5389-0.0000 ( 13447 PWs) bands (ev): -15.0230 -15.0230 -15.0150 -15.0150 -13.9268 -13.9268 -13.8811 -13.8811 -13.7865 -13.7865 -13.7645 -13.7645 -13.2833 -13.2833 -13.2789 -13.2789 -12.9561 -12.9561 -12.9493 -12.9493 -7.7902 -7.7902 -7.7839 -7.7839 -4.4122 -4.4122 -4.2482 -4.2482 -3.8530 -3.8530 -3.6629 -3.6629 -3.5392 -3.5392 -3.5139 -3.5139 -2.1760 -2.1760 -1.9020 -1.9020 -1.8564 -1.8564 -1.7893 -1.7893 -1.7287 -1.7287 -1.6029 -1.6029 -1.5282 -1.5282 -1.4901 -1.4901 -1.4626 -1.4626 -1.2757 -1.2757 -1.2205 -1.2205 -1.1864 -1.1864 -0.6755 -0.6755 -0.6690 -0.6690 -0.6269 -0.6269 -0.6143 -0.6143 -0.5830 -0.5830 -0.5669 -0.5669 -0.2109 -0.2109 -0.1368 -0.1368 -0.0983 -0.0983 -0.0443 -0.0443 2.6803 2.6803 2.6899 2.6899 5.1549 5.1549 5.5228 5.5228 5.8354 5.8354 6.1264 6.1264 7.4824 7.4824 7.4955 7.4955 k = 0.3444 0.5581-0.0000 ( 13459 PWs) bands (ev): -15.0208 -15.0208 -15.0167 -15.0167 -13.9275 -13.9275 -13.8814 -13.8814 -13.7865 -13.7865 -13.7645 -13.7645 -13.2823 -13.2823 -13.2800 -13.2800 -12.9542 -12.9542 -12.9508 -12.9508 -7.7877 -7.7877 -7.7844 -7.7844 -4.4151 -4.4151 -4.2494 -4.2494 -3.8530 -3.8530 -3.6608 -3.6608 -3.5392 -3.5392 -3.5139 -3.5139 -2.1779 -2.1779 -1.8975 -1.8975 -1.8613 -1.8613 -1.7783 -1.7783 -1.7394 -1.7394 -1.5978 -1.5978 -1.5316 -1.5316 -1.4908 -1.4908 -1.4619 -1.4619 -1.2572 -1.2572 -1.2265 -1.2265 -1.2042 -1.2042 -0.6688 -0.6688 -0.6651 -0.6651 -0.6305 -0.6305 -0.6081 -0.6081 -0.5909 -0.5909 -0.5703 -0.5703 -0.2120 -0.2120 -0.1366 -0.1366 -0.0986 -0.0986 -0.0441 -0.0441 2.6846 2.6846 2.6945 2.6945 5.1526 5.1526 5.5279 5.5279 5.8308 5.8308 6.1275 6.1275 7.4862 7.4862 7.4950 7.4950 k = 0.3333 0.5774-0.0000 ( 13467 PWs) bands (ev): -15.0187 -15.0187 -15.0186 -15.0186 -13.9278 -13.9278 -13.8815 -13.8815 -13.7866 -13.7866 -13.7645 -13.7645 -13.2812 -13.2812 -13.2810 -13.2810 -12.9524 -12.9524 -12.9524 -12.9524 -7.7861 -7.7861 -7.7853 -7.7853 -4.4161 -4.4161 -4.2499 -4.2499 -3.8530 -3.8530 -3.6601 -3.6601 -3.5392 -3.5392 -3.5139 -3.5139 -2.1786 -2.1786 -1.8954 -1.8954 -1.8635 -1.8635 -1.7731 -1.7731 -1.7445 -1.7445 -1.5961 -1.5961 -1.5327 -1.5327 -1.4909 -1.4909 -1.4616 -1.4616 -1.2491 -1.2491 -1.2236 -1.2236 -1.2171 -1.2171 -0.6661 -0.6661 -0.6638 -0.6638 -0.6321 -0.6321 -0.6034 -0.6034 -0.5960 -0.5960 -0.5715 -0.5715 -0.2124 -0.2124 -0.1365 -0.1365 -0.0988 -0.0988 -0.0440 -0.0440 2.6861 2.6861 2.6961 2.6961 5.1518 5.1518 5.5296 5.5296 5.8293 5.8293 6.1280 6.1280 7.4883 7.4883 7.4940 7.4940 k = 0.3333 0.5774-0.0000 ( 13467 PWs) bands (ev): -15.0187 -15.0187 -15.0186 -15.0186 -13.9278 -13.9278 -13.8815 -13.8815 -13.7866 -13.7866 -13.7645 -13.7645 -13.2812 -13.2812 -13.2810 -13.2810 -12.9524 -12.9524 -12.9524 -12.9524 -7.7861 -7.7861 -7.7853 -7.7853 -4.4161 -4.4161 -4.2499 -4.2499 -3.8530 -3.8530 -3.6601 -3.6601 -3.5392 -3.5392 -3.5139 -3.5139 -2.1786 -2.1786 -1.8954 -1.8954 -1.8635 -1.8635 -1.7731 -1.7731 -1.7445 -1.7445 -1.5961 -1.5961 -1.5327 -1.5327 -1.4909 -1.4909 -1.4616 -1.4616 -1.2491 -1.2491 -1.2236 -1.2236 -1.2171 -1.2171 -0.6661 -0.6661 -0.6638 -0.6638 -0.6321 -0.6321 -0.6034 -0.6034 -0.5960 -0.5960 -0.5715 -0.5715 -0.2124 -0.2124 -0.1365 -0.1365 -0.0988 -0.0988 -0.0440 -0.0440 2.6861 2.6861 2.6961 2.6961 5.1518 5.1518 5.5296 5.5296 5.8293 5.8293 6.1280 6.1280 7.4883 7.4883 7.4940 7.4940 k = 0.3218 0.5574-0.0000 ( 13461 PWs) bands (ev): -15.0210 -15.0210 -15.0165 -15.0165 -13.9275 -13.9275 -13.8814 -13.8814 -13.7865 -13.7865 -13.7645 -13.7645 -13.2824 -13.2824 -13.2799 -13.2799 -12.9543 -12.9543 -12.9507 -12.9507 -7.7878 -7.7878 -7.7844 -7.7844 -4.4150 -4.4150 -4.2493 -4.2493 -3.8531 -3.8531 -3.6609 -3.6609 -3.5393 -3.5393 -3.5139 -3.5139 -2.1779 -2.1779 -1.8980 -1.8980 -1.8608 -1.8608 -1.7782 -1.7782 -1.7395 -1.7395 -1.5976 -1.5976 -1.5319 -1.5319 -1.4909 -1.4909 -1.4619 -1.4619 -1.2539 -1.2539 -1.2321 -1.2321 -1.2016 -1.2016 -0.6689 -0.6689 -0.6652 -0.6652 -0.6303 -0.6303 -0.6081 -0.6081 -0.5908 -0.5908 -0.5703 -0.5703 -0.2120 -0.2120 -0.1366 -0.1366 -0.0986 -0.0986 -0.0441 -0.0441 2.6844 2.6844 2.6943 2.6943 5.1527 5.1527 5.5279 5.5279 5.8307 5.8307 6.1274 6.1274 7.4853 7.4853 7.4958 7.4958 k = 0.3103 0.5375-0.0000 ( 13437 PWs) bands (ev): -15.0237 -15.0237 -15.0145 -15.0145 -13.9266 -13.9266 -13.8809 -13.8809 -13.7864 -13.7864 -13.7645 -13.7645 -13.2836 -13.2836 -13.2787 -13.2787 -12.9564 -12.9564 -12.9491 -12.9491 -7.7909 -7.7909 -7.7840 -7.7840 -4.4117 -4.4117 -4.2475 -4.2475 -3.8532 -3.8532 -3.6631 -3.6631 -3.5394 -3.5394 -3.5138 -3.5138 -2.1757 -2.1757 -1.9045 -1.9045 -1.8540 -1.8540 -1.7878 -1.7878 -1.7300 -1.7300 -1.6012 -1.6012 -1.5305 -1.5305 -1.4910 -1.4910 -1.4627 -1.4627 -1.2639 -1.2639 -1.2363 -1.2363 -1.1805 -1.1805 -0.6761 -0.6761 -0.6690 -0.6690 -0.6264 -0.6264 -0.6138 -0.6138 -0.5832 -0.5832 -0.5671 -0.5671 -0.2108 -0.2108 -0.1367 -0.1367 -0.0982 -0.0982 -0.0442 -0.0442 2.6791 2.6791 2.6887 2.6887 5.1552 5.1552 5.5233 5.5233 5.8343 5.8343 6.1254 6.1254 7.4783 7.4783 7.4987 7.4987 k = 0.2989 0.5176-0.0000 ( 13447 PWs) bands (ev): -15.0267 -15.0267 -15.0126 -15.0126 -13.9250 -13.9250 -13.8801 -13.8801 -13.7863 -13.7863 -13.7645 -13.7645 -13.2849 -13.2849 -13.2774 -13.2774 -12.9587 -12.9587 -12.9477 -12.9477 -7.7949 -7.7949 -7.7845 -7.7845 -4.4060 -4.4060 -4.2444 -4.2444 -3.8536 -3.8536 -3.6667 -3.6667 -3.5396 -3.5396 -3.5138 -3.5138 -2.1721 -2.1721 -1.9131 -1.9131 -1.8452 -1.8452 -1.7976 -1.7976 -1.7199 -1.7199 -1.6057 -1.6057 -1.5297 -1.5297 -1.4918 -1.4918 -1.4641 -1.4641 -1.2753 -1.2753 -1.2346 -1.2346 -1.1589 -1.1589 -0.6859 -0.6859 -0.6747 -0.6747 -0.6242 -0.6242 -0.6161 -0.6161 -0.5754 -0.5754 -0.5625 -0.5625 -0.2087 -0.2087 -0.1368 -0.1368 -0.0977 -0.0977 -0.0444 -0.0444 2.6699 2.6699 2.6793 2.6793 5.1593 5.1593 5.5165 5.5165 5.8391 5.8391 6.1217 6.1217 7.4685 7.4685 7.5014 7.5014 k = 0.2874 0.4977-0.0000 ( 13445 PWs) bands (ev): -15.0300 -15.0300 -15.0109 -15.0109 -13.9227 -13.9227 -13.8788 -13.8788 -13.7861 -13.7861 -13.7644 -13.7644 -13.2862 -13.2862 -13.2760 -13.2760 -12.9612 -12.9612 -12.9465 -12.9465 -7.7999 -7.7999 -7.7861 -7.7861 -4.3979 -4.3979 -4.2397 -4.2397 -3.8541 -3.8541 -3.6716 -3.6716 -3.5400 -3.5400 -3.5136 -3.5136 -2.1671 -2.1671 -1.9230 -1.9230 -1.8366 -1.8366 -1.8053 -1.8053 -1.7102 -1.7102 -1.6100 -1.6100 -1.5300 -1.5300 -1.4941 -1.4941 -1.4660 -1.4660 -1.2860 -1.2860 -1.2282 -1.2282 -1.1374 -1.1374 -0.6972 -0.6972 -0.6817 -0.6817 -0.6260 -0.6260 -0.6128 -0.6128 -0.5680 -0.5680 -0.5570 -0.5570 -0.2059 -0.2059 -0.1368 -0.1368 -0.0969 -0.0969 -0.0444 -0.0444 2.6567 2.6567 2.6661 2.6661 5.1650 5.1650 5.5082 5.5082 5.8441 5.8441 6.1158 6.1158 7.4563 7.4563 7.5036 7.5036 k = 0.2759 0.4778-0.0000 ( 13437 PWs) bands (ev): -15.0336 -15.0336 -15.0094 -15.0094 -13.9198 -13.9198 -13.8770 -13.8770 -13.7859 -13.7859 -13.7644 -13.7644 -13.2876 -13.2876 -13.2747 -13.2747 -12.9639 -12.9639 -12.9455 -12.9455 -7.8060 -7.8060 -7.7887 -7.7887 -4.3874 -4.3874 -4.2335 -4.2335 -3.8550 -3.8550 -3.6777 -3.6777 -3.5407 -3.5407 -3.5134 -3.5134 -2.1606 -2.1606 -1.9335 -1.9335 -1.8331 -1.8331 -1.8063 -1.8063 -1.7014 -1.7014 -1.6136 -1.6136 -1.5313 -1.5313 -1.4983 -1.4983 -1.4684 -1.4684 -1.2957 -1.2957 -1.2177 -1.2177 -1.1164 -1.1164 -0.7098 -0.7098 -0.6895 -0.6895 -0.6280 -0.6280 -0.6083 -0.6083 -0.5609 -0.5609 -0.5510 -0.5510 -0.2024 -0.2024 -0.1367 -0.1367 -0.0961 -0.0961 -0.0443 -0.0443 2.6393 2.6393 2.6494 2.6494 5.1722 5.1722 5.4990 5.4990 5.8484 5.8484 6.1074 6.1074 7.4418 7.4418 7.5052 7.5052 k = 0.2644 0.4579-0.0000 ( 13445 PWs) bands (ev): -15.0375 -15.0375 -15.0081 -15.0081 -13.9161 -13.9161 -13.8748 -13.8748 -13.7856 -13.7856 -13.7643 -13.7643 -13.2889 -13.2889 -13.2733 -13.2733 -12.9669 -12.9669 -12.9448 -12.9448 -7.8132 -7.8132 -7.7924 -7.7924 -4.3746 -4.3746 -4.2257 -4.2257 -3.8561 -3.8561 -3.6847 -3.6847 -3.5415 -3.5415 -3.5131 -3.5131 -2.1526 -2.1526 -1.9444 -1.9444 -1.8369 -1.8369 -1.7986 -1.7986 -1.6934 -1.6934 -1.6163 -1.6163 -1.5332 -1.5332 -1.5045 -1.5045 -1.4714 -1.4714 -1.3044 -1.3044 -1.2036 -1.2036 -1.0958 -1.0958 -0.7235 -0.7235 -0.6975 -0.6975 -0.6287 -0.6287 -0.6039 -0.6039 -0.5542 -0.5542 -0.5448 -0.5448 -0.1983 -0.1983 -0.1363 -0.1363 -0.0954 -0.0954 -0.0439 -0.0439 2.6177 2.6177 2.6293 2.6293 5.1806 5.1806 5.4894 5.4894 5.8513 5.8513 6.0963 6.0963 7.4250 7.4250 7.5062 7.5062 k = 0.2529 0.4380-0.0000 ( 13451 PWs) bands (ev): -15.0417 -15.0417 -15.0071 -15.0071 -13.9118 -13.9118 -13.8720 -13.8720 -13.7853 -13.7853 -13.7643 -13.7643 -13.2903 -13.2903 -13.2719 -13.2719 -12.9700 -12.9700 -12.9442 -12.9442 -7.8214 -7.8214 -7.7971 -7.7971 -4.3596 -4.3596 -4.2162 -4.2162 -3.8576 -3.8576 -3.6927 -3.6927 -3.5426 -3.5426 -3.5128 -3.5128 -2.1433 -2.1433 -1.9554 -1.9554 -1.8433 -1.8433 -1.7870 -1.7870 -1.6864 -1.6864 -1.6179 -1.6179 -1.5355 -1.5355 -1.5123 -1.5123 -1.4750 -1.4750 -1.3123 -1.3123 -1.1865 -1.1865 -1.0758 -1.0758 -0.7384 -0.7384 -0.7052 -0.7052 -0.6281 -0.6281 -0.5999 -0.5999 -0.5480 -0.5480 -0.5388 -0.5388 -0.1937 -0.1937 -0.1357 -0.1357 -0.0948 -0.0948 -0.0431 -0.0431 2.5921 2.5921 2.6061 2.6061 5.1902 5.1902 5.4797 5.4797 5.8520 5.8520 6.0822 6.0822 7.4064 7.4064 7.5065 7.5065 k = 0.2414 0.4181-0.0000 ( 13443 PWs) bands (ev): -15.0462 -15.0462 -15.0063 -15.0063 -13.9069 -13.9069 -13.8687 -13.8687 -13.7850 -13.7850 -13.7642 -13.7642 -13.2917 -13.2917 -13.2706 -13.2706 -12.9734 -12.9734 -12.9440 -12.9440 -7.8306 -7.8306 -7.8029 -7.8029 -4.3423 -4.3423 -4.2053 -4.2053 -3.8594 -3.8594 -3.7012 -3.7012 -3.5438 -3.5438 -3.5124 -3.5124 -2.1325 -2.1325 -1.9662 -1.9662 -1.8497 -1.8497 -1.7748 -1.7748 -1.6803 -1.6803 -1.6184 -1.6184 -1.5385 -1.5385 -1.5207 -1.5207 -1.4794 -1.4794 -1.3196 -1.3196 -1.1670 -1.1670 -1.0564 -1.0564 -0.7544 -0.7544 -0.7120 -0.7120 -0.6262 -0.6262 -0.5964 -0.5964 -0.5421 -0.5421 -0.5329 -0.5329 -0.1887 -0.1887 -0.1347 -0.1347 -0.0944 -0.0944 -0.0418 -0.0418 2.5627 2.5627 2.5799 2.5799 5.2007 5.2007 5.4702 5.4702 5.8503 5.8503 6.0651 6.0651 7.3861 7.3861 7.5060 7.5060 k = 0.2299 0.3982-0.0000 ( 13445 PWs) bands (ev): -15.0508 -15.0508 -15.0057 -15.0057 -13.9013 -13.9013 -13.8649 -13.8649 -13.7846 -13.7846 -13.7641 -13.7641 -13.2930 -13.2930 -13.2692 -13.2692 -12.9769 -12.9769 -12.9439 -12.9439 -7.8407 -7.8407 -7.8097 -7.8097 -4.3231 -4.3231 -4.1929 -4.1929 -3.8615 -3.8615 -3.7103 -3.7103 -3.5453 -3.5453 -3.5119 -3.5119 -2.1204 -2.1204 -1.9764 -1.9764 -1.8554 -1.8554 -1.7632 -1.7632 -1.6750 -1.6750 -1.6178 -1.6178 -1.5431 -1.5431 -1.5279 -1.5279 -1.4846 -1.4846 -1.3267 -1.3267 -1.1459 -1.1459 -1.0375 -1.0375 -0.7715 -0.7715 -0.7175 -0.7175 -0.6231 -0.6231 -0.5933 -0.5933 -0.5366 -0.5366 -0.5273 -0.5273 -0.1837 -0.1837 -0.1332 -0.1332 -0.0942 -0.0942 -0.0401 -0.0401 2.5299 2.5299 2.5510 2.5510 5.2119 5.2119 5.4610 5.4610 5.8459 5.8459 6.0449 6.0449 7.3645 7.3645 7.5049 7.5049 k = 0.2184 0.3783-0.0000 ( 13437 PWs) bands (ev): -15.0556 -15.0556 -15.0055 -15.0055 -13.8951 -13.8951 -13.8606 -13.8606 -13.7842 -13.7842 -13.7641 -13.7641 -13.2944 -13.2944 -13.2678 -13.2678 -12.9806 -12.9806 -12.9441 -12.9441 -7.8516 -7.8516 -7.8174 -7.8174 -4.3021 -4.3021 -4.1792 -4.1792 -3.8639 -3.8639 -3.7195 -3.7195 -3.5468 -3.5468 -3.5115 -3.5115 -2.1071 -2.1071 -1.9859 -1.9859 -1.8603 -1.8603 -1.7531 -1.7531 -1.6705 -1.6705 -1.6164 -1.6164 -1.5500 -1.5500 -1.5321 -1.5321 -1.4906 -1.4906 -1.3338 -1.3338 -1.1237 -1.1237 -1.0192 -1.0192 -0.7896 -0.7896 -0.7215 -0.7215 -0.6189 -0.6189 -0.5906 -0.5906 -0.5315 -0.5315 -0.5221 -0.5221 -0.1788 -0.1788 -0.1313 -0.1313 -0.0942 -0.0942 -0.0378 -0.0378 2.4942 2.4942 2.5196 2.5196 5.2236 5.2236 5.4521 5.4521 5.8388 5.8388 6.0218 6.0218 7.3419 7.3419 7.5029 7.5029 k = 0.2069 0.3584-0.0000 ( 13439 PWs) bands (ev): -15.0606 -15.0606 -15.0054 -15.0054 -13.8884 -13.8884 -13.8558 -13.8558 -13.7838 -13.7838 -13.7640 -13.7640 -13.2957 -13.2957 -13.2665 -13.2665 -12.9846 -12.9846 -12.9446 -12.9446 -7.8632 -7.8632 -7.8260 -7.8260 -4.2796 -4.2796 -4.1644 -4.1644 -3.8666 -3.8666 -3.7289 -3.7289 -3.5486 -3.5486 -3.5109 -3.5109 -2.0925 -2.0925 -1.9943 -1.9943 -1.8640 -1.8640 -1.7458 -1.7458 -1.6666 -1.6666 -1.6145 -1.6145 -1.5573 -1.5573 -1.5336 -1.5336 -1.4974 -1.4974 -1.3411 -1.3411 -1.1010 -1.1010 -1.0014 -1.0014 -0.8088 -0.8088 -0.7236 -0.7236 -0.6138 -0.6138 -0.5883 -0.5883 -0.5268 -0.5268 -0.5172 -0.5172 -0.1742 -0.1742 -0.1287 -0.1287 -0.0942 -0.0942 -0.0351 -0.0351 2.4559 2.4559 2.4862 2.4862 5.2356 5.2356 5.4435 5.4435 5.8289 5.8289 5.9959 5.9959 7.3185 7.3185 7.4999 7.4999 k = 0.1954 0.3384-0.0000 ( 13419 PWs) bands (ev): -15.0656 -15.0656 -15.0056 -15.0056 -13.8814 -13.8814 -13.8505 -13.8505 -13.7833 -13.7833 -13.7639 -13.7639 -13.2970 -13.2970 -13.2652 -13.2652 -12.9886 -12.9886 -12.9452 -12.9452 -7.8754 -7.8754 -7.8352 -7.8352 -4.2560 -4.2560 -4.1486 -4.1486 -3.8695 -3.8695 -3.7380 -3.7380 -3.5504 -3.5504 -3.5104 -3.5104 -2.0768 -2.0768 -2.0013 -2.0013 -1.8667 -1.8667 -1.7421 -1.7421 -1.6634 -1.6634 -1.6128 -1.6128 -1.5625 -1.5625 -1.5338 -1.5338 -1.5050 -1.5050 -1.3488 -1.3488 -1.0783 -1.0783 -0.9841 -0.9841 -0.8287 -0.8287 -0.7237 -0.7237 -0.6079 -0.6079 -0.5861 -0.5861 -0.5224 -0.5224 -0.5128 -0.5128 -0.1703 -0.1703 -0.1257 -0.1257 -0.0941 -0.0941 -0.0320 -0.0320 2.4154 2.4154 2.4510 2.4510 5.2476 5.2476 5.4351 5.4351 5.8166 5.8166 5.9676 5.9676 7.2948 7.2948 7.4945 7.4945 k = 0.1839 0.3185-0.0000 ( 13417 PWs) bands (ev): -15.0707 -15.0707 -15.0060 -15.0060 -13.8739 -13.8739 -13.8449 -13.8449 -13.7828 -13.7828 -13.7639 -13.7639 -13.2983 -13.2983 -13.2639 -13.2639 -12.9928 -12.9928 -12.9461 -12.9461 -7.8881 -7.8881 -7.8450 -7.8450 -4.2316 -4.2316 -4.1320 -4.1320 -3.8727 -3.8727 -3.7467 -3.7467 -3.5522 -3.5522 -3.5099 -3.5099 -2.0601 -2.0601 -2.0066 -2.0066 -1.8683 -1.8683 -1.7429 -1.7429 -1.6607 -1.6607 -1.6118 -1.6118 -1.5641 -1.5641 -1.5329 -1.5329 -1.5133 -1.5133 -1.3570 -1.3570 -1.0560 -1.0560 -0.9673 -0.9673 -0.8494 -0.8494 -0.7216 -0.7216 -0.6013 -0.6013 -0.5840 -0.5840 -0.5184 -0.5184 -0.5089 -0.5089 -0.1671 -0.1671 -0.1223 -0.1223 -0.0936 -0.0936 -0.0286 -0.0286 2.3733 2.3733 2.4145 2.4145 5.2595 5.2595 5.4270 5.4270 5.8021 5.8021 5.9374 5.9374 7.2710 7.2710 7.4649 7.4649 k = 0.1724 0.2986-0.0000 ( 13421 PWs) bands (ev): -15.0758 -15.0758 -15.0066 -15.0066 -13.8662 -13.8662 -13.8390 -13.8390 -13.7823 -13.7823 -13.7638 -13.7638 -13.2995 -13.2995 -13.2626 -13.2626 -12.9971 -12.9971 -12.9472 -12.9472 -7.9011 -7.9011 -7.8553 -7.8553 -4.2068 -4.2068 -4.1146 -4.1146 -3.8760 -3.8760 -3.7548 -3.7548 -3.5541 -3.5541 -3.5093 -3.5093 -2.0429 -2.0429 -2.0098 -2.0098 -1.8688 -1.8688 -1.7482 -1.7482 -1.6585 -1.6585 -1.6116 -1.6116 -1.5620 -1.5620 -1.5317 -1.5317 -1.5216 -1.5216 -1.3658 -1.3658 -1.0344 -1.0344 -0.9510 -0.9510 -0.8704 -0.8704 -0.7171 -0.7171 -0.5944 -0.5944 -0.5819 -0.5819 -0.5147 -0.5147 -0.5053 -0.5053 -0.1647 -0.1647 -0.1189 -0.1189 -0.0924 -0.0924 -0.0250 -0.0250 2.3299 2.3299 2.3770 2.3770 5.2710 5.2710 5.4189 5.4189 5.7859 5.7859 5.9057 5.9057 7.2473 7.2473 7.4001 7.4001 k = 0.1609 0.2787-0.0000 ( 13429 PWs) bands (ev): -15.0808 -15.0808 -15.0074 -15.0074 -13.8584 -13.8584 -13.8328 -13.8328 -13.7818 -13.7818 -13.7637 -13.7637 -13.3007 -13.3007 -13.2614 -13.2614 -13.0014 -13.0014 -12.9484 -12.9484 -7.9143 -7.9143 -7.8658 -7.8658 -4.1823 -4.1823 -4.0968 -4.0968 -3.8794 -3.8794 -3.7621 -3.7621 -3.5560 -3.5560 -3.5088 -3.5088 -2.0268 -2.0268 -2.0091 -2.0091 -1.8682 -1.8682 -1.7577 -1.7577 -1.6570 -1.6570 -1.6114 -1.6114 -1.5577 -1.5577 -1.5354 -1.5354 -1.5245 -1.5245 -1.3753 -1.3753 -1.0140 -1.0140 -0.9356 -0.9356 -0.8913 -0.8913 -0.7105 -0.7105 -0.5872 -0.5872 -0.5796 -0.5796 -0.5115 -0.5115 -0.5022 -0.5022 -0.1630 -0.1630 -0.1162 -0.1162 -0.0901 -0.0901 -0.0212 -0.0212 2.2858 2.2858 2.3391 2.3391 5.2818 5.2818 5.4108 5.4108 5.7684 5.7684 5.8731 5.8731 7.2241 7.2241 7.3346 7.3346 k = 0.1494 0.2588-0.0000 ( 13441 PWs) bands (ev): -15.0857 -15.0857 -15.0083 -15.0083 -13.8504 -13.8504 -13.8265 -13.8265 -13.7812 -13.7812 -13.7635 -13.7635 -13.3018 -13.3018 -13.2603 -13.2603 -13.0058 -13.0058 -12.9498 -12.9498 -7.9274 -7.9274 -7.8765 -7.8765 -4.1587 -4.1587 -4.0785 -4.0785 -3.8827 -3.8827 -3.7683 -3.7683 -3.5578 -3.5578 -3.5082 -3.5082 -2.0180 -2.0180 -1.9983 -1.9983 -1.8667 -1.8667 -1.7702 -1.7702 -1.6561 -1.6561 -1.6106 -1.6106 -1.5531 -1.5531 -1.5451 -1.5451 -1.5207 -1.5207 -1.3855 -1.3855 -0.9950 -0.9950 -0.9256 -0.9256 -0.9073 -0.9073 -0.7017 -0.7017 -0.5802 -0.5802 -0.5767 -0.5767 -0.5086 -0.5086 -0.4995 -0.4995 -0.1618 -0.1618 -0.1144 -0.1144 -0.0867 -0.0867 -0.0173 -0.0173 2.2414 2.2414 2.3012 2.3012 5.2919 5.2919 5.4026 5.4026 5.7501 5.7501 5.8403 5.8403 7.2016 7.2016 7.2721 7.2721 k = 0.1379 0.2389-0.0000 ( 13427 PWs) bands (ev): -15.0905 -15.0905 -15.0093 -15.0093 -13.8426 -13.8426 -13.8202 -13.8202 -13.7806 -13.7806 -13.7634 -13.7634 -13.3029 -13.3029 -13.2592 -13.2592 -13.0102 -13.0102 -12.9512 -12.9512 -7.9404 -7.9404 -7.8872 -7.8872 -4.1366 -4.1366 -4.0598 -4.0598 -3.8859 -3.8859 -3.7734 -3.7734 -3.5596 -3.5596 -3.5077 -3.5077 -2.0142 -2.0142 -1.9800 -1.9800 -1.8645 -1.8645 -1.7847 -1.7847 -1.6559 -1.6559 -1.6092 -1.6092 -1.5568 -1.5568 -1.5483 -1.5483 -1.5149 -1.5149 -1.3962 -1.3962 -0.9784 -0.9784 -0.9382 -0.9382 -0.8999 -0.8999 -0.6913 -0.6913 -0.5749 -0.5749 -0.5716 -0.5716 -0.5061 -0.5061 -0.4972 -0.4972 -0.1611 -0.1611 -0.1135 -0.1135 -0.0822 -0.0822 -0.0133 -0.0133 2.1973 2.1973 2.2637 2.2637 5.3010 5.3010 5.3942 5.3942 5.7317 5.7317 5.8078 5.8078 7.1800 7.1800 7.2132 7.2132 k = 0.1264 0.2190-0.0000 ( 13419 PWs) bands (ev): -15.0951 -15.0951 -15.0104 -15.0104 -13.8349 -13.8349 -13.8140 -13.8140 -13.7799 -13.7799 -13.7631 -13.7631 -13.3039 -13.3039 -13.2582 -13.2582 -13.0145 -13.0145 -12.9528 -12.9528 -7.9531 -7.9531 -7.8976 -7.8976 -4.1165 -4.1165 -4.0410 -4.0410 -3.8889 -3.8889 -3.7772 -3.7772 -3.5613 -3.5613 -3.5072 -3.5072 -2.0098 -2.0098 -1.9599 -1.9599 -1.8620 -1.8620 -1.7995 -1.7995 -1.6565 -1.6565 -1.6076 -1.6076 -1.5684 -1.5684 -1.5450 -1.5450 -1.5083 -1.5083 -1.4075 -1.4075 -0.9717 -0.9717 -0.9490 -0.9490 -0.8858 -0.8858 -0.6797 -0.6797 -0.5710 -0.5710 -0.5649 -0.5649 -0.5039 -0.5039 -0.4953 -0.4953 -0.1607 -0.1607 -0.1132 -0.1132 -0.0772 -0.0772 -0.0094 -0.0094 2.1539 2.1539 2.2271 2.2271 5.3089 5.3089 5.3856 5.3856 5.7136 5.7136 5.7764 5.7764 7.1573 7.1573 7.1604 7.1604 k = 0.1149 0.1991-0.0000 ( 13411 PWs) bands (ev): -15.0994 -15.0994 -15.0115 -15.0115 -13.8275 -13.8275 -13.8081 -13.8081 -13.7791 -13.7791 -13.7628 -13.7628 -13.3049 -13.3049 -13.2572 -13.2572 -13.0187 -13.0187 -12.9544 -12.9544 -7.9652 -7.9652 -7.9078 -7.9078 -4.0990 -4.0990 -4.0223 -4.0223 -3.8914 -3.8914 -3.7796 -3.7796 -3.5628 -3.5628 -3.5067 -3.5067 -2.0039 -2.0039 -1.9394 -1.9394 -1.8606 -1.8606 -1.8125 -1.8125 -1.6579 -1.6579 -1.6064 -1.6064 -1.5799 -1.5799 -1.5423 -1.5423 -1.5017 -1.5017 -1.4190 -1.4190 -0.9872 -0.9872 -0.9393 -0.9393 -0.8715 -0.8715 -0.6678 -0.6678 -0.5664 -0.5664 -0.5583 -0.5583 -0.5021 -0.5021 -0.4937 -0.4937 -0.1606 -0.1606 -0.1134 -0.1134 -0.0720 -0.0720 -0.0055 -0.0055 2.1118 2.1118 2.1918 2.1918 5.3153 5.3153 5.3767 5.3767 5.6963 5.6963 5.7467 5.7467 7.1072 7.1072 7.1403 7.1403 k = 0.1034 0.1792-0.0000 ( 13421 PWs) bands (ev): -15.1035 -15.1035 -15.0127 -15.0127 -13.8205 -13.8205 -13.8025 -13.8025 -13.7781 -13.7781 -13.7624 -13.7624 -13.3057 -13.3057 -13.2564 -13.2564 -13.0228 -13.0228 -12.9560 -12.9560 -7.9767 -7.9767 -7.9175 -7.9175 -4.0842 -4.0842 -4.0043 -4.0043 -3.8933 -3.8933 -3.7804 -3.7804 -3.5642 -3.5642 -3.5062 -3.5062 -1.9966 -1.9966 -1.9195 -1.9195 -1.8623 -1.8623 -1.8205 -1.8205 -1.6601 -1.6601 -1.6083 -1.6083 -1.5889 -1.5889 -1.5402 -1.5402 -1.4959 -1.4959 -1.4306 -1.4306 -1.0073 -1.0073 -0.9257 -0.9257 -0.8575 -0.8575 -0.6562 -0.6562 -0.5608 -0.5608 -0.5522 -0.5522 -0.5005 -0.5005 -0.4922 -0.4922 -0.1606 -0.1606 -0.1137 -0.1137 -0.0669 -0.0669 -0.0017 -0.0017 2.0715 2.0715 2.1582 2.1582 5.3201 5.3201 5.3678 5.3678 5.6800 5.6800 5.7193 5.7193 7.0607 7.0607 7.1224 7.1224 k = 0.0920 0.1593-0.0000 ( 13425 PWs) bands (ev): -15.1072 -15.1072 -15.0138 -15.0138 -13.8142 -13.8142 -13.7973 -13.7973 -13.7771 -13.7771 -13.7619 -13.7619 -13.3065 -13.3065 -13.2556 -13.2556 -13.0266 -13.0266 -12.9575 -12.9575 -7.9875 -7.9875 -7.9265 -7.9265 -4.0720 -4.0720 -3.9875 -3.9875 -3.8945 -3.8945 -3.7797 -3.7797 -3.5653 -3.5653 -3.5057 -3.5057 -1.9879 -1.9879 -1.9030 -1.9030 -1.8662 -1.8662 -1.8210 -1.8210 -1.6633 -1.6633 -1.6166 -1.6166 -1.5920 -1.5920 -1.5386 -1.5386 -1.4913 -1.4913 -1.4417 -1.4417 -1.0274 -1.0274 -0.9124 -0.9124 -0.8441 -0.8441 -0.6457 -0.6457 -0.5542 -0.5542 -0.5467 -0.5467 -0.4991 -0.4991 -0.4910 -0.4910 -0.1608 -0.1608 -0.1142 -0.1142 -0.0622 -0.0622 0.0020 0.0020 2.0336 2.0336 2.1269 2.1269 5.3233 5.3233 5.3590 5.3590 5.6652 5.6652 5.6946 5.6946 7.0186 7.0186 7.1061 7.1061 k = 0.0805 0.1394-0.0000 ( 13413 PWs) bands (ev): -15.1106 -15.1106 -15.0148 -15.0148 -13.8085 -13.8085 -13.7927 -13.7927 -13.7759 -13.7759 -13.7611 -13.7611 -13.3072 -13.3072 -13.2548 -13.2548 -13.0301 -13.0301 -12.9590 -12.9590 -7.9973 -7.9973 -7.9348 -7.9348 -4.0623 -4.0623 -3.9726 -3.9726 -3.8951 -3.8951 -3.7775 -3.7775 -3.5663 -3.5663 -3.5053 -3.5053 -1.9783 -1.9783 -1.8995 -1.8995 -1.8607 -1.8607 -1.8161 -1.8161 -1.6674 -1.6674 -1.6290 -1.6290 -1.5918 -1.5918 -1.5372 -1.5372 -1.4884 -1.4884 -1.4516 -1.4516 -1.0465 -1.0465 -0.9001 -0.9001 -0.8315 -0.8315 -0.6369 -0.6369 -0.5467 -0.5467 -0.5419 -0.5419 -0.4979 -0.4979 -0.4898 -0.4898 -0.1611 -0.1611 -0.1147 -0.1147 -0.0579 -0.0579 0.0054 0.0054 1.9985 1.9985 2.0981 2.0981 5.3247 5.3247 5.3505 5.3505 5.6520 5.6520 5.6732 5.6732 6.9811 6.9811 7.0914 7.0914 k = 0.0690 0.1195-0.0000 ( 13395 PWs) bands (ev): -15.1136 -15.1136 -15.0158 -15.0158 -13.8037 -13.8037 -13.7888 -13.7888 -13.7746 -13.7746 -13.7602 -13.7602 -13.3078 -13.3078 -13.2542 -13.2542 -13.0334 -13.0334 -12.9604 -12.9604 -8.0060 -8.0060 -7.9423 -7.9423 -4.0549 -4.0549 -3.9598 -3.9598 -3.8950 -3.8950 -3.7742 -3.7742 -3.5670 -3.5670 -3.5050 -3.5050 -1.9681 -1.9681 -1.9081 -1.9081 -1.8440 -1.8440 -1.8083 -1.8083 -1.6726 -1.6726 -1.6427 -1.6427 -1.5915 -1.5915 -1.5359 -1.5359 -1.4881 -1.4881 -1.4593 -1.4593 -1.0641 -1.0641 -0.8889 -0.8889 -0.8199 -0.8199 -0.6299 -0.6299 -0.5396 -0.5396 -0.5369 -0.5369 -0.4966 -0.4966 -0.4886 -0.4886 -0.1614 -0.1614 -0.1152 -0.1152 -0.0541 -0.0541 0.0085 0.0085 1.9668 1.9668 2.0723 2.0723 5.3244 5.3244 5.3427 5.3427 5.6403 5.6403 5.6553 5.6553 6.9484 6.9484 7.0786 7.0786 k = 0.0575 0.0995-0.0000 ( 13401 PWs) bands (ev): -15.1162 -15.1162 -15.0167 -15.0167 -13.7999 -13.7999 -13.7853 -13.7853 -13.7734 -13.7734 -13.7590 -13.7590 -13.3083 -13.3083 -13.2537 -13.2537 -13.0362 -13.0362 -12.9617 -12.9617 -8.0136 -8.0136 -7.9488 -7.9488 -4.0494 -4.0494 -3.9495 -3.9495 -3.8944 -3.8944 -3.7701 -3.7701 -3.5676 -3.5676 -3.5046 -3.5046 -1.9579 -1.9579 -1.9192 -1.9192 -1.8245 -1.8245 -1.7987 -1.7987 -1.6790 -1.6790 -1.6568 -1.6568 -1.5920 -1.5920 -1.5344 -1.5344 -1.4908 -1.4908 -1.4638 -1.4638 -1.0799 -1.0799 -0.8789 -0.8789 -0.8095 -0.8095 -0.6246 -0.6246 -0.5357 -0.5357 -0.5299 -0.5299 -0.4951 -0.4951 -0.4874 -0.4874 -0.1617 -0.1617 -0.1157 -0.1157 -0.0509 -0.0509 0.0114 0.0114 1.9390 1.9390 2.0498 2.0498 5.3226 5.3226 5.3359 5.3359 5.6302 5.6302 5.6410 5.6410 6.9205 6.9205 7.0675 7.0675 k = 0.0460 0.0796-0.0000 ( 13409 PWs) bands (ev): -15.1183 -15.1183 -15.0174 -15.0174 -13.7970 -13.7970 -13.7824 -13.7824 -13.7724 -13.7724 -13.7577 -13.7577 -13.3088 -13.3088 -13.2532 -13.2532 -13.0386 -13.0386 -12.9627 -12.9627 -8.0200 -8.0200 -7.9542 -7.9542 -4.0454 -4.0454 -3.9415 -3.9415 -3.8934 -3.8934 -3.7657 -3.7657 -3.5679 -3.5679 -3.5044 -3.5044 -1.9482 -1.9482 -1.9296 -1.9296 -1.8050 -1.8050 -1.7879 -1.7879 -1.6870 -1.6870 -1.6707 -1.6707 -1.5936 -1.5936 -1.5324 -1.5324 -1.4956 -1.4956 -1.4656 -1.4656 -1.0935 -1.0935 -0.8704 -0.8704 -0.8006 -0.8006 -0.6209 -0.6209 -0.5333 -0.5333 -0.5234 -0.5234 -0.4931 -0.4931 -0.4862 -0.4862 -0.1620 -0.1620 -0.1161 -0.1161 -0.0483 -0.0483 0.0138 0.0138 1.9156 1.9156 2.0310 2.0310 5.3197 5.3197 5.3304 5.3304 5.6217 5.6217 5.6302 5.6302 6.8975 6.8975 7.0584 7.0584 k = 0.0345 0.0597-0.0000 ( 13413 PWs) bands (ev): -15.1200 -15.1200 -15.0180 -15.0180 -13.7950 -13.7950 -13.7800 -13.7800 -13.7717 -13.7717 -13.7564 -13.7564 -13.3091 -13.3091 -13.2529 -13.2529 -13.0405 -13.0405 -12.9636 -12.9636 -8.0250 -8.0250 -7.9585 -7.9585 -4.0427 -4.0427 -3.9357 -3.9357 -3.8923 -3.8923 -3.7615 -3.7615 -3.5681 -3.5681 -3.5042 -3.5042 -1.9397 -1.9397 -1.9384 -1.9384 -1.7862 -1.7862 -1.7762 -1.7762 -1.6969 -1.6969 -1.6839 -1.6839 -1.5960 -1.5960 -1.5299 -1.5299 -1.5011 -1.5011 -1.4662 -1.4662 -1.1044 -1.1044 -0.8636 -0.8636 -0.7934 -0.7934 -0.6183 -0.6183 -0.5317 -0.5317 -0.5185 -0.5185 -0.4906 -0.4906 -0.4852 -0.4852 -0.1622 -0.1622 -0.1165 -0.1165 -0.0463 -0.0463 0.0157 0.0157 1.8969 1.8969 2.0160 2.0160 5.3164 5.3164 5.3262 5.3262 5.6149 5.6149 5.6226 5.6226 6.8796 6.8796 7.0513 7.0513 k = 0.0230 0.0398-0.0000 ( 13417 PWs) bands (ev): -15.1213 -15.1213 -15.0184 -15.0184 -13.7937 -13.7937 -13.7782 -13.7782 -13.7712 -13.7712 -13.7554 -13.7554 -13.3094 -13.3094 -13.2527 -13.2527 -13.0419 -13.0419 -12.9642 -12.9642 -8.0286 -8.0286 -7.9617 -7.9617 -4.0409 -4.0409 -3.9319 -3.9319 -3.8914 -3.8914 -3.7581 -3.7581 -3.5682 -3.5682 -3.5040 -3.5040 -1.9449 -1.9449 -1.9331 -1.9331 -1.7689 -1.7689 -1.7639 -1.7639 -1.7087 -1.7087 -1.6959 -1.6959 -1.5987 -1.5987 -1.5270 -1.5270 -1.5062 -1.5062 -1.4664 -1.4664 -1.1125 -1.1125 -0.8586 -0.8586 -0.7880 -0.7880 -0.6166 -0.6166 -0.5306 -0.5306 -0.5155 -0.5155 -0.4880 -0.4880 -0.4843 -0.4843 -0.1624 -0.1624 -0.1167 -0.1167 -0.0448 -0.0448 0.0171 0.0171 1.8833 1.8833 2.0052 2.0052 5.3134 5.3134 5.3232 5.3232 5.6100 5.6100 5.6175 5.6175 6.8667 6.8667 7.0461 7.0461 k = 0.0115 0.0199-0.0000 ( 13431 PWs) bands (ev): -15.1220 -15.1220 -15.0187 -15.0187 -13.7930 -13.7930 -13.7770 -13.7770 -13.7709 -13.7709 -13.7547 -13.7547 -13.3095 -13.3095 -13.2525 -13.2525 -13.0428 -13.0428 -12.9646 -12.9646 -8.0308 -8.0308 -7.9636 -7.9636 -4.0400 -4.0400 -3.9297 -3.9297 -3.8907 -3.8907 -3.7559 -3.7559 -3.5683 -3.5683 -3.5039 -3.5039 -1.9489 -1.9489 -1.9288 -1.9288 -1.7555 -1.7555 -1.7506 -1.7506 -1.7219 -1.7219 -1.7058 -1.7058 -1.6007 -1.6007 -1.5240 -1.5240 -1.5104 -1.5104 -1.4664 -1.4664 -1.1175 -1.1175 -0.8555 -0.8555 -0.7847 -0.7847 -0.6157 -0.6157 -0.5300 -0.5300 -0.5140 -0.5140 -0.4860 -0.4860 -0.4838 -0.4838 -0.1625 -0.1625 -0.1169 -0.1169 -0.0440 -0.0440 0.0180 0.0180 1.8750 1.8750 1.9986 1.9986 5.3115 5.3115 5.3213 5.3213 5.6071 5.6071 5.6145 5.6145 6.8590 6.8590 7.0430 7.0430 k = 0.0000 0.0000 0.0000 ( 13425 PWs) bands (ev): -15.1222 -15.1222 -15.0188 -15.0188 -13.7927 -13.7927 -13.7767 -13.7767 -13.7708 -13.7708 -13.7544 -13.7544 -13.3095 -13.3095 -13.2525 -13.2525 -13.0430 -13.0430 -12.9647 -12.9647 -8.0316 -8.0316 -7.9642 -7.9642 -4.0397 -4.0397 -3.9290 -3.9290 -3.8905 -3.8905 -3.7551 -3.7551 -3.5683 -3.5683 -3.5039 -3.5039 -1.9502 -1.9502 -1.9274 -1.9274 -1.7500 -1.7500 -1.7384 -1.7384 -1.7336 -1.7336 -1.7105 -1.7105 -1.6014 -1.6014 -1.5225 -1.5225 -1.5123 -1.5123 -1.4665 -1.4665 -1.1192 -1.1192 -0.8544 -0.8544 -0.7836 -0.7836 -0.6155 -0.6155 -0.5298 -0.5298 -0.5135 -0.5135 -0.4853 -0.4853 -0.4836 -0.4836 -0.1626 -0.1626 -0.1169 -0.1169 -0.0437 -0.0437 0.0183 0.0183 1.8722 1.8722 1.9964 1.9964 5.3108 5.3108 5.3207 5.3207 5.6061 5.6061 5.6135 5.6135 6.8564 6.8564 7.0420 7.0420 k = 0.0000 0.0000 0.0000 ( 13425 PWs) bands (ev): -15.1222 -15.1222 -15.0188 -15.0188 -13.7927 -13.7927 -13.7767 -13.7767 -13.7708 -13.7708 -13.7544 -13.7544 -13.3095 -13.3095 -13.2525 -13.2525 -13.0430 -13.0430 -12.9647 -12.9647 -8.0316 -8.0316 -7.9642 -7.9642 -4.0397 -4.0397 -3.9290 -3.9290 -3.8905 -3.8905 -3.7551 -3.7551 -3.5683 -3.5683 -3.5039 -3.5039 -1.9502 -1.9502 -1.9274 -1.9274 -1.7500 -1.7500 -1.7384 -1.7384 -1.7336 -1.7336 -1.7105 -1.7105 -1.6014 -1.6014 -1.5225 -1.5225 -1.5123 -1.5123 -1.4665 -1.4665 -1.1192 -1.1192 -0.8544 -0.8544 -0.7836 -0.7836 -0.6155 -0.6155 -0.5298 -0.5298 -0.5135 -0.5135 -0.4853 -0.4853 -0.4836 -0.4836 -0.1626 -0.1626 -0.1169 -0.1169 -0.0437 -0.0437 0.0183 0.0183 1.8722 1.8722 1.9964 1.9964 5.3108 5.3108 5.3207 5.3207 5.6061 5.6061 5.6135 5.6135 6.8564 6.8564 7.0420 7.0420 k = 0.0000 0.0000 0.0233 ( 13401 PWs) bands (ev): -15.1220 -15.1220 -15.0189 -15.0189 -13.7927 -13.7927 -13.7767 -13.7767 -13.7707 -13.7707 -13.7544 -13.7544 -13.3108 -13.3108 -13.2537 -13.2537 -13.0417 -13.0417 -12.9638 -12.9638 -8.0307 -8.0307 -7.9636 -7.9636 -4.0396 -4.0396 -3.9296 -3.9296 -3.8903 -3.8903 -3.7553 -3.7553 -3.5725 -3.5725 -3.5086 -3.5086 -1.9457 -1.9457 -1.9233 -1.9233 -1.7526 -1.7526 -1.7407 -1.7407 -1.7354 -1.7354 -1.7127 -1.7127 -1.5981 -1.5981 -1.5202 -1.5202 -1.5093 -1.5093 -1.4637 -1.4637 -1.1186 -1.1186 -0.8543 -0.8543 -0.7837 -0.7837 -0.6164 -0.6164 -0.5301 -0.5301 -0.5147 -0.5147 -0.4856 -0.4856 -0.4837 -0.4837 -0.1628 -0.1628 -0.1171 -0.1171 -0.0442 -0.0442 0.0178 0.0178 1.8754 1.8754 1.9990 1.9990 5.3111 5.3111 5.3209 5.3209 5.6065 5.6065 5.6139 5.6139 6.8586 6.8586 7.0360 7.0360 k = 0.0000 0.0000 0.0467 ( 13419 PWs) bands (ev): -15.1213 -15.1213 -15.0190 -15.0190 -13.7926 -13.7926 -13.7768 -13.7768 -13.7707 -13.7707 -13.7545 -13.7545 -13.3144 -13.3144 -13.2573 -13.2573 -13.0378 -13.0378 -12.9612 -12.9612 -8.0283 -8.0283 -7.9618 -7.9618 -4.0396 -4.0396 -3.9314 -3.9314 -3.8897 -3.8897 -3.7560 -3.7560 -3.5849 -3.5849 -3.5226 -3.5226 -1.9326 -1.9326 -1.9114 -1.9114 -1.7594 -1.7594 -1.7471 -1.7471 -1.7406 -1.7406 -1.7191 -1.7191 -1.5889 -1.5889 -1.5135 -1.5135 -1.5008 -1.5008 -1.4558 -1.4558 -1.1168 -1.1168 -0.8540 -0.8540 -0.7841 -0.7841 -0.6193 -0.6193 -0.5307 -0.5307 -0.5180 -0.5180 -0.4865 -0.4865 -0.4841 -0.4841 -0.1635 -0.1635 -0.1178 -0.1178 -0.0455 -0.0455 0.0164 0.0164 1.8849 1.8849 2.0066 2.0066 5.3118 5.3118 5.3216 5.3216 5.6077 5.6077 5.6150 5.6150 6.8648 6.8648 7.0182 7.0182 k = 0.0000 0.0000 0.0700 ( 13389 PWs) bands (ev): -15.1201 -15.1201 -15.0194 -15.0194 -13.7925 -13.7925 -13.7769 -13.7769 -13.7705 -13.7705 -13.7546 -13.7546 -13.3202 -13.3202 -13.2630 -13.2630 -13.0315 -13.0315 -12.9569 -12.9569 -8.0242 -8.0242 -7.9589 -7.9589 -4.0395 -4.0395 -3.9345 -3.9345 -3.8887 -3.8887 -3.7570 -3.7570 -3.6047 -3.6047 -3.5451 -3.5451 -1.9118 -1.9118 -1.8926 -1.8926 -1.7689 -1.7689 -1.7563 -1.7563 -1.7485 -1.7485 -1.7289 -1.7289 -1.5751 -1.5751 -1.5030 -1.5030 -1.4878 -1.4878 -1.4436 -1.4436 -1.1140 -1.1140 -0.8534 -0.8534 -0.7846 -0.7846 -0.6244 -0.6244 -0.5318 -0.5318 -0.5231 -0.5231 -0.4879 -0.4879 -0.4848 -0.4848 -0.1646 -0.1646 -0.1188 -0.1188 -0.0478 -0.0478 0.0141 0.0141 1.9005 1.9005 2.0192 2.0192 5.3129 5.3129 5.3228 5.3228 5.6096 5.6096 5.6167 5.6167 6.8750 6.8750 6.9892 6.9892 k = 0.0000 0.0000 0.0934 ( 13365 PWs) bands (ev): -15.1185 -15.1185 -15.0198 -15.0198 -13.7923 -13.7923 -13.7771 -13.7771 -13.7703 -13.7703 -13.7548 -13.7548 -13.3277 -13.3277 -13.2707 -13.2707 -13.0234 -13.0234 -12.9514 -12.9514 -8.0187 -8.0187 -7.9548 -7.9548 -4.0395 -4.0395 -3.9390 -3.9390 -3.8873 -3.8873 -3.7584 -3.7584 -3.6306 -3.6306 -3.5748 -3.5748 -1.8853 -1.8853 -1.8690 -1.8690 -1.7786 -1.7786 -1.7661 -1.7661 -1.7585 -1.7585 -1.7410 -1.7410 -1.5582 -1.5582 -1.4895 -1.4895 -1.4715 -1.4715 -1.4283 -1.4283 -1.1102 -1.1102 -0.8526 -0.8526 -0.7854 -0.7854 -0.6320 -0.6320 -0.5334 -0.5334 -0.5297 -0.5297 -0.4898 -0.4898 -0.4860 -0.4860 -0.1661 -0.1661 -0.1201 -0.1201 -0.0509 -0.0509 0.0108 0.0108 1.9221 1.9221 2.0366 2.0366 5.3143 5.3143 5.3243 5.3243 5.6122 5.6122 5.6191 5.6191 6.8885 6.8885 6.9498 6.9498 k = 0.0000 0.0000 0.1167 ( 13401 PWs) bands (ev): -15.1164 -15.1164 -15.0204 -15.0204 -13.7921 -13.7921 -13.7773 -13.7773 -13.7701 -13.7701 -13.7550 -13.7550 -13.3364 -13.3364 -13.2798 -13.2798 -13.0137 -13.0137 -12.9449 -12.9449 -8.0118 -8.0118 -7.9498 -7.9498 -4.0398 -4.0398 -3.9454 -3.9454 -3.8855 -3.8855 -3.7602 -3.7602 -3.6609 -3.6609 -3.6103 -3.6103 -1.8574 -1.8574 -1.8456 -1.8456 -1.7836 -1.7836 -1.7727 -1.7727 -1.7697 -1.7697 -1.7545 -1.7545 -1.5392 -1.5392 -1.4737 -1.4737 -1.4531 -1.4531 -1.4107 -1.4107 -1.1057 -1.1057 -0.8516 -0.8516 -0.7863 -0.7863 -0.6423 -0.6423 -0.5372 -0.5372 -0.5354 -0.5354 -0.4921 -0.4921 -0.4875 -0.4875 -0.1679 -0.1679 -0.1216 -0.1216 -0.0549 -0.0549 0.0067 0.0067 1.9492 1.9492 2.0587 2.0587 5.3161 5.3161 5.3261 5.3261 5.6155 5.6155 5.6221 5.6221 6.9013 6.9013 6.9042 6.9042 k = 0.0000 0.0000 0.1401 ( 13389 PWs) bands (ev): -15.1140 -15.1140 -15.0212 -15.0212 -13.7919 -13.7919 -13.7776 -13.7776 -13.7699 -13.7699 -13.7553 -13.7553 -13.3459 -13.3459 -13.2902 -13.2902 -13.0031 -13.0031 -12.9377 -12.9377 -8.0036 -8.0036 -7.9440 -7.9440 -4.0403 -4.0403 -3.9539 -3.9539 -3.8833 -3.8833 -3.7625 -3.7625 -3.6939 -3.6939 -3.6500 -3.6500 -1.8390 -1.8390 -1.8350 -1.8350 -1.7816 -1.7816 -1.7719 -1.7719 -1.7687 -1.7687 -1.7656 -1.7656 -1.5188 -1.5188 -1.4564 -1.4564 -1.4334 -1.4334 -1.3918 -1.3918 -1.1005 -1.1005 -0.8503 -0.8503 -0.7875 -0.7875 -0.6558 -0.6558 -0.5449 -0.5449 -0.5378 -0.5378 -0.4948 -0.4948 -0.4894 -0.4894 -0.1699 -0.1699 -0.1233 -0.1233 -0.0597 -0.0597 0.0018 0.0018 1.9814 1.9814 2.0851 2.0851 5.3181 5.3181 5.3281 5.3281 5.6193 5.6193 5.6256 5.6256 6.8450 6.8450 6.9190 6.9190 k = 0.0000 0.0000 0.1634 ( 13371 PWs) bands (ev): -15.1111 -15.1111 -15.0221 -15.0221 -13.7916 -13.7916 -13.7779 -13.7779 -13.7695 -13.7695 -13.7556 -13.7556 -13.3558 -13.3558 -13.3014 -13.3014 -12.9918 -12.9918 -12.9302 -12.9302 -7.9943 -7.9943 -7.9374 -7.9374 -4.0415 -4.0415 -3.9653 -3.9653 -3.8808 -3.8808 -3.7650 -3.7650 -3.7275 -3.7275 -3.6922 -3.6922 -1.8400 -1.8400 -1.8388 -1.8388 -1.7937 -1.7937 -1.7830 -1.7830 -1.7415 -1.7415 -1.7370 -1.7370 -1.4975 -1.4975 -1.4379 -1.4379 -1.4131 -1.4131 -1.3721 -1.3721 -1.0950 -1.0950 -0.8488 -0.8488 -0.7889 -0.7889 -0.6726 -0.6726 -0.5525 -0.5525 -0.5406 -0.5406 -0.4978 -0.4978 -0.4916 -0.4916 -0.1720 -0.1720 -0.1251 -0.1251 -0.0652 -0.0652 -0.0038 -0.0038 2.0181 2.0181 2.1154 2.1154 5.3203 5.3203 5.3302 5.3302 5.6236 5.6236 5.6295 5.6295 6.7825 6.7825 6.9248 6.9248 k = 0.0000 0.0000 0.1868 ( 13388 PWs) bands (ev): -15.1079 -15.1079 -15.0233 -15.0233 -13.7912 -13.7912 -13.7783 -13.7783 -13.7692 -13.7692 -13.7560 -13.7560 -13.3658 -13.3658 -13.3132 -13.3132 -12.9801 -12.9801 -12.9226 -12.9226 -7.9841 -7.9841 -7.9302 -7.9302 -4.0437 -4.0437 -3.9799 -3.9799 -3.8779 -3.8779 -3.7680 -3.7680 -3.7598 -3.7598 -3.7352 -3.7352 -1.8504 -1.8504 -1.8480 -1.8480 -1.8059 -1.8059 -1.7971 -1.7971 -1.7033 -1.7033 -1.6965 -1.6965 -1.4756 -1.4756 -1.4187 -1.4187 -1.3929 -1.3929 -1.3524 -1.3524 -1.0894 -1.0894 -0.8472 -0.8472 -0.7905 -0.7905 -0.6926 -0.6926 -0.5596 -0.5596 -0.5437 -0.5437 -0.5011 -0.5011 -0.4942 -0.4942 -0.1741 -0.1741 -0.1267 -0.1267 -0.0713 -0.0713 -0.0102 -0.0102 2.0587 2.0587 2.1492 2.1492 5.3224 5.3224 5.3324 5.3324 5.6283 5.6283 5.6338 5.6338 6.7154 6.7154 6.9041 6.9041 k = 0.0000 0.0000 0.2101 ( 13406 PWs) bands (ev): -15.1044 -15.1044 -15.0246 -15.0246 -13.7909 -13.7909 -13.7787 -13.7787 -13.7688 -13.7688 -13.7564 -13.7564 -13.3756 -13.3756 -13.3252 -13.3252 -12.9685 -12.9685 -12.9152 -12.9152 -7.9732 -7.9732 -7.9227 -7.9227 -4.0476 -4.0476 -3.9985 -3.9985 -3.8746 -3.8746 -3.7891 -3.7891 -3.7772 -3.7772 -3.7713 -3.7713 -1.8619 -1.8619 -1.8597 -1.8597 -1.8177 -1.8177 -1.8106 -1.8106 -1.6622 -1.6622 -1.6517 -1.6517 -1.4535 -1.4535 -1.3992 -1.3992 -1.3731 -1.3731 -1.3330 -1.3330 -1.0839 -1.0839 -0.8454 -0.8454 -0.7923 -0.7923 -0.7155 -0.7155 -0.5661 -0.5661 -0.5473 -0.5473 -0.5047 -0.5047 -0.4971 -0.4971 -0.1760 -0.1760 -0.1282 -0.1282 -0.0781 -0.0781 -0.0171 -0.0171 2.1024 2.1024 2.1858 2.1858 5.3244 5.3244 5.3344 5.3344 5.6333 5.6333 5.6383 5.6383 6.6453 6.6453 6.8477 6.8477 k = 0.0000 0.0000 0.2334 ( 13382 PWs) bands (ev): -15.1006 -15.1006 -15.0262 -15.0262 -13.7904 -13.7904 -13.7791 -13.7791 -13.7684 -13.7684 -13.7568 -13.7568 -13.3849 -13.3849 -13.3372 -13.3372 -12.9569 -12.9569 -12.9081 -12.9081 -7.9618 -7.9618 -7.9150 -7.9150 -4.0538 -4.0538 -4.0209 -4.0209 -3.8711 -3.8711 -3.8161 -3.8161 -3.8142 -3.8142 -3.7749 -3.7749 -1.8734 -1.8734 -1.8718 -1.8718 -1.8291 -1.8291 -1.8233 -1.8233 -1.6200 -1.6200 -1.6056 -1.6056 -1.4313 -1.4313 -1.3795 -1.3795 -1.3543 -1.3543 -1.3144 -1.3144 -1.0789 -1.0789 -0.8433 -0.8433 -0.7943 -0.7943 -0.7410 -0.7410 -0.5721 -0.5721 -0.5511 -0.5511 -0.5085 -0.5085 -0.5002 -0.5002 -0.1777 -0.1777 -0.1293 -0.1293 -0.0853 -0.0853 -0.0246 -0.0246 2.1484 2.1484 2.2246 2.2246 5.3263 5.3263 5.3362 5.3362 5.6384 5.6384 5.6430 5.6430 6.5742 6.5742 6.7703 6.7703 k = 0.0000 0.0000 0.2568 ( 13364 PWs) bands (ev): -15.0965 -15.0965 -15.0280 -15.0280 -13.7900 -13.7900 -13.7796 -13.7796 -13.7679 -13.7679 -13.7573 -13.7573 -13.3935 -13.3935 -13.3491 -13.3491 -12.9458 -12.9458 -12.9015 -12.9015 -7.9502 -7.9502 -7.9073 -7.9073 -4.0633 -4.0633 -4.0465 -4.0465 -3.8672 -3.8672 -3.8502 -3.8502 -3.8348 -3.8348 -3.7788 -3.7788 -1.8843 -1.8843 -1.8834 -1.8834 -1.8398 -1.8398 -1.8349 -1.8349 -1.5778 -1.5778 -1.5597 -1.5597 -1.4093 -1.4093 -1.3601 -1.3601 -1.3368 -1.3368 -1.2970 -1.2970 -1.0745 -1.0745 -0.8412 -0.8412 -0.7969 -0.7969 -0.7683 -0.7683 -0.5774 -0.5774 -0.5552 -0.5552 -0.5123 -0.5123 -0.5036 -0.5036 -0.1790 -0.1790 -0.1300 -0.1300 -0.0929 -0.0929 -0.0325 -0.0325 2.1957 2.1957 2.2646 2.2646 5.3277 5.3277 5.3376 5.3376 5.6435 5.6435 5.6476 5.6476 6.5036 6.5036 6.6854 6.6854 k = 0.0000 0.0000 0.2801 ( 13364 PWs) bands (ev): -15.0922 -15.0922 -15.0301 -15.0301 -13.7895 -13.7895 -13.7801 -13.7801 -13.7674 -13.7674 -13.7578 -13.7578 -13.4013 -13.4013 -13.3605 -13.3605 -12.9352 -12.9352 -12.8955 -12.8955 -7.9386 -7.9386 -7.8999 -7.8999 -4.0770 -4.0770 -4.0739 -4.0739 -3.8776 -3.8776 -3.8631 -3.8631 -3.8514 -3.8514 -3.7830 -3.7830 -1.8945 -1.8945 -1.8942 -1.8942 -1.8497 -1.8497 -1.8456 -1.8456 -1.5361 -1.5361 -1.5150 -1.5150 -1.3877 -1.3877 -1.3411 -1.3411 -1.3209 -1.3209 -1.2811 -1.2811 -1.0710 -1.0710 -0.8389 -0.8389 -0.8042 -0.8042 -0.7927 -0.7927 -0.5821 -0.5821 -0.5595 -0.5595 -0.5160 -0.5160 -0.5071 -0.5071 -0.1798 -0.1798 -0.1301 -0.1301 -0.1008 -0.1008 -0.0408 -0.0408 2.2433 2.2433 2.3048 2.3048 5.3288 5.3288 5.3384 5.3384 5.6485 5.6485 5.6522 5.6522 6.4355 6.4355 6.5995 6.5995 k = 0.0000 0.0000 0.3035 ( 13418 PWs) bands (ev): -15.0878 -15.0878 -15.0325 -15.0325 -13.7890 -13.7890 -13.7807 -13.7807 -13.7668 -13.7668 -13.7583 -13.7583 -13.4081 -13.4081 -13.3714 -13.3714 -12.9253 -12.9253 -12.8904 -12.8904 -7.9273 -7.9273 -7.8930 -7.8930 -4.1014 -4.1014 -4.0948 -4.0948 -3.8977 -3.8977 -3.8649 -3.8649 -3.8587 -3.8587 -3.7875 -3.7875 -1.9040 -1.9040 -1.9037 -1.9037 -1.8587 -1.8587 -1.8550 -1.8550 -1.4958 -1.4958 -1.4724 -1.4724 -1.3667 -1.3667 -1.3229 -1.3229 -1.3071 -1.3071 -1.2670 -1.2670 -1.0684 -1.0684 -0.8365 -0.8365 -0.8310 -0.8310 -0.7990 -0.7990 -0.5862 -0.5862 -0.5640 -0.5640 -0.5196 -0.5196 -0.5106 -0.5106 -0.1800 -0.1800 -0.1296 -0.1296 -0.1089 -0.1089 -0.0492 -0.0492 2.2901 2.2901 2.3442 2.3442 5.3294 5.3294 5.3387 5.3387 5.6533 5.6533 5.6565 5.6565 6.3715 6.3715 6.5161 6.5161 k = 0.0000 0.0000 0.3268 ( 13418 PWs) bands (ev): -15.0833 -15.0833 -15.0351 -15.0351 -13.7885 -13.7885 -13.7812 -13.7812 -13.7663 -13.7663 -13.7589 -13.7589 -13.4138 -13.4138 -13.3815 -13.3815 -12.9161 -12.9161 -12.8860 -12.8860 -7.9165 -7.9165 -7.8868 -7.8868 -4.1276 -4.1276 -4.1154 -4.1154 -3.9110 -3.9110 -3.8760 -3.8760 -3.8541 -3.8541 -3.7922 -3.7922 -1.9126 -1.9126 -1.9120 -1.9120 -1.8667 -1.8667 -1.8634 -1.8634 -1.4573 -1.4573 -1.4327 -1.4327 -1.3465 -1.3465 -1.3056 -1.3056 -1.2955 -1.2955 -1.2549 -1.2549 -1.0667 -1.0667 -0.8622 -0.8622 -0.8340 -0.8340 -0.8019 -0.8019 -0.5895 -0.5895 -0.5686 -0.5686 -0.5229 -0.5229 -0.5142 -0.5142 -0.1795 -0.1795 -0.1284 -0.1284 -0.1170 -0.1170 -0.0578 -0.0578 2.3348 2.3348 2.3814 2.3814 5.3295 5.3295 5.3383 5.3383 5.6577 5.6577 5.6605 5.6605 6.3135 6.3135 6.4378 6.4378 k = 0.0000 0.0000 0.3502 ( 13430 PWs) bands (ev): -15.0786 -15.0786 -15.0379 -15.0379 -13.7879 -13.7879 -13.7818 -13.7818 -13.7657 -13.7657 -13.7594 -13.7594 -13.4182 -13.4182 -13.3908 -13.3908 -12.9078 -12.9078 -12.8827 -12.8827 -7.9065 -7.9065 -7.8815 -7.8815 -4.1511 -4.1511 -4.1371 -4.1371 -3.9188 -3.9188 -3.8853 -3.8853 -3.8492 -3.8492 -3.7970 -3.7970 -1.9199 -1.9199 -1.9191 -1.9191 -1.8735 -1.8735 -1.8706 -1.8706 -1.4214 -1.4214 -1.3965 -1.3965 -1.3273 -1.3273 -1.2895 -1.2895 -1.2864 -1.2864 -1.2452 -1.2452 -1.0655 -1.0655 -0.8941 -0.8941 -0.8314 -0.8314 -0.8045 -0.8045 -0.5921 -0.5921 -0.5732 -0.5732 -0.5257 -0.5257 -0.5177 -0.5177 -0.1783 -0.1783 -0.1264 -0.1264 -0.1251 -0.1251 -0.0663 -0.0663 2.3762 2.3762 2.4153 2.4153 5.3292 5.3292 5.3373 5.3373 5.6617 5.6617 5.6640 5.6640 6.2629 6.2629 6.3666 6.3666 k = 0.0000 0.0000 0.3735 ( 13466 PWs) bands (ev): -15.0740 -15.0740 -15.0411 -15.0411 -13.7873 -13.7873 -13.7824 -13.7824 -13.7651 -13.7651 -13.7601 -13.7601 -13.4214 -13.4214 -13.3991 -13.3991 -12.9005 -12.9005 -12.8803 -12.8803 -7.8975 -7.8975 -7.8774 -7.8774 -4.1712 -4.1712 -4.1577 -4.1577 -3.9225 -3.9225 -3.8933 -3.8933 -3.8443 -3.8443 -3.8021 -3.8021 -1.9259 -1.9259 -1.9251 -1.9251 -1.8790 -1.8790 -1.8766 -1.8766 -1.3890 -1.3890 -1.3648 -1.3648 -1.3095 -1.3095 -1.2797 -1.2797 -1.2749 -1.2749 -1.2380 -1.2380 -1.0642 -1.0642 -0.9258 -0.9258 -0.8287 -0.8287 -0.8071 -0.8071 -0.5938 -0.5938 -0.5776 -0.5776 -0.5280 -0.5280 -0.5210 -0.5210 -0.1763 -0.1763 -0.1329 -0.1329 -0.1236 -0.1236 -0.0747 -0.0747 2.4130 2.4130 2.4445 2.4445 5.3286 5.3286 5.3358 5.3358 5.6652 5.6652 5.6670 5.6670 6.2213 6.2213 6.3042 6.3042 k = 0.0000 0.0000 0.3969 ( 13460 PWs) bands (ev): -15.0694 -15.0694 -15.0445 -15.0445 -13.7867 -13.7867 -13.7830 -13.7830 -13.7645 -13.7645 -13.7607 -13.7607 -13.4233 -13.4233 -13.4064 -13.4064 -12.8942 -12.8942 -12.8790 -12.8790 -7.8897 -7.8897 -7.8745 -7.8745 -4.1869 -4.1869 -4.1756 -4.1756 -3.9235 -3.9235 -3.9004 -3.9004 -3.8391 -3.8391 -3.8072 -3.8072 -1.9306 -1.9306 -1.9298 -1.9298 -1.8833 -1.8833 -1.8813 -1.8813 -1.3610 -1.3610 -1.3387 -1.3387 -1.2938 -1.2938 -1.2755 -1.2755 -1.2620 -1.2620 -1.2335 -1.2335 -1.0617 -1.0617 -0.9565 -0.9565 -0.8260 -0.8260 -0.8098 -0.8098 -0.5946 -0.5946 -0.5818 -0.5818 -0.5295 -0.5295 -0.5239 -0.5239 -0.1734 -0.1734 -0.1405 -0.1405 -0.1200 -0.1200 -0.0828 -0.0828 2.4440 2.4440 2.4678 2.4678 5.3281 5.3281 5.3339 5.3339 5.6680 5.6680 5.6694 5.6694 6.1900 6.1900 6.2520 6.2520 k = 0.0000 0.0000 0.4202 ( 13484 PWs) bands (ev): -15.0649 -15.0649 -15.0482 -15.0482 -13.7861 -13.7861 -13.7836 -13.7836 -13.7639 -13.7639 -13.7613 -13.7613 -13.4238 -13.4238 -13.4124 -13.4124 -12.8889 -12.8889 -12.8787 -12.8787 -7.8833 -7.8833 -7.8731 -7.8731 -4.1978 -4.1978 -4.1898 -4.1898 -3.9225 -3.9225 -3.9065 -3.9065 -3.8339 -3.8339 -3.8125 -3.8125 -1.9339 -1.9339 -1.9333 -1.9333 -1.8863 -1.8863 -1.8849 -1.8849 -1.3383 -1.3383 -1.3198 -1.3198 -1.2811 -1.2811 -1.2729 -1.2729 -1.2512 -1.2512 -1.2317 -1.2317 -1.0565 -1.0565 -0.9852 -0.9852 -0.8233 -0.8233 -0.8124 -0.8124 -0.5944 -0.5944 -0.5856 -0.5856 -0.5304 -0.5304 -0.5265 -0.5265 -0.1698 -0.1698 -0.1476 -0.1476 -0.1155 -0.1155 -0.0905 -0.0905 2.4682 2.4682 2.4842 2.4842 5.3278 5.3278 5.3319 5.3319 5.6702 5.6702 5.6711 5.6711 6.1697 6.1697 6.2110 6.2110 k = 0.0000 0.0000 0.4436 ( 13502 PWs) bands (ev): -15.0605 -15.0605 -15.0521 -15.0521 -13.7855 -13.7855 -13.7843 -13.7843 -13.7632 -13.7632 -13.7619 -13.7619 -13.4230 -13.4230 -13.4173 -13.4173 -12.8847 -12.8847 -12.8796 -12.8796 -7.8784 -7.8784 -7.8733 -7.8733 -4.2036 -4.2036 -4.1995 -4.1995 -3.9200 -3.9200 -3.9118 -3.9118 -3.8286 -3.8286 -3.8178 -3.8178 -1.9358 -1.9358 -1.9354 -1.9354 -1.8879 -1.8879 -1.8872 -1.8872 -1.3216 -1.3216 -1.3106 -1.3106 -1.2730 -1.2730 -1.2710 -1.2710 -1.2425 -1.2425 -1.2327 -1.2327 -1.0468 -1.0468 -1.0107 -1.0107 -0.8206 -0.8206 -0.8151 -0.8151 -0.5934 -0.5934 -0.5889 -0.5889 -0.5305 -0.5305 -0.5285 -0.5285 -0.1653 -0.1653 -0.1541 -0.1541 -0.1103 -0.1103 -0.0977 -0.0977 2.4847 2.4847 2.4927 2.4927 5.3280 5.3280 5.3301 5.3301 5.6716 5.6716 5.6720 5.6720 6.1614 6.1614 6.1820 6.1820 k = 0.0000 0.0000 0.4669 ( 13508 PWs) bands (ev): -15.0562 -15.0562 -15.0562 -15.0562 -13.7849 -13.7849 -13.7849 -13.7849 -13.7626 -13.7626 -13.7626 -13.7626 -13.4208 -13.4208 -13.4208 -13.4208 -12.8816 -12.8816 -12.8816 -12.8816 -7.8750 -7.8750 -7.8750 -7.8750 -4.2042 -4.2042 -4.2042 -4.2042 -3.9164 -3.9164 -3.9164 -3.9164 -3.8232 -3.8232 -3.8232 -3.8232 -1.9363 -1.9363 -1.9363 -1.9363 -1.8882 -1.8882 -1.8882 -1.8882 -1.3118 -1.3118 -1.3118 -1.3118 -1.2702 -1.2702 -1.2701 -1.2701 -1.2363 -1.2363 -1.2363 -1.2363 -1.0316 -1.0316 -1.0316 -1.0316 -0.8179 -0.8179 -0.8179 -0.8179 -0.5915 -0.5915 -0.5915 -0.5915 -0.5298 -0.5298 -0.5298 -0.5298 -0.1601 -0.1601 -0.1601 -0.1601 -0.1043 -0.1043 -0.1043 -0.1043 2.4929 2.4929 2.4930 2.4930 5.3287 5.3287 5.3287 5.3287 5.6722 5.6722 5.6722 5.6722 6.1655 6.1655 6.1655 6.1655 k = 0.0000 0.0000 0.4669 ( 13508 PWs) bands (ev): -15.0562 -15.0562 -15.0562 -15.0562 -13.7849 -13.7849 -13.7849 -13.7849 -13.7626 -13.7626 -13.7626 -13.7626 -13.4208 -13.4208 -13.4208 -13.4208 -12.8816 -12.8816 -12.8816 -12.8816 -7.8750 -7.8750 -7.8750 -7.8750 -4.2042 -4.2042 -4.2042 -4.2042 -3.9164 -3.9164 -3.9164 -3.9164 -3.8232 -3.8232 -3.8232 -3.8232 -1.9363 -1.9363 -1.9363 -1.9363 -1.8882 -1.8882 -1.8882 -1.8882 -1.3118 -1.3118 -1.3118 -1.3118 -1.2702 -1.2702 -1.2701 -1.2701 -1.2363 -1.2363 -1.2363 -1.2363 -1.0316 -1.0316 -1.0316 -1.0316 -0.8179 -0.8179 -0.8179 -0.8179 -0.5915 -0.5915 -0.5915 -0.5915 -0.5298 -0.5298 -0.5298 -0.5298 -0.1601 -0.1601 -0.1601 -0.1601 -0.1043 -0.1043 -0.1043 -0.1043 2.4929 2.4929 2.4930 2.4930 5.3287 5.3287 5.3287 5.3287 5.6722 5.6722 5.6722 5.6722 6.1655 6.1655 6.1655 6.1655 k = 0.0200 0.0115 0.4669 ( 13502 PWs) bands (ev): -15.0560 -15.0560 -15.0560 -15.0560 -13.7851 -13.7851 -13.7851 -13.7851 -13.7628 -13.7628 -13.7628 -13.7628 -13.4208 -13.4208 -13.4208 -13.4208 -12.8814 -12.8814 -12.8814 -12.8814 -7.8743 -7.8743 -7.8743 -7.8743 -4.2043 -4.2043 -4.2043 -4.2043 -3.9168 -3.9168 -3.9168 -3.9168 -3.8236 -3.8236 -3.8236 -3.8236 -1.9366 -1.9366 -1.9366 -1.9366 -1.8886 -1.8886 -1.8886 -1.8886 -1.3174 -1.3174 -1.3174 -1.3174 -1.2677 -1.2677 -1.2677 -1.2677 -1.2339 -1.2339 -1.2339 -1.2339 -1.0300 -1.0300 -1.0300 -1.0300 -0.8190 -0.8190 -0.8190 -0.8190 -0.5910 -0.5910 -0.5910 -0.5910 -0.5294 -0.5294 -0.5294 -0.5294 -0.1605 -0.1605 -0.1605 -0.1605 -0.1048 -0.1048 -0.1048 -0.1048 2.4949 2.4949 2.4949 2.4949 5.3296 5.3296 5.3296 5.3296 5.6731 5.6731 5.6731 5.6731 6.1663 6.1663 6.1663 6.1663 k = 0.0400 0.0231 0.4669 ( 13480 PWs) bands (ev): -15.0555 -15.0555 -15.0554 -15.0554 -13.7859 -13.7859 -13.7859 -13.7859 -13.7635 -13.7635 -13.7635 -13.7635 -13.4208 -13.4208 -13.4208 -13.4208 -12.8808 -12.8808 -12.8808 -12.8808 -7.8722 -7.8722 -7.8722 -7.8722 -4.2046 -4.2046 -4.2046 -4.2046 -3.9182 -3.9182 -3.9182 -3.9182 -3.8248 -3.8248 -3.8248 -3.8248 -1.9377 -1.9377 -1.9377 -1.9377 -1.8898 -1.8898 -1.8898 -1.8898 -1.3307 -1.3307 -1.3307 -1.3307 -1.2639 -1.2639 -1.2639 -1.2639 -1.2266 -1.2266 -1.2266 -1.2266 -1.0254 -1.0254 -1.0253 -1.0253 -0.8226 -0.8226 -0.8226 -0.8226 -0.5895 -0.5895 -0.5895 -0.5895 -0.5280 -0.5280 -0.5280 -0.5280 -0.1617 -0.1617 -0.1617 -0.1617 -0.1060 -0.1060 -0.1060 -0.1060 2.5007 2.5007 2.5007 2.5007 5.3319 5.3319 5.3319 5.3319 5.6759 5.6759 5.6759 5.6759 6.1687 6.1687 6.1687 6.1687 k = 0.0600 0.0346 0.4669 ( 13468 PWs) bands (ev): -15.0546 -15.0546 -15.0546 -15.0546 -13.7872 -13.7872 -13.7872 -13.7872 -13.7646 -13.7646 -13.7646 -13.7646 -13.4208 -13.4208 -13.4208 -13.4208 -12.8797 -12.8797 -12.8797 -12.8797 -7.8686 -7.8686 -7.8686 -7.8686 -4.2052 -4.2052 -4.2052 -4.2052 -3.9208 -3.9208 -3.9208 -3.9208 -3.8265 -3.8265 -3.8265 -3.8265 -1.9394 -1.9394 -1.9393 -1.9393 -1.8917 -1.8917 -1.8917 -1.8917 -1.3477 -1.3477 -1.3476 -1.3476 -1.2617 -1.2617 -1.2617 -1.2617 -1.2153 -1.2153 -1.2153 -1.2153 -1.0181 -1.0181 -1.0180 -1.0180 -0.8282 -0.8282 -0.8282 -0.8282 -0.5870 -0.5870 -0.5870 -0.5870 -0.5257 -0.5257 -0.5257 -0.5257 -0.1639 -0.1639 -0.1639 -0.1639 -0.1080 -0.1080 -0.1080 -0.1080 2.5103 2.5103 2.5103 2.5103 5.3357 5.3357 5.3357 5.3357 5.6806 5.6806 5.6806 5.6806 6.1727 6.1727 6.1727 6.1727 k = 0.0800 0.0462 0.4669 ( 13472 PWs) bands (ev): -15.0533 -15.0533 -15.0533 -15.0533 -13.7893 -13.7893 -13.7893 -13.7893 -13.7658 -13.7658 -13.7658 -13.7658 -13.4208 -13.4208 -13.4208 -13.4208 -12.8784 -12.8784 -12.8784 -12.8784 -7.8637 -7.8637 -7.8637 -7.8637 -4.2060 -4.2060 -4.2060 -4.2060 -3.9248 -3.9248 -3.9248 -3.9248 -3.8282 -3.8282 -3.8282 -3.8282 -1.9416 -1.9416 -1.9416 -1.9416 -1.8942 -1.8942 -1.8942 -1.8942 -1.3666 -1.3666 -1.3666 -1.3666 -1.2610 -1.2610 -1.2610 -1.2610 -1.2013 -1.2013 -1.2013 -1.2013 -1.0086 -1.0086 -1.0086 -1.0086 -0.8359 -0.8359 -0.8359 -0.8359 -0.5838 -0.5838 -0.5838 -0.5838 -0.5227 -0.5227 -0.5226 -0.5226 -0.1669 -0.1669 -0.1669 -0.1669 -0.1107 -0.1107 -0.1107 -0.1107 2.5236 2.5236 2.5236 2.5236 5.3407 5.3407 5.3407 5.3407 5.6874 5.6874 5.6874 5.6874 6.1782 6.1782 6.1783 6.1783 k = 0.1000 0.0577 0.4669 ( 13446 PWs) bands (ev): -15.0518 -15.0518 -15.0518 -15.0518 -13.7921 -13.7921 -13.7921 -13.7921 -13.7671 -13.7671 -13.7671 -13.7671 -13.4208 -13.4208 -13.4208 -13.4208 -12.8766 -12.8766 -12.8766 -12.8766 -7.8576 -7.8576 -7.8576 -7.8576 -4.2071 -4.2071 -4.2071 -4.2071 -3.9308 -3.9308 -3.9308 -3.9308 -3.8295 -3.8295 -3.8295 -3.8295 -1.9443 -1.9443 -1.9443 -1.9443 -1.8970 -1.8970 -1.8970 -1.8970 -1.3869 -1.3869 -1.3869 -1.3869 -1.2613 -1.2613 -1.2613 -1.2613 -1.1857 -1.1857 -1.1857 -1.1857 -0.9977 -0.9977 -0.9977 -0.9977 -0.8451 -0.8451 -0.8451 -0.8451 -0.5798 -0.5798 -0.5798 -0.5798 -0.5189 -0.5189 -0.5189 -0.5189 -0.1709 -0.1709 -0.1709 -0.1709 -0.1138 -0.1138 -0.1138 -0.1138 2.5403 2.5403 2.5403 2.5403 5.3464 5.3464 5.3464 5.3464 5.6964 5.6964 5.6964 5.6964 6.1853 6.1853 6.1853 6.1853 k = 0.1200 0.0693 0.4669 ( 13434 PWs) bands (ev): -15.0499 -15.0499 -15.0499 -15.0499 -13.7958 -13.7958 -13.7958 -13.7958 -13.7683 -13.7683 -13.7683 -13.7683 -13.4208 -13.4208 -13.4208 -13.4208 -12.8746 -12.8746 -12.8746 -12.8746 -7.8502 -7.8502 -7.8502 -7.8502 -4.2085 -4.2085 -4.2085 -4.2085 -3.9390 -3.9390 -3.9390 -3.9390 -3.8299 -3.8299 -3.8299 -3.8299 -1.9473 -1.9473 -1.9473 -1.9473 -1.9002 -1.9002 -1.9002 -1.9002 -1.4080 -1.4080 -1.4080 -1.4080 -1.2621 -1.2621 -1.2621 -1.2621 -1.1692 -1.1692 -1.1692 -1.1692 -0.9857 -0.9857 -0.9857 -0.9857 -0.8557 -0.8557 -0.8557 -0.8557 -0.5753 -0.5753 -0.5753 -0.5753 -0.5146 -0.5146 -0.5146 -0.5146 -0.1759 -0.1759 -0.1759 -0.1759 -0.1173 -0.1173 -0.1173 -0.1173 2.5604 2.5604 2.5604 2.5604 5.3526 5.3526 5.3526 5.3526 5.7077 5.7077 5.7077 5.7077 6.1937 6.1937 6.1937 6.1937 k = 0.1400 0.0808 0.4669 ( 13422 PWs) bands (ev): -15.0478 -15.0478 -15.0478 -15.0478 -13.8004 -13.8004 -13.8004 -13.8004 -13.7693 -13.7693 -13.7693 -13.7693 -13.4208 -13.4208 -13.4208 -13.4208 -12.8723 -12.8723 -12.8723 -12.8723 -7.8417 -7.8417 -7.8417 -7.8417 -4.2103 -4.2103 -4.2103 -4.2103 -3.9494 -3.9494 -3.9494 -3.9494 -3.8292 -3.8292 -3.8292 -3.8292 -1.9504 -1.9504 -1.9504 -1.9504 -1.9035 -1.9035 -1.9034 -1.9034 -1.4297 -1.4297 -1.4297 -1.4297 -1.2634 -1.2634 -1.2633 -1.2633 -1.1520 -1.1520 -1.1520 -1.1520 -0.9733 -0.9733 -0.9733 -0.9733 -0.8672 -0.8672 -0.8672 -0.8672 -0.5703 -0.5703 -0.5703 -0.5703 -0.5098 -0.5098 -0.5098 -0.5098 -0.1820 -0.1820 -0.1820 -0.1820 -0.1210 -0.1210 -0.1210 -0.1210 2.5835 2.5835 2.5835 2.5835 5.3588 5.3588 5.3588 5.3588 5.7214 5.7214 5.7214 5.7214 6.2034 6.2034 6.2034 6.2034 k = 0.1600 0.0924 0.4669 ( 13432 PWs) bands (ev): -15.0454 -15.0454 -15.0454 -15.0454 -13.8057 -13.8057 -13.8057 -13.8057 -13.7701 -13.7701 -13.7701 -13.7701 -13.4208 -13.4208 -13.4208 -13.4208 -12.8697 -12.8697 -12.8697 -12.8697 -7.8322 -7.8322 -7.8322 -7.8322 -4.2125 -4.2125 -4.2125 -4.2125 -3.9619 -3.9619 -3.9619 -3.9619 -3.8273 -3.8273 -3.8273 -3.8273 -1.9534 -1.9534 -1.9534 -1.9534 -1.9068 -1.9068 -1.9068 -1.9068 -1.4517 -1.4517 -1.4517 -1.4517 -1.2649 -1.2649 -1.2649 -1.2649 -1.1345 -1.1345 -1.1345 -1.1345 -0.9609 -0.9609 -0.9609 -0.9609 -0.8793 -0.8793 -0.8793 -0.8793 -0.5649 -0.5649 -0.5649 -0.5649 -0.5048 -0.5048 -0.5048 -0.5048 -0.1890 -0.1890 -0.1890 -0.1890 -0.1247 -0.1247 -0.1247 -0.1247 2.6092 2.6092 2.6092 2.6092 5.3646 5.3646 5.3646 5.3646 5.7376 5.7376 5.7376 5.7376 6.2142 6.2142 6.2142 6.2142 k = 0.1800 0.1039 0.4669 ( 13426 PWs) bands (ev): -15.0428 -15.0428 -15.0428 -15.0428 -13.8117 -13.8117 -13.8117 -13.8117 -13.7708 -13.7708 -13.7708 -13.7708 -13.4208 -13.4208 -13.4208 -13.4208 -12.8670 -12.8670 -12.8670 -12.8670 -7.8219 -7.8219 -7.8219 -7.8219 -4.2153 -4.2153 -4.2153 -4.2153 -3.9761 -3.9761 -3.9761 -3.9761 -3.8242 -3.8242 -3.8242 -3.8242 -1.9561 -1.9561 -1.9561 -1.9561 -1.9102 -1.9102 -1.9102 -1.9102 -1.4737 -1.4737 -1.4737 -1.4737 -1.2668 -1.2668 -1.2668 -1.2668 -1.1169 -1.1169 -1.1169 -1.1169 -0.9492 -0.9492 -0.9492 -0.9492 -0.8912 -0.8912 -0.8912 -0.8912 -0.5594 -0.5594 -0.5594 -0.5594 -0.4995 -0.4995 -0.4994 -0.4994 -0.1970 -0.1970 -0.1970 -0.1970 -0.1284 -0.1284 -0.1284 -0.1284 2.6374 2.6374 2.6374 2.6374 5.3697 5.3697 5.3697 5.3697 5.7563 5.7563 5.7563 5.7563 6.2262 6.2262 6.2262 6.2262 k = 0.2000 0.1155 0.4669 ( 13426 PWs) bands (ev): -15.0400 -15.0400 -15.0400 -15.0400 -13.8182 -13.8182 -13.8182 -13.8182 -13.7714 -13.7714 -13.7714 -13.7714 -13.4208 -13.4208 -13.4208 -13.4208 -12.8642 -12.8642 -12.8642 -12.8642 -7.8108 -7.8108 -7.8108 -7.8108 -4.2186 -4.2186 -4.2186 -4.2186 -3.9916 -3.9916 -3.9916 -3.9916 -3.8201 -3.8201 -3.8201 -3.8201 -1.9584 -1.9584 -1.9584 -1.9584 -1.9135 -1.9135 -1.9135 -1.9135 -1.4957 -1.4957 -1.4957 -1.4957 -1.2689 -1.2689 -1.2689 -1.2689 -1.0995 -1.0995 -1.0995 -1.0995 -0.9395 -0.9395 -0.9395 -0.9395 -0.9017 -0.9017 -0.9017 -0.9017 -0.5536 -0.5536 -0.5536 -0.5536 -0.4940 -0.4940 -0.4940 -0.4940 -0.2058 -0.2058 -0.2058 -0.2058 -0.1319 -0.1319 -0.1319 -0.1319 2.6675 2.6675 2.6675 2.6675 5.3738 5.3738 5.3738 5.3738 5.7772 5.7772 5.7772 5.7772 6.2390 6.2390 6.2390 6.2390 k = 0.2200 0.1270 0.4669 ( 13438 PWs) bands (ev): -15.0371 -15.0371 -15.0371 -15.0371 -13.8251 -13.8251 -13.8251 -13.8251 -13.7718 -13.7718 -13.7718 -13.7718 -13.4208 -13.4208 -13.4208 -13.4208 -12.8613 -12.8613 -12.8613 -12.8613 -7.7992 -7.7992 -7.7992 -7.7992 -4.2226 -4.2226 -4.2226 -4.2226 -4.0079 -4.0079 -4.0079 -4.0079 -3.8153 -3.8153 -3.8153 -3.8153 -1.9603 -1.9603 -1.9602 -1.9602 -1.9167 -1.9167 -1.9167 -1.9167 -1.5173 -1.5173 -1.5173 -1.5173 -1.2712 -1.2712 -1.2712 -1.2712 -1.0826 -1.0826 -1.0826 -1.0826 -0.9357 -0.9357 -0.9357 -0.9357 -0.9065 -0.9065 -0.9065 -0.9065 -0.5479 -0.5479 -0.5478 -0.5478 -0.4886 -0.4886 -0.4886 -0.4886 -0.2152 -0.2152 -0.2152 -0.2152 -0.1353 -0.1353 -0.1353 -0.1353 2.6991 2.6991 2.6992 2.6992 5.3768 5.3768 5.3768 5.3768 5.8001 5.8001 5.8001 5.8001 6.2526 6.2526 6.2526 6.2526 k = 0.2400 0.1386 0.4669 ( 13442 PWs) bands (ev): -15.0341 -15.0341 -15.0341 -15.0341 -13.8322 -13.8322 -13.8322 -13.8322 -13.7722 -13.7722 -13.7722 -13.7722 -13.4208 -13.4208 -13.4208 -13.4208 -12.8583 -12.8583 -12.8583 -12.8583 -7.7872 -7.7872 -7.7872 -7.7872 -4.2274 -4.2274 -4.2274 -4.2274 -4.0243 -4.0243 -4.0243 -4.0243 -3.8098 -3.8098 -3.8098 -3.8098 -1.9615 -1.9615 -1.9615 -1.9615 -1.9197 -1.9197 -1.9197 -1.9197 -1.5386 -1.5386 -1.5386 -1.5386 -1.2737 -1.2737 -1.2737 -1.2737 -1.0665 -1.0665 -1.0665 -1.0665 -0.9414 -0.9414 -0.9414 -0.9414 -0.9021 -0.9021 -0.9021 -0.9021 -0.5421 -0.5421 -0.5421 -0.5421 -0.4832 -0.4832 -0.4832 -0.4832 -0.2251 -0.2251 -0.2251 -0.2251 -0.1386 -0.1386 -0.1386 -0.1386 2.7319 2.7319 2.7319 2.7319 5.3786 5.3786 5.3786 5.3786 5.8247 5.8247 5.8247 5.8247 6.2668 6.2668 6.2668 6.2668 k = 0.2600 0.1501 0.4669 ( 13434 PWs) bands (ev): -15.0310 -15.0310 -15.0310 -15.0310 -13.8395 -13.8395 -13.8395 -13.8395 -13.7725 -13.7725 -13.7725 -13.7725 -13.4208 -13.4208 -13.4208 -13.4208 -12.8554 -12.8554 -12.8554 -12.8554 -7.7750 -7.7750 -7.7750 -7.7750 -4.2332 -4.2332 -4.2332 -4.2332 -4.0405 -4.0405 -4.0405 -4.0405 -3.8039 -3.8039 -3.8039 -3.8039 -1.9623 -1.9623 -1.9623 -1.9623 -1.9223 -1.9223 -1.9223 -1.9223 -1.5593 -1.5593 -1.5593 -1.5593 -1.2764 -1.2764 -1.2764 -1.2764 -1.0515 -1.0515 -1.0515 -1.0515 -0.9510 -0.9510 -0.9510 -0.9510 -0.8936 -0.8936 -0.8935 -0.8935 -0.5365 -0.5365 -0.5365 -0.5365 -0.4779 -0.4779 -0.4779 -0.4779 -0.2352 -0.2352 -0.2352 -0.2352 -0.1416 -0.1416 -0.1416 -0.1416 2.7653 2.7653 2.7653 2.7653 5.3792 5.3792 5.3792 5.3792 5.8503 5.8503 5.8503 5.8503 6.2814 6.2814 6.2814 6.2814 k = 0.2800 0.1617 0.4669 ( 13438 PWs) bands (ev): -15.0279 -15.0279 -15.0279 -15.0279 -13.8467 -13.8467 -13.8467 -13.8467 -13.7727 -13.7727 -13.7727 -13.7727 -13.4209 -13.4209 -13.4209 -13.4209 -12.8525 -12.8525 -12.8525 -12.8525 -7.7628 -7.7628 -7.7628 -7.7628 -4.2399 -4.2399 -4.2399 -4.2399 -4.0558 -4.0558 -4.0558 -4.0558 -3.7978 -3.7978 -3.7978 -3.7978 -1.9628 -1.9628 -1.9628 -1.9628 -1.9243 -1.9243 -1.9242 -1.9242 -1.5794 -1.5794 -1.5794 -1.5794 -1.2791 -1.2791 -1.2791 -1.2791 -1.0381 -1.0381 -1.0381 -1.0381 -0.9610 -0.9610 -0.9610 -0.9610 -0.8842 -0.8842 -0.8842 -0.8842 -0.5310 -0.5310 -0.5310 -0.5310 -0.4728 -0.4728 -0.4728 -0.4728 -0.2454 -0.2454 -0.2454 -0.2454 -0.1445 -0.1445 -0.1445 -0.1445 2.7987 2.7987 2.7987 2.7987 5.3787 5.3787 5.3787 5.3787 5.8766 5.8766 5.8766 5.8766 6.2963 6.2963 6.2963 6.2963 k = 0.3000 0.1732 0.4669 ( 13434 PWs) bands (ev): -15.0249 -15.0249 -15.0249 -15.0249 -13.8537 -13.8537 -13.8537 -13.8537 -13.7729 -13.7729 -13.7729 -13.7729 -13.4209 -13.4209 -13.4209 -13.4209 -12.8497 -12.8497 -12.8497 -12.8497 -7.7508 -7.7508 -7.7508 -7.7508 -4.2477 -4.2477 -4.2477 -4.2477 -4.0698 -4.0698 -4.0698 -4.0698 -3.7916 -3.7916 -3.7916 -3.7916 -1.9632 -1.9632 -1.9632 -1.9632 -1.9254 -1.9254 -1.9254 -1.9254 -1.5987 -1.5987 -1.5987 -1.5987 -1.2820 -1.2820 -1.2820 -1.2820 -1.0270 -1.0270 -1.0270 -1.0270 -0.9695 -0.9695 -0.9695 -0.9695 -0.8750 -0.8750 -0.8750 -0.8750 -0.5259 -0.5259 -0.5259 -0.5259 -0.4680 -0.4680 -0.4680 -0.4680 -0.2554 -0.2554 -0.2554 -0.2554 -0.1472 -0.1472 -0.1472 -0.1472 2.8317 2.8317 2.8317 2.8317 5.3773 5.3773 5.3773 5.3773 5.9029 5.9029 5.9030 5.9030 6.3112 6.3112 6.3112 6.3112 k = 0.3200 0.1848 0.4669 ( 13440 PWs) bands (ev): -15.0220 -15.0220 -15.0220 -15.0220 -13.8605 -13.8605 -13.8605 -13.8605 -13.7731 -13.7731 -13.7731 -13.7731 -13.4209 -13.4209 -13.4209 -13.4209 -12.8471 -12.8471 -12.8471 -12.8471 -7.7391 -7.7391 -7.7391 -7.7391 -4.2564 -4.2564 -4.2564 -4.2564 -4.0823 -4.0823 -4.0823 -4.0823 -3.7854 -3.7854 -3.7854 -3.7854 -1.9637 -1.9637 -1.9637 -1.9637 -1.9255 -1.9255 -1.9255 -1.9255 -1.6172 -1.6172 -1.6172 -1.6172 -1.2849 -1.2849 -1.2849 -1.2849 -1.0196 -1.0196 -1.0196 -1.0196 -0.9750 -0.9750 -0.9750 -0.9750 -0.8663 -0.8663 -0.8662 -0.8662 -0.5210 -0.5210 -0.5210 -0.5210 -0.4635 -0.4635 -0.4635 -0.4635 -0.2650 -0.2650 -0.2650 -0.2650 -0.1497 -0.1497 -0.1497 -0.1497 2.8638 2.8638 2.8638 2.8638 5.3751 5.3751 5.3751 5.3751 5.9287 5.9287 5.9287 5.9287 6.3258 6.3258 6.3258 6.3258 k = 0.3400 0.1963 0.4669 ( 13434 PWs) bands (ev): -15.0192 -15.0192 -15.0192 -15.0192 -13.8669 -13.8669 -13.8669 -13.8669 -13.7733 -13.7733 -13.7733 -13.7733 -13.4209 -13.4209 -13.4209 -13.4209 -12.8447 -12.8447 -12.8447 -12.8447 -7.7280 -7.7280 -7.7280 -7.7280 -4.2657 -4.2657 -4.2657 -4.2657 -4.0930 -4.0930 -4.0930 -4.0930 -3.7795 -3.7795 -3.7795 -3.7795 -1.9646 -1.9646 -1.9646 -1.9646 -1.9244 -1.9244 -1.9244 -1.9244 -1.6346 -1.6346 -1.6346 -1.6346 -1.2877 -1.2877 -1.2877 -1.2877 -1.0174 -1.0174 -1.0173 -1.0173 -0.9758 -0.9758 -0.9758 -0.9758 -0.8581 -0.8581 -0.8581 -0.8581 -0.5166 -0.5166 -0.5166 -0.5166 -0.4593 -0.4593 -0.4593 -0.4593 -0.2742 -0.2742 -0.2742 -0.2742 -0.1520 -0.1520 -0.1520 -0.1520 2.8943 2.8943 2.8943 2.8943 5.3723 5.3723 5.3723 5.3723 5.9534 5.9534 5.9534 5.9534 6.3400 6.3400 6.3400 6.3400 k = 0.3600 0.2078 0.4669 ( 13434 PWs) bands (ev): -15.0166 -15.0166 -15.0166 -15.0166 -13.8728 -13.8728 -13.8728 -13.8728 -13.7734 -13.7734 -13.7734 -13.7734 -13.4210 -13.4210 -13.4209 -13.4209 -12.8424 -12.8424 -12.8424 -12.8424 -7.7177 -7.7177 -7.7177 -7.7177 -4.2754 -4.2754 -4.2754 -4.2754 -4.1020 -4.1020 -4.1020 -4.1020 -3.7738 -3.7738 -3.7738 -3.7738 -1.9659 -1.9659 -1.9659 -1.9659 -1.9221 -1.9221 -1.9221 -1.9221 -1.6508 -1.6508 -1.6508 -1.6508 -1.2905 -1.2905 -1.2905 -1.2905 -1.0197 -1.0197 -1.0197 -1.0197 -0.9724 -0.9724 -0.9724 -0.9724 -0.8507 -0.8507 -0.8507 -0.8507 -0.5125 -0.5125 -0.5125 -0.5125 -0.4556 -0.4556 -0.4556 -0.4556 -0.2826 -0.2826 -0.2826 -0.2826 -0.1541 -0.1541 -0.1541 -0.1541 2.9228 2.9228 2.9228 2.9228 5.3691 5.3691 5.3692 5.3692 5.9765 5.9765 5.9765 5.9765 6.3535 6.3535 6.3535 6.3535 k = 0.3800 0.2194 0.4669 ( 13446 PWs) bands (ev): -15.0142 -15.0142 -15.0142 -15.0142 -13.8781 -13.8781 -13.8781 -13.8781 -13.7735 -13.7735 -13.7735 -13.7735 -13.4210 -13.4210 -13.4210 -13.4210 -12.8405 -12.8405 -12.8405 -12.8405 -7.7084 -7.7084 -7.7084 -7.7084 -4.2850 -4.2850 -4.2850 -4.2850 -4.1093 -4.1093 -4.1093 -4.1093 -3.7687 -3.7687 -3.7687 -3.7687 -1.9674 -1.9674 -1.9674 -1.9674 -1.9190 -1.9190 -1.9189 -1.9189 -1.6658 -1.6658 -1.6658 -1.6658 -1.2931 -1.2931 -1.2931 -1.2931 -1.0242 -1.0242 -1.0242 -1.0242 -0.9672 -0.9672 -0.9672 -0.9672 -0.8440 -0.8440 -0.8440 -0.8440 -0.5090 -0.5090 -0.5090 -0.5090 -0.4522 -0.4522 -0.4522 -0.4522 -0.2903 -0.2903 -0.2902 -0.2902 -0.1560 -0.1560 -0.1560 -0.1560 2.9488 2.9488 2.9488 2.9488 5.3658 5.3658 5.3658 5.3658 5.9974 5.9974 5.9974 5.9974 6.3660 6.3660 6.3660 6.3660 k = 0.4000 0.2309 0.4669 ( 13458 PWs) bands (ev): -15.0122 -15.0122 -15.0122 -15.0122 -13.8828 -13.8828 -13.8828 -13.8828 -13.7736 -13.7736 -13.7736 -13.7736 -13.4210 -13.4210 -13.4210 -13.4210 -12.8387 -12.8387 -12.8387 -12.8387 -7.7001 -7.7001 -7.7001 -7.7001 -4.2941 -4.2941 -4.2941 -4.2941 -4.1151 -4.1151 -4.1151 -4.1151 -3.7641 -3.7641 -3.7641 -3.7641 -1.9691 -1.9691 -1.9691 -1.9691 -1.9152 -1.9152 -1.9152 -1.9152 -1.6792 -1.6792 -1.6792 -1.6792 -1.2954 -1.2954 -1.2954 -1.2954 -1.0290 -1.0290 -1.0290 -1.0290 -0.9619 -0.9619 -0.9619 -0.9619 -0.8382 -0.8382 -0.8382 -0.8382 -0.5059 -0.5059 -0.5059 -0.5059 -0.4493 -0.4493 -0.4493 -0.4493 -0.2969 -0.2969 -0.2969 -0.2969 -0.1575 -0.1575 -0.1575 -0.1575 2.9717 2.9717 2.9717 2.9717 5.3626 5.3626 5.3626 5.3626 6.0158 6.0158 6.0158 6.0158 6.3772 6.3772 6.3772 6.3772 k = 0.4200 0.2425 0.4669 ( 13436 PWs) bands (ev): -15.0104 -15.0104 -15.0104 -15.0104 -13.8867 -13.8867 -13.8867 -13.8867 -13.7737 -13.7737 -13.7737 -13.7737 -13.4210 -13.4210 -13.4210 -13.4210 -12.8373 -12.8373 -12.8373 -12.8373 -7.6931 -7.6931 -7.6931 -7.6931 -4.3022 -4.3022 -4.3022 -4.3022 -4.1196 -4.1196 -4.1196 -4.1196 -3.7602 -3.7602 -3.7602 -3.7602 -1.9707 -1.9707 -1.9707 -1.9707 -1.9112 -1.9112 -1.9112 -1.9112 -1.6908 -1.6908 -1.6908 -1.6908 -1.2974 -1.2974 -1.2974 -1.2974 -1.0334 -1.0334 -1.0333 -1.0333 -0.9573 -0.9573 -0.9572 -0.9572 -0.8333 -0.8333 -0.8333 -0.8333 -0.5034 -0.5034 -0.5034 -0.5034 -0.4470 -0.4470 -0.4470 -0.4470 -0.3025 -0.3025 -0.3025 -0.3025 -0.1589 -0.1589 -0.1589 -0.1589 2.9910 2.9910 2.9910 2.9910 5.3596 5.3596 5.3596 5.3596 6.0313 6.0313 6.0313 6.0313 6.3869 6.3869 6.3869 6.3869 k = 0.4400 0.2540 0.4669 ( 13448 PWs) bands (ev): -15.0090 -15.0090 -15.0090 -15.0090 -13.8898 -13.8898 -13.8898 -13.8898 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8361 -12.8361 -12.8361 -12.8361 -7.6876 -7.6876 -7.6876 -7.6876 -4.3089 -4.3089 -4.3089 -4.3089 -4.1229 -4.1229 -4.1229 -4.1229 -3.7571 -3.7571 -3.7571 -3.7571 -1.9721 -1.9721 -1.9721 -1.9721 -1.9075 -1.9075 -1.9075 -1.9075 -1.7003 -1.7003 -1.7003 -1.7003 -1.2991 -1.2991 -1.2991 -1.2991 -1.0369 -1.0369 -1.0369 -1.0369 -0.9536 -0.9536 -0.9535 -0.9535 -0.8294 -0.8294 -0.8294 -0.8294 -0.5014 -0.5014 -0.5014 -0.5014 -0.4451 -0.4451 -0.4451 -0.4451 -0.3070 -0.3070 -0.3070 -0.3070 -0.1599 -0.1599 -0.1599 -0.1599 3.0066 3.0066 3.0066 3.0066 5.3570 5.3570 5.3570 5.3570 6.0436 6.0436 6.0436 6.0436 6.3947 6.3947 6.3947 6.3947 k = 0.4600 0.2656 0.4669 ( 13436 PWs) bands (ev): -15.0080 -15.0080 -15.0080 -15.0080 -13.8921 -13.8921 -13.8921 -13.8921 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8353 -12.8353 -12.8353 -12.8353 -7.6835 -7.6835 -7.6835 -7.6835 -4.3139 -4.3139 -4.3139 -4.3139 -4.1252 -4.1252 -4.1252 -4.1252 -3.7548 -3.7548 -3.7548 -3.7548 -1.9732 -1.9732 -1.9732 -1.9732 -1.9045 -1.9045 -1.9045 -1.9045 -1.7074 -1.7074 -1.7074 -1.7074 -1.3003 -1.3003 -1.3003 -1.3003 -1.0396 -1.0396 -1.0396 -1.0396 -0.9509 -0.9509 -0.9508 -0.9508 -0.8266 -0.8266 -0.8265 -0.8265 -0.5000 -0.5000 -0.5000 -0.5000 -0.4437 -0.4437 -0.4437 -0.4437 -0.3102 -0.3102 -0.3102 -0.3102 -0.1607 -0.1607 -0.1607 -0.1607 3.0179 3.0179 3.0179 3.0179 5.3551 5.3551 5.3551 5.3551 6.0526 6.0526 6.0526 6.0526 6.4005 6.4005 6.4005 6.4005 k = 0.4800 0.2771 0.4669 ( 13424 PWs) bands (ev): -15.0074 -15.0074 -15.0074 -15.0074 -13.8935 -13.8935 -13.8935 -13.8935 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8348 -12.8348 -12.8348 -12.8348 -7.6811 -7.6811 -7.6811 -7.6811 -4.3170 -4.3170 -4.3170 -4.3170 -4.1265 -4.1265 -4.1265 -4.1265 -3.7534 -3.7534 -3.7534 -3.7534 -1.9739 -1.9739 -1.9739 -1.9739 -1.9025 -1.9025 -1.9025 -1.9025 -1.7119 -1.7119 -1.7119 -1.7119 -1.3011 -1.3011 -1.3010 -1.3010 -1.0412 -1.0412 -1.0412 -1.0412 -0.9492 -0.9492 -0.9492 -0.9492 -0.8248 -0.8248 -0.8248 -0.8248 -0.4991 -0.4991 -0.4991 -0.4991 -0.4429 -0.4429 -0.4429 -0.4429 -0.3122 -0.3122 -0.3122 -0.3122 -0.1611 -0.1611 -0.1611 -0.1611 3.0248 3.0248 3.0248 3.0248 5.3539 5.3539 5.3539 5.3539 6.0580 6.0580 6.0581 6.0581 6.4040 6.4040 6.4040 6.4040 k = 0.5000 0.2887 0.4669 ( 13432 PWs) bands (ev): -15.0072 -15.0072 -15.0072 -15.0072 -13.8939 -13.8939 -13.8939 -13.8939 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8347 -12.8347 -12.8347 -12.8347 -7.6802 -7.6802 -7.6802 -7.6802 -4.3181 -4.3181 -4.3181 -4.3181 -4.1269 -4.1269 -4.1269 -4.1269 -3.7530 -3.7530 -3.7530 -3.7530 -1.9741 -1.9741 -1.9741 -1.9741 -1.9018 -1.9018 -1.9018 -1.9018 -1.7134 -1.7134 -1.7134 -1.7134 -1.3013 -1.3013 -1.3013 -1.3013 -1.0417 -1.0417 -1.0417 -1.0417 -0.9487 -0.9487 -0.9487 -0.9487 -0.8243 -0.8243 -0.8242 -0.8242 -0.4989 -0.4989 -0.4989 -0.4989 -0.4426 -0.4426 -0.4426 -0.4426 -0.3128 -0.3128 -0.3128 -0.3128 -0.1613 -0.1613 -0.1613 -0.1613 3.0271 3.0271 3.0271 3.0271 5.3535 5.3535 5.3535 5.3535 6.0599 6.0599 6.0599 6.0599 6.4052 6.4052 6.4052 6.4052 k = 0.5000 0.2887 0.4669 ( 13432 PWs) bands (ev): -15.0072 -15.0072 -15.0072 -15.0072 -13.8939 -13.8939 -13.8939 -13.8939 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8347 -12.8347 -12.8347 -12.8347 -7.6802 -7.6802 -7.6802 -7.6802 -4.3181 -4.3181 -4.3181 -4.3181 -4.1269 -4.1269 -4.1269 -4.1269 -3.7530 -3.7530 -3.7530 -3.7530 -1.9741 -1.9741 -1.9741 -1.9741 -1.9018 -1.9018 -1.9018 -1.9018 -1.7134 -1.7134 -1.7134 -1.7134 -1.3013 -1.3013 -1.3013 -1.3013 -1.0417 -1.0417 -1.0417 -1.0417 -0.9487 -0.9487 -0.9487 -0.9487 -0.8243 -0.8243 -0.8242 -0.8242 -0.4989 -0.4989 -0.4989 -0.4989 -0.4426 -0.4426 -0.4426 -0.4426 -0.3128 -0.3128 -0.3128 -0.3128 -0.1613 -0.1613 -0.1613 -0.1613 3.0271 3.0271 3.0271 3.0271 5.3535 5.3535 5.3535 5.3535 6.0599 6.0599 6.0599 6.0599 6.4052 6.4052 6.4052 6.4052 k = 0.4889 0.3079 0.4669 ( 13420 PWs) bands (ev): -15.0071 -15.0071 -15.0071 -15.0071 -13.8952 -13.8952 -13.8929 -13.8929 -13.7751 -13.7751 -13.7726 -13.7726 -13.4210 -13.4210 -13.4210 -13.4210 -12.8346 -12.8346 -12.8346 -12.8346 -7.6800 -7.6800 -7.6799 -7.6799 -4.3267 -4.3267 -4.3099 -4.3099 -4.1288 -4.1288 -4.1258 -4.1258 -3.7607 -3.7607 -3.7445 -3.7445 -1.9757 -1.9757 -1.9726 -1.9726 -1.9032 -1.9032 -1.8997 -1.8997 -1.7149 -1.7149 -1.7118 -1.7118 -1.3030 -1.3030 -1.2998 -1.2998 -1.0521 -1.0521 -1.0382 -1.0382 -0.9522 -0.9522 -0.9404 -0.9404 -0.8251 -0.8251 -0.8227 -0.8227 -0.5022 -0.5022 -0.4953 -0.4953 -0.4464 -0.4464 -0.4388 -0.4388 -0.3133 -0.3133 -0.3116 -0.3116 -0.1627 -0.1627 -0.1607 -0.1607 3.0281 3.0281 3.0284 3.0284 5.3370 5.3370 5.3704 5.3704 6.0431 6.0431 6.0755 6.0755 6.4035 6.4035 6.4074 6.4074 k = 0.4778 0.3272 0.4669 ( 13428 PWs) bands (ev): -15.0069 -15.0069 -15.0069 -15.0069 -13.8966 -13.8966 -13.8920 -13.8920 -13.7766 -13.7766 -13.7716 -13.7716 -13.4210 -13.4210 -13.4210 -13.4210 -12.8345 -12.8345 -12.8345 -12.8345 -7.6793 -7.6793 -7.6791 -7.6791 -4.3358 -4.3358 -4.3023 -4.3023 -4.1317 -4.1317 -4.1255 -4.1255 -3.7674 -3.7674 -3.7354 -3.7354 -1.9773 -1.9773 -1.9711 -1.9711 -1.9040 -1.9040 -1.8970 -1.8970 -1.7163 -1.7163 -1.7103 -1.7103 -1.3049 -1.3049 -1.2986 -1.2986 -1.0670 -1.0670 -1.0428 -1.0428 -0.9496 -0.9496 -0.9297 -0.9297 -0.8255 -0.8255 -0.8207 -0.8207 -0.5054 -0.5054 -0.4916 -0.4916 -0.4499 -0.4499 -0.4348 -0.4348 -0.3132 -0.3132 -0.3097 -0.3097 -0.1650 -0.1650 -0.1608 -0.1608 3.0314 3.0314 3.0320 3.0320 5.3211 5.3211 5.3879 5.3879 6.0252 6.0252 6.0901 6.0901 6.4022 6.4022 6.4100 6.4100 k = 0.4667 0.3464 0.4669 ( 13444 PWs) bands (ev): -15.0066 -15.0066 -15.0066 -15.0066 -13.8982 -13.8982 -13.8913 -13.8913 -13.7781 -13.7781 -13.7707 -13.7707 -13.4210 -13.4210 -13.4209 -13.4209 -12.8342 -12.8342 -12.8342 -12.8342 -7.6781 -7.6781 -7.6778 -7.6778 -4.3452 -4.3452 -4.2952 -4.2952 -4.1356 -4.1356 -4.1257 -4.1257 -3.7730 -3.7730 -3.7259 -3.7259 -1.9788 -1.9788 -1.9699 -1.9699 -1.9040 -1.9040 -1.8937 -1.8937 -1.7178 -1.7178 -1.7088 -1.7088 -1.3069 -1.3069 -1.2975 -1.2975 -1.0844 -1.0844 -1.0540 -1.0540 -0.9422 -0.9422 -0.9183 -0.9183 -0.8253 -0.8253 -0.8183 -0.8183 -0.5084 -0.5084 -0.4878 -0.4878 -0.4532 -0.4532 -0.4307 -0.4307 -0.3125 -0.3125 -0.3072 -0.3072 -0.1681 -0.1681 -0.1618 -0.1618 3.0369 3.0369 3.0377 3.0377 5.3057 5.3057 5.4057 5.4057 6.0063 6.0063 6.1034 6.1034 6.4015 6.4015 6.4131 6.4131 k = 0.4556 0.3657 0.4669 ( 13440 PWs) bands (ev): -15.0062 -15.0062 -15.0062 -15.0062 -13.8999 -13.8999 -13.8909 -13.8909 -13.7796 -13.7796 -13.7699 -13.7699 -13.4209 -13.4209 -13.4209 -13.4209 -12.8339 -12.8339 -12.8339 -12.8339 -7.6765 -7.6765 -7.6761 -7.6761 -4.3547 -4.3547 -4.2887 -4.2887 -4.1404 -4.1404 -4.1263 -4.1263 -3.7775 -3.7775 -3.7162 -3.7162 -1.9804 -1.9804 -1.9688 -1.9688 -1.9034 -1.9034 -1.8899 -1.8899 -1.7194 -1.7194 -1.7073 -1.7073 -1.3090 -1.3090 -1.2966 -1.2966 -1.1034 -1.1034 -1.0693 -1.0693 -0.9323 -0.9323 -0.9068 -0.9068 -0.8248 -0.8248 -0.8156 -0.8156 -0.5111 -0.5111 -0.4839 -0.4839 -0.4563 -0.4563 -0.4266 -0.4266 -0.3113 -0.3113 -0.3040 -0.3040 -0.1721 -0.1721 -0.1634 -0.1634 3.0442 3.0442 3.0455 3.0455 5.2909 5.2909 5.4240 5.4240 5.9866 5.9866 6.1157 6.1157 6.4013 6.4013 6.4164 6.4164 k = 0.4444 0.3849 0.4669 ( 13448 PWs) bands (ev): -15.0057 -15.0057 -15.0057 -15.0057 -13.9017 -13.9017 -13.8906 -13.8906 -13.7811 -13.7811 -13.7693 -13.7693 -13.4208 -13.4208 -13.4208 -13.4208 -12.8335 -12.8335 -12.8335 -12.8335 -7.6744 -7.6744 -7.6739 -7.6739 -4.3644 -4.3644 -4.2829 -4.2829 -4.1461 -4.1461 -4.1272 -4.1272 -3.7809 -3.7809 -3.7067 -3.7067 -1.9818 -1.9818 -1.9680 -1.9680 -1.9020 -1.9020 -1.8856 -1.8856 -1.7211 -1.7211 -1.7059 -1.7059 -1.3109 -1.3109 -1.2957 -1.2957 -1.1232 -1.1232 -1.0868 -1.0868 -0.9215 -0.9215 -0.8956 -0.8956 -0.8242 -0.8242 -0.8129 -0.8129 -0.5136 -0.5136 -0.4800 -0.4800 -0.4591 -0.4591 -0.4225 -0.4225 -0.3097 -0.3097 -0.3002 -0.3002 -0.1767 -0.1767 -0.1657 -0.1657 3.0532 3.0532 3.0550 3.0550 5.2767 5.2767 5.4426 5.4426 5.9662 5.9662 6.1269 6.1269 6.4016 6.4016 6.4201 6.4201 k = 0.4333 0.4041 0.4669 ( 13456 PWs) bands (ev): -15.0051 -15.0051 -15.0051 -15.0051 -13.9036 -13.9036 -13.8906 -13.8906 -13.7826 -13.7826 -13.7688 -13.7688 -13.4207 -13.4207 -13.4207 -13.4207 -12.8330 -12.8330 -12.8330 -12.8330 -7.6721 -7.6721 -7.6715 -7.6715 -4.3740 -4.3740 -4.2776 -4.2776 -4.1526 -4.1526 -4.1283 -4.1283 -3.7831 -3.7831 -3.6974 -3.6974 -1.9832 -1.9832 -1.9675 -1.9675 -1.8999 -1.8999 -1.8809 -1.8809 -1.7230 -1.7230 -1.7048 -1.7048 -1.3126 -1.3126 -1.2947 -1.2947 -1.1434 -1.1434 -1.1053 -1.1053 -0.9106 -0.9106 -0.8850 -0.8850 -0.8235 -0.8235 -0.8104 -0.8104 -0.5158 -0.5158 -0.4763 -0.4763 -0.4617 -0.4617 -0.4184 -0.4184 -0.3077 -0.3077 -0.2959 -0.2959 -0.1821 -0.1821 -0.1684 -0.1684 3.0634 3.0634 3.0658 3.0658 5.2633 5.2633 5.4613 5.4613 5.9454 5.9454 6.1370 6.1370 6.4024 6.4024 6.4239 6.4239 k = 0.4222 0.4234 0.4669 ( 13452 PWs) bands (ev): -15.0045 -15.0045 -15.0045 -15.0045 -13.9054 -13.9054 -13.8908 -13.8908 -13.7841 -13.7841 -13.7685 -13.7685 -13.4206 -13.4206 -13.4206 -13.4206 -12.8325 -12.8325 -12.8325 -12.8325 -7.6695 -7.6695 -7.6689 -7.6689 -4.3833 -4.3833 -4.2729 -4.2729 -4.1595 -4.1595 -4.1295 -4.1295 -3.7844 -3.7844 -3.6885 -3.6885 -1.9846 -1.9846 -1.9673 -1.9673 -1.8972 -1.8972 -1.8758 -1.8758 -1.7251 -1.7251 -1.7039 -1.7039 -1.3139 -1.3139 -1.2935 -1.2935 -1.1634 -1.1634 -1.1241 -1.1241 -0.8999 -0.8999 -0.8749 -0.8749 -0.8231 -0.8231 -0.8083 -0.8083 -0.5178 -0.5178 -0.4727 -0.4727 -0.4638 -0.4638 -0.4146 -0.4146 -0.3055 -0.3055 -0.2912 -0.2912 -0.1880 -0.1880 -0.1715 -0.1715 3.0745 3.0745 3.0776 3.0776 5.2508 5.2508 5.4801 5.4801 5.9244 5.9244 6.1461 6.1461 6.4035 6.4035 6.4279 6.4279 k = 0.4111 0.4426 0.4669 ( 13460 PWs) bands (ev): -15.0038 -15.0038 -15.0038 -15.0038 -13.9073 -13.9073 -13.8911 -13.8911 -13.7854 -13.7854 -13.7682 -13.7682 -13.4205 -13.4205 -13.4205 -13.4205 -12.8320 -12.8320 -12.8320 -12.8320 -7.6668 -7.6668 -7.6661 -7.6661 -4.3922 -4.3922 -4.2688 -4.2688 -4.1667 -4.1667 -4.1308 -4.1308 -3.7850 -3.7850 -3.6804 -3.6804 -1.9859 -1.9859 -1.9673 -1.9673 -1.8940 -1.8940 -1.8703 -1.8703 -1.7276 -1.7276 -1.7033 -1.7033 -1.3147 -1.3147 -1.2919 -1.2919 -1.1828 -1.1828 -1.1426 -1.1426 -0.8897 -0.8897 -0.8655 -0.8655 -0.8230 -0.8230 -0.8065 -0.8065 -0.5195 -0.5195 -0.4699 -0.4699 -0.4652 -0.4652 -0.4109 -0.4109 -0.3033 -0.3033 -0.2860 -0.2860 -0.1944 -0.1944 -0.1748 -0.1748 3.0859 3.0859 3.0898 3.0898 5.2392 5.2392 5.4987 5.4987 5.9037 5.9037 6.1543 6.1543 6.4050 6.4050 6.4319 6.4319 k = 0.4000 0.4619 0.4669 ( 13464 PWs) bands (ev): -15.0031 -15.0031 -15.0031 -15.0031 -13.9090 -13.9090 -13.8916 -13.8916 -13.7866 -13.7866 -13.7680 -13.7680 -13.4204 -13.4204 -13.4204 -13.4204 -12.8314 -12.8314 -12.8314 -12.8314 -7.6640 -7.6640 -7.6633 -7.6633 -4.4005 -4.4005 -4.2654 -4.2654 -4.1739 -4.1739 -4.1319 -4.1319 -3.7849 -3.7849 -3.6730 -3.6730 -1.9870 -1.9870 -1.9676 -1.9676 -1.8905 -1.8905 -1.8647 -1.8647 -1.7305 -1.7305 -1.7032 -1.7032 -1.3148 -1.3148 -1.2899 -1.2899 -1.2012 -1.2012 -1.1604 -1.1604 -0.8800 -0.8800 -0.8567 -0.8567 -0.8233 -0.8233 -0.8054 -0.8054 -0.5210 -0.5210 -0.4693 -0.4693 -0.4643 -0.4643 -0.4076 -0.4076 -0.3011 -0.3011 -0.2806 -0.2806 -0.2012 -0.2012 -0.1781 -0.1781 3.0973 3.0973 3.1020 3.1020 5.2287 5.2287 5.5168 5.5168 5.8837 5.8837 6.1616 6.1616 6.4067 6.4067 6.4358 6.4358 k = 0.3889 0.4811 0.4669 ( 13432 PWs) bands (ev): -15.0025 -15.0025 -15.0024 -15.0024 -13.9107 -13.9107 -13.8922 -13.8922 -13.7876 -13.7876 -13.7679 -13.7679 -13.4203 -13.4203 -13.4203 -13.4203 -12.8309 -12.8309 -12.8309 -12.8309 -7.6614 -7.6614 -7.6606 -7.6606 -4.4079 -4.4079 -4.2626 -4.2626 -4.1805 -4.1805 -4.1330 -4.1330 -3.7843 -3.7843 -3.6665 -3.6665 -1.9881 -1.9881 -1.9679 -1.9679 -1.8869 -1.8869 -1.8590 -1.8590 -1.7337 -1.7337 -1.7035 -1.7035 -1.3142 -1.3142 -1.2874 -1.2874 -1.2182 -1.2182 -1.1770 -1.1770 -0.8710 -0.8710 -0.8488 -0.8488 -0.8242 -0.8242 -0.8047 -0.8047 -0.5222 -0.5222 -0.4703 -0.4703 -0.4620 -0.4620 -0.4046 -0.4046 -0.2991 -0.2991 -0.2749 -0.2749 -0.2082 -0.2082 -0.1813 -0.1813 3.1082 3.1082 3.1137 3.1137 5.2195 5.2195 5.5339 5.5339 5.8650 5.8650 6.1679 6.1679 6.4086 6.4086 6.4395 6.4395 k = 0.3778 0.5004 0.4669 ( 13430 PWs) bands (ev): -15.0019 -15.0019 -15.0018 -15.0018 -13.9121 -13.9121 -13.8928 -13.8928 -13.7884 -13.7884 -13.7678 -13.7678 -13.4203 -13.4203 -13.4202 -13.4202 -12.8305 -12.8305 -12.8305 -12.8305 -7.6590 -7.6590 -7.6582 -7.6582 -4.4144 -4.4144 -4.2605 -4.2605 -4.1864 -4.1864 -4.1339 -4.1339 -3.7836 -3.7836 -3.6611 -3.6611 -1.9891 -1.9891 -1.9684 -1.9684 -1.8833 -1.8833 -1.8535 -1.8535 -1.7371 -1.7371 -1.7042 -1.7042 -1.3128 -1.3128 -1.2845 -1.2845 -1.2334 -1.2334 -1.1920 -1.1920 -0.8627 -0.8627 -0.8417 -0.8417 -0.8255 -0.8255 -0.8046 -0.8046 -0.5232 -0.5232 -0.4713 -0.4713 -0.4596 -0.4596 -0.4020 -0.4020 -0.2973 -0.2973 -0.2691 -0.2691 -0.2153 -0.2153 -0.1841 -0.1841 3.1180 3.1180 3.1243 3.1243 5.2116 5.2116 5.5494 5.5494 5.8482 5.8482 6.1733 6.1733 6.4104 6.4104 6.4428 6.4428 k = 0.3667 0.5196 0.4669 ( 13432 PWs) bands (ev): -15.0014 -15.0014 -15.0013 -15.0013 -13.9134 -13.9134 -13.8934 -13.8934 -13.7890 -13.7890 -13.7678 -13.7678 -13.4202 -13.4202 -13.4201 -13.4201 -12.8301 -12.8301 -12.8300 -12.8300 -7.6569 -7.6569 -7.6560 -7.6560 -4.4197 -4.4197 -4.2592 -4.2592 -4.1912 -4.1912 -4.1347 -4.1347 -3.7827 -3.7827 -3.6568 -3.6568 -1.9898 -1.9898 -1.9689 -1.9689 -1.8801 -1.8801 -1.8485 -1.8485 -1.7406 -1.7406 -1.7051 -1.7051 -1.3107 -1.3107 -1.2811 -1.2811 -1.2465 -1.2465 -1.2049 -1.2049 -0.8552 -0.8552 -0.8358 -0.8358 -0.8275 -0.8275 -0.8049 -0.8049 -0.5239 -0.5239 -0.4721 -0.4721 -0.4577 -0.4577 -0.3999 -0.3999 -0.2960 -0.2960 -0.2632 -0.2632 -0.2224 -0.2224 -0.1865 -0.1865 3.1264 3.1264 3.1333 3.1333 5.2054 5.2054 5.5625 5.5625 5.8341 5.8341 6.1777 6.1777 6.4121 6.4121 6.4456 6.4456 k = 0.3556 0.5389 0.4669 ( 13440 PWs) bands (ev): -15.0010 -15.0010 -15.0009 -15.0009 -13.9143 -13.9143 -13.8939 -13.8939 -13.7895 -13.7895 -13.7678 -13.7678 -13.4202 -13.4202 -13.4201 -13.4201 -12.8297 -12.8297 -12.8297 -12.8297 -7.6552 -7.6552 -7.6544 -7.6544 -4.4237 -4.4237 -4.2585 -4.2585 -4.1947 -4.1947 -4.1353 -4.1353 -3.7820 -3.7820 -3.6536 -3.6536 -1.9904 -1.9904 -1.9693 -1.9693 -1.8775 -1.8775 -1.8443 -1.8443 -1.7437 -1.7437 -1.7062 -1.7062 -1.3082 -1.3082 -1.2778 -1.2778 -1.2569 -1.2569 -1.2151 -1.2151 -0.8488 -0.8488 -0.8311 -0.8311 -0.8300 -0.8300 -0.8054 -0.8054 -0.5244 -0.5244 -0.4727 -0.4727 -0.4562 -0.4562 -0.3984 -0.3984 -0.2950 -0.2950 -0.2574 -0.2574 -0.2292 -0.2292 -0.1883 -0.1883 3.1328 3.1328 3.1403 3.1403 5.2008 5.2008 5.5726 5.5726 5.8235 5.8235 6.1810 6.1810 6.4136 6.4136 6.4478 6.4478 k = 0.3444 0.5581 0.4669 ( 13444 PWs) bands (ev): -15.0007 -15.0007 -15.0007 -15.0007 -13.9149 -13.9149 -13.8943 -13.8943 -13.7897 -13.7897 -13.7678 -13.7678 -13.4201 -13.4201 -13.4201 -13.4201 -12.8295 -12.8295 -12.8295 -12.8295 -7.6542 -7.6542 -7.6533 -7.6533 -4.4262 -4.4262 -4.2582 -4.2582 -4.1968 -4.1968 -4.1356 -4.1356 -3.7814 -3.7814 -3.6518 -3.6518 -1.9908 -1.9908 -1.9696 -1.9696 -1.8757 -1.8757 -1.8414 -1.8414 -1.7460 -1.7460 -1.7070 -1.7070 -1.3061 -1.3061 -1.2752 -1.2752 -1.2639 -1.2639 -1.2219 -1.2219 -0.8435 -0.8435 -0.8328 -0.8328 -0.8282 -0.8282 -0.8059 -0.8059 -0.5246 -0.5246 -0.4730 -0.4730 -0.4553 -0.4553 -0.3975 -0.3975 -0.2945 -0.2945 -0.2521 -0.2521 -0.2352 -0.2352 -0.1894 -0.1894 3.1368 3.1368 3.1447 3.1447 5.1980 5.1980 5.5788 5.5788 5.8171 5.8171 6.1831 6.1831 6.4145 6.4145 6.4492 6.4492 k = 0.3333 0.5774 0.4669 ( 13440 PWs) bands (ev): -15.0006 -15.0006 -15.0006 -15.0006 -13.9151 -13.9151 -13.8944 -13.8944 -13.7898 -13.7898 -13.7678 -13.7678 -13.4201 -13.4201 -13.4201 -13.4201 -12.8295 -12.8295 -12.8295 -12.8295 -7.6538 -7.6538 -7.6529 -7.6529 -4.4270 -4.4270 -4.2582 -4.2582 -4.1975 -4.1975 -4.1358 -4.1358 -3.7813 -3.7813 -3.6511 -3.6511 -1.9910 -1.9910 -1.9697 -1.9697 -1.8751 -1.8751 -1.8403 -1.8403 -1.7469 -1.7469 -1.7074 -1.7074 -1.3052 -1.3052 -1.2742 -1.2742 -1.2663 -1.2663 -1.2243 -1.2243 -0.8409 -0.8409 -0.8347 -0.8347 -0.8271 -0.8271 -0.8061 -0.8061 -0.5247 -0.5247 -0.4731 -0.4731 -0.4550 -0.4550 -0.3971 -0.3971 -0.2944 -0.2944 -0.2492 -0.2492 -0.2383 -0.2383 -0.1898 -0.1898 3.1383 3.1383 3.1462 3.1462 5.1970 5.1970 5.5808 5.5808 5.8150 5.8150 6.1839 6.1839 6.4149 6.4149 6.4497 6.4497 k = 0.3333 0.5774 0.4669 ( 13440 PWs) bands (ev): -15.0006 -15.0006 -15.0006 -15.0006 -13.9151 -13.9151 -13.8944 -13.8944 -13.7898 -13.7898 -13.7678 -13.7678 -13.4201 -13.4201 -13.4201 -13.4201 -12.8295 -12.8295 -12.8295 -12.8295 -7.6538 -7.6538 -7.6529 -7.6529 -4.4270 -4.4270 -4.2582 -4.2582 -4.1975 -4.1975 -4.1358 -4.1358 -3.7813 -3.7813 -3.6511 -3.6511 -1.9910 -1.9910 -1.9697 -1.9697 -1.8751 -1.8751 -1.8403 -1.8403 -1.7469 -1.7469 -1.7074 -1.7074 -1.3052 -1.3052 -1.2742 -1.2742 -1.2663 -1.2663 -1.2243 -1.2243 -0.8409 -0.8409 -0.8347 -0.8347 -0.8271 -0.8271 -0.8061 -0.8061 -0.5247 -0.5247 -0.4731 -0.4731 -0.4550 -0.4550 -0.3971 -0.3971 -0.2944 -0.2944 -0.2492 -0.2492 -0.2383 -0.2383 -0.1898 -0.1898 3.1383 3.1383 3.1462 3.1462 5.1970 5.1970 5.5808 5.5808 5.8150 5.8150 6.1839 6.1839 6.4149 6.4149 6.4497 6.4497 k = 0.3218 0.5574 0.4669 ( 13442 PWs) bands (ev): -15.0007 -15.0007 -15.0007 -15.0007 -13.9149 -13.9149 -13.8943 -13.8943 -13.7897 -13.7897 -13.7678 -13.7678 -13.4201 -13.4201 -13.4201 -13.4201 -12.8295 -12.8295 -12.8295 -12.8295 -7.6542 -7.6542 -7.6534 -7.6534 -4.4261 -4.4261 -4.2581 -4.2581 -4.1968 -4.1968 -4.1356 -4.1356 -3.7815 -3.7815 -3.6518 -3.6518 -1.9908 -1.9908 -1.9696 -1.9696 -1.8758 -1.8758 -1.8416 -1.8416 -1.7458 -1.7458 -1.7069 -1.7069 -1.3060 -1.3060 -1.2752 -1.2752 -1.2638 -1.2638 -1.2219 -1.2219 -0.8435 -0.8435 -0.8329 -0.8329 -0.8282 -0.8282 -0.8060 -0.8060 -0.5247 -0.5247 -0.4730 -0.4730 -0.4554 -0.4554 -0.3975 -0.3975 -0.2945 -0.2945 -0.2520 -0.2520 -0.2352 -0.2352 -0.1894 -0.1894 3.1366 3.1366 3.1445 3.1445 5.1980 5.1980 5.5788 5.5788 5.8170 5.8170 6.1830 6.1830 6.4144 6.4144 6.4492 6.4492 k = 0.3103 0.5375 0.4669 ( 13446 PWs) bands (ev): -15.0011 -15.0011 -15.0010 -15.0010 -13.9141 -13.9141 -13.8937 -13.8937 -13.7895 -13.7895 -13.7678 -13.7678 -13.4202 -13.4202 -13.4201 -13.4201 -12.8298 -12.8298 -12.8298 -12.8298 -7.6556 -7.6556 -7.6548 -7.6548 -4.4232 -4.4232 -4.2576 -4.2576 -4.1949 -4.1949 -4.1352 -4.1352 -3.7822 -3.7822 -3.6538 -3.6538 -1.9903 -1.9903 -1.9691 -1.9691 -1.8780 -1.8780 -1.8452 -1.8452 -1.7425 -1.7425 -1.7052 -1.7052 -1.3079 -1.3079 -1.2775 -1.2775 -1.2572 -1.2572 -1.2153 -1.2153 -0.8485 -0.8485 -0.8310 -0.8310 -0.8306 -0.8306 -0.8058 -0.8058 -0.5245 -0.5245 -0.4728 -0.4728 -0.4564 -0.4564 -0.3986 -0.3986 -0.2947 -0.2947 -0.2567 -0.2567 -0.2296 -0.2296 -0.1883 -0.1883 3.1317 3.1317 3.1391 3.1391 5.2010 5.2010 5.5734 5.5734 5.8222 5.8222 6.1803 6.1803 6.4130 6.4130 6.4473 6.4473 k = 0.2989 0.5176 0.4669 ( 13442 PWs) bands (ev): -15.0016 -15.0016 -15.0016 -15.0016 -13.9128 -13.9128 -13.8927 -13.8927 -13.7891 -13.7891 -13.7677 -13.7677 -13.4202 -13.4202 -13.4201 -13.4201 -12.8303 -12.8303 -12.8303 -12.8303 -7.6580 -7.6580 -7.6572 -7.6572 -4.4183 -4.4183 -4.2565 -4.2565 -4.1918 -4.1918 -4.1344 -4.1344 -3.7835 -3.7835 -3.6571 -3.6571 -1.9895 -1.9895 -1.9684 -1.9684 -1.8817 -1.8817 -1.8509 -1.8509 -1.7370 -1.7370 -1.7022 -1.7022 -1.3097 -1.3097 -1.2801 -1.2801 -1.2478 -1.2478 -1.2058 -1.2058 -0.8544 -0.8544 -0.8352 -0.8352 -0.8292 -0.8292 -0.8061 -0.8061 -0.5243 -0.5243 -0.4724 -0.4724 -0.4581 -0.4581 -0.4003 -0.4003 -0.2949 -0.2949 -0.2611 -0.2611 -0.2235 -0.2235 -0.1866 -0.1866 3.1233 3.1233 3.1301 3.1301 5.2059 5.2059 5.5655 5.5655 5.8293 5.8293 6.1755 6.1755 6.4105 6.4105 6.4440 6.4440 k = 0.2874 0.4977 0.4669 ( 13452 PWs) bands (ev): -15.0025 -15.0025 -15.0025 -15.0025 -13.9108 -13.9108 -13.8912 -13.8912 -13.7886 -13.7886 -13.7677 -13.7677 -13.4202 -13.4202 -13.4202 -13.4202 -12.8309 -12.8309 -12.8309 -12.8309 -7.6615 -7.6615 -7.6606 -7.6606 -4.4115 -4.4115 -4.2545 -4.2545 -4.1875 -4.1875 -4.1333 -4.1333 -3.7854 -3.7854 -3.6616 -3.6616 -1.9884 -1.9884 -1.9672 -1.9672 -1.8867 -1.8867 -1.8581 -1.8581 -1.7297 -1.7297 -1.6977 -1.6977 -1.3109 -1.3109 -1.2823 -1.2823 -1.2364 -1.2364 -1.1943 -1.1943 -0.8611 -0.8611 -0.8404 -0.8404 -0.8287 -0.8287 -0.8071 -0.8071 -0.5241 -0.5241 -0.4721 -0.4721 -0.4604 -0.4604 -0.4028 -0.4028 -0.2948 -0.2948 -0.2647 -0.2647 -0.2172 -0.2172 -0.1843 -0.1843 3.1113 3.1113 3.1173 3.1173 5.2124 5.2124 5.5561 5.5561 5.8370 5.8370 6.1683 6.1683 6.4068 6.4068 6.4393 6.4393 k = 0.2759 0.4778 0.4669 ( 13456 PWs) bands (ev): -15.0037 -15.0037 -15.0036 -15.0036 -13.9083 -13.9083 -13.8891 -13.8891 -13.7881 -13.7881 -13.7677 -13.7677 -13.4203 -13.4203 -13.4202 -13.4202 -12.8318 -12.8318 -12.8318 -12.8318 -7.6660 -7.6660 -7.6652 -7.6652 -4.4026 -4.4026 -4.2519 -4.2519 -4.1821 -4.1821 -4.1317 -4.1317 -3.7879 -3.7879 -3.6673 -3.6673 -1.9869 -1.9869 -1.9658 -1.9658 -1.8927 -1.8927 -1.8663 -1.8663 -1.7209 -1.7209 -1.6917 -1.6917 -1.3113 -1.3113 -1.2839 -1.2839 -1.2237 -1.2237 -1.1813 -1.1813 -0.8685 -0.8685 -0.8466 -0.8466 -0.8294 -0.8294 -0.8089 -0.8089 -0.5240 -0.5240 -0.4719 -0.4719 -0.4633 -0.4633 -0.4059 -0.4059 -0.2942 -0.2942 -0.2674 -0.2674 -0.2110 -0.2110 -0.1815 -0.1815 3.0959 3.0959 3.1009 3.1009 5.2205 5.2205 5.5459 5.5459 5.8443 5.8443 6.1587 6.1587 6.4017 6.4017 6.4330 6.4330 k = 0.2644 0.4579 0.4669 ( 13450 PWs) bands (ev): -15.0051 -15.0051 -15.0050 -15.0050 -13.9051 -13.9051 -13.8865 -13.8865 -13.7874 -13.7874 -13.7677 -13.7677 -13.4204 -13.4204 -13.4203 -13.4203 -12.8330 -12.8330 -12.8329 -12.8329 -7.6717 -7.6717 -7.6710 -7.6710 -4.3920 -4.3920 -4.2487 -4.2487 -4.1752 -4.1752 -4.1297 -4.1297 -3.7908 -3.7908 -3.6741 -3.6741 -1.9851 -1.9851 -1.9640 -1.9640 -1.8993 -1.8993 -1.8749 -1.8749 -1.7108 -1.7108 -1.6844 -1.6844 -1.3109 -1.3109 -1.2847 -1.2847 -1.2099 -1.2099 -1.1672 -1.1672 -0.8766 -0.8766 -0.8535 -0.8535 -0.8310 -0.8310 -0.8116 -0.8116 -0.5241 -0.5241 -0.4722 -0.4722 -0.4665 -0.4665 -0.4097 -0.4097 -0.2930 -0.2930 -0.2691 -0.2691 -0.2048 -0.2048 -0.1784 -0.1784 3.0771 3.0771 3.0811 3.0811 5.2299 5.2299 5.5355 5.5355 5.8504 5.8504 6.1464 6.1464 6.3953 6.3953 6.4251 6.4251 k = 0.2529 0.4380 0.4669 ( 13438 PWs) bands (ev): -15.0068 -15.0068 -15.0067 -15.0067 -13.9012 -13.9012 -13.8833 -13.8833 -13.7867 -13.7867 -13.7677 -13.7677 -13.4204 -13.4204 -13.4204 -13.4204 -12.8343 -12.8343 -12.8343 -12.8343 -7.6785 -7.6785 -7.6778 -7.6778 -4.3796 -4.3796 -4.2450 -4.2450 -4.1668 -4.1668 -4.1271 -4.1271 -3.7943 -3.7943 -3.6818 -3.6818 -1.9830 -1.9830 -1.9619 -1.9619 -1.9062 -1.9062 -1.8835 -1.8835 -1.6997 -1.6997 -1.6757 -1.6757 -1.3097 -1.3097 -1.2849 -1.2849 -1.1954 -1.1954 -1.1524 -1.1524 -0.8854 -0.8854 -0.8612 -0.8612 -0.8337 -0.8337 -0.8152 -0.8152 -0.5244 -0.5244 -0.4738 -0.4738 -0.4690 -0.4690 -0.4140 -0.4140 -0.2911 -0.2911 -0.2696 -0.2696 -0.1986 -0.1986 -0.1751 -0.1751 3.0552 3.0552 3.0580 3.0580 5.2403 5.2403 5.5251 5.5251 5.8546 5.8546 6.1313 6.1313 6.3876 6.3876 6.4157 6.4157 k = 0.2414 0.4181 0.4669 ( 13444 PWs) bands (ev): -15.0087 -15.0087 -15.0087 -15.0087 -13.8967 -13.8967 -13.8795 -13.8795 -13.7859 -13.7859 -13.7677 -13.7677 -13.4205 -13.4205 -13.4204 -13.4204 -12.8359 -12.8359 -12.8359 -12.8359 -7.6864 -7.6864 -7.6857 -7.6857 -4.3658 -4.3658 -4.2412 -4.2412 -4.1568 -4.1568 -4.1239 -4.1239 -3.7983 -3.7983 -3.6903 -3.6903 -1.9807 -1.9807 -1.9597 -1.9597 -1.9130 -1.9130 -1.8918 -1.8918 -1.6876 -1.6876 -1.6659 -1.6659 -1.3079 -1.3079 -1.2845 -1.2845 -1.1803 -1.1803 -1.1369 -1.1369 -0.8950 -0.8950 -0.8696 -0.8696 -0.8373 -0.8373 -0.8196 -0.8196 -0.5250 -0.5250 -0.4778 -0.4778 -0.4702 -0.4702 -0.4189 -0.4189 -0.2883 -0.2883 -0.2689 -0.2689 -0.1926 -0.1926 -0.1715 -0.1715 3.0303 3.0303 3.0320 3.0320 5.2514 5.2514 5.5149 5.5149 5.8565 5.8565 6.1133 6.1133 6.3786 6.3786 6.4048 6.4048 k = 0.2299 0.3982 0.4669 ( 13436 PWs) bands (ev): -15.0109 -15.0109 -15.0109 -15.0109 -13.8917 -13.8917 -13.8752 -13.8752 -13.7851 -13.7851 -13.7677 -13.7677 -13.4205 -13.4205 -13.4205 -13.4205 -12.8377 -12.8377 -12.8377 -12.8377 -7.6952 -7.6952 -7.6946 -7.6946 -4.3508 -4.3508 -4.2373 -4.2373 -4.1450 -4.1450 -4.1198 -4.1198 -3.8026 -3.8026 -3.6996 -3.6996 -1.9783 -1.9783 -1.9575 -1.9575 -1.9194 -1.9194 -1.8995 -1.8995 -1.6746 -1.6746 -1.6548 -1.6548 -1.3056 -1.3056 -1.2835 -1.2835 -1.1651 -1.1651 -1.1212 -1.1212 -0.9051 -0.9051 -0.8785 -0.8785 -0.8419 -0.8419 -0.8250 -0.8250 -0.5260 -0.5260 -0.4828 -0.4828 -0.4710 -0.4710 -0.4243 -0.4243 -0.2845 -0.2845 -0.2671 -0.2671 -0.1867 -0.1867 -0.1678 -0.1678 3.0028 3.0028 3.0035 3.0035 5.2629 5.2629 5.5049 5.5049 5.8559 5.8559 6.0926 6.0926 6.3684 6.3684 6.3925 6.3925 k = 0.2184 0.3783 0.4669 ( 13428 PWs) bands (ev): -15.0134 -15.0134 -15.0134 -15.0134 -13.8860 -13.8860 -13.8703 -13.8703 -13.7843 -13.7843 -13.7677 -13.7677 -13.4206 -13.4206 -13.4205 -13.4205 -12.8397 -12.8397 -12.8397 -12.8397 -7.7050 -7.7050 -7.7044 -7.7044 -4.3350 -4.3350 -4.2337 -4.2337 -4.1315 -4.1315 -4.1148 -4.1148 -3.8072 -3.8072 -3.7094 -3.7094 -1.9758 -1.9758 -1.9556 -1.9556 -1.9247 -1.9247 -1.9063 -1.9063 -1.6607 -1.6607 -1.6427 -1.6427 -1.3028 -1.3028 -1.2821 -1.2821 -1.1500 -1.1500 -1.1055 -1.1055 -0.9156 -0.9156 -0.8879 -0.8879 -0.8473 -0.8473 -0.8311 -0.8311 -0.5274 -0.5274 -0.4885 -0.4885 -0.4719 -0.4719 -0.4300 -0.4300 -0.2798 -0.2798 -0.2641 -0.2641 -0.1810 -0.1810 -0.1640 -0.1640 2.9728 2.9728 2.9729 2.9729 5.2746 5.2746 5.4952 5.4952 5.8527 5.8527 6.0691 6.0691 6.3571 6.3571 6.3790 6.3790 k = 0.2069 0.3584 0.4669 ( 13440 PWs) bands (ev): -15.0160 -15.0160 -15.0160 -15.0160 -13.8799 -13.8799 -13.8649 -13.8649 -13.7834 -13.7834 -13.7677 -13.7677 -13.4206 -13.4206 -13.4206 -13.4206 -12.8420 -12.8420 -12.8419 -12.8419 -7.7155 -7.7155 -7.7150 -7.7150 -4.3189 -4.3189 -4.2303 -4.2303 -4.1165 -4.1165 -4.1085 -4.1085 -3.8120 -3.8120 -3.7196 -3.7196 -1.9734 -1.9734 -1.9545 -1.9545 -1.9285 -1.9285 -1.9120 -1.9120 -1.6459 -1.6459 -1.6295 -1.6295 -1.2998 -1.2998 -1.2804 -1.2804 -1.1353 -1.1353 -1.0903 -1.0903 -0.9264 -0.9264 -0.8975 -0.8975 -0.8537 -0.8537 -0.8380 -0.8380 -0.5292 -0.5292 -0.4947 -0.4947 -0.4732 -0.4732 -0.4361 -0.4361 -0.2742 -0.2742 -0.2600 -0.2600 -0.1753 -0.1753 -0.1602 -0.1602 2.9404 2.9404 2.9412 2.9412 5.2862 5.2862 5.4856 5.4856 5.8470 5.8470 6.0432 6.0432 6.3449 6.3449 6.3645 6.3645 k = 0.1954 0.3384 0.4669 ( 13444 PWs) bands (ev): -15.0188 -15.0188 -15.0188 -15.0188 -13.8732 -13.8732 -13.8591 -13.8591 -13.7826 -13.7826 -13.7677 -13.7677 -13.4207 -13.4207 -13.4206 -13.4206 -12.8444 -12.8444 -12.8443 -12.8443 -7.7267 -7.7267 -7.7262 -7.7262 -4.3028 -4.3028 -4.2272 -4.2272 -4.1009 -4.1009 -4.1000 -4.1000 -3.8170 -3.8170 -3.7301 -3.7301 -1.9712 -1.9712 -1.9545 -1.9545 -1.9303 -1.9303 -1.9165 -1.9165 -1.6301 -1.6301 -1.6153 -1.6153 -1.2965 -1.2965 -1.2785 -1.2785 -1.1217 -1.1217 -1.0762 -1.0762 -0.9368 -0.9368 -0.9070 -0.9070 -0.8608 -0.8608 -0.8457 -0.8457 -0.5314 -0.5314 -0.5012 -0.5012 -0.4749 -0.4749 -0.4426 -0.4426 -0.2676 -0.2676 -0.2548 -0.2548 -0.1699 -0.1699 -0.1564 -0.1564 2.9065 2.9065 2.9080 2.9080 5.2974 5.2974 5.4760 5.4760 5.8389 5.8389 6.0150 6.0150 6.3320 6.3320 6.3492 6.3492 k = 0.1839 0.3185 0.4669 ( 13452 PWs) bands (ev): -15.0218 -15.0218 -15.0218 -15.0218 -13.8662 -13.8662 -13.8529 -13.8529 -13.7817 -13.7817 -13.7677 -13.7677 -13.4207 -13.4207 -13.4207 -13.4207 -12.8470 -12.8470 -12.8469 -12.8469 -7.7385 -7.7385 -7.7380 -7.7380 -4.2873 -4.2873 -4.2244 -4.2244 -4.0917 -4.0917 -4.0825 -4.0825 -3.8219 -3.8219 -3.7408 -3.7408 -1.9692 -1.9692 -1.9557 -1.9557 -1.9299 -1.9299 -1.9196 -1.9196 -1.6135 -1.6135 -1.6000 -1.6000 -1.2931 -1.2931 -1.2765 -1.2765 -1.1096 -1.1096 -1.0643 -1.0643 -0.9458 -0.9458 -0.9158 -0.9158 -0.8687 -0.8687 -0.8539 -0.8539 -0.5340 -0.5340 -0.5080 -0.5080 -0.4770 -0.4770 -0.4492 -0.4492 -0.2602 -0.2602 -0.2487 -0.2487 -0.1646 -0.1646 -0.1526 -0.1526 2.8718 2.8718 2.8736 2.8736 5.3081 5.3081 5.4664 5.4664 5.8287 5.8287 5.9852 5.9852 6.3185 6.3185 6.3334 6.3334 k = 0.1724 0.2986 0.4669 ( 13454 PWs) bands (ev): -15.0248 -15.0248 -15.0248 -15.0248 -13.8589 -13.8589 -13.8465 -13.8465 -13.7808 -13.7808 -13.7678 -13.7678 -13.4207 -13.4207 -13.4207 -13.4207 -12.8497 -12.8497 -12.8497 -12.8497 -7.7506 -7.7506 -7.7502 -7.7502 -4.2729 -4.2729 -4.2218 -4.2218 -4.0808 -4.0808 -4.0643 -4.0643 -3.8266 -3.8266 -3.7514 -3.7514 -1.9675 -1.9675 -1.9573 -1.9573 -1.9281 -1.9281 -1.9212 -1.9212 -1.5960 -1.5960 -1.5837 -1.5837 -1.2897 -1.2897 -1.2743 -1.2743 -1.1000 -1.1000 -1.0564 -1.0564 -0.9519 -0.9519 -0.9235 -0.9235 -0.8774 -0.8774 -0.8626 -0.8626 -0.5371 -0.5371 -0.5150 -0.5150 -0.4796 -0.4796 -0.4560 -0.4560 -0.2521 -0.2521 -0.2418 -0.2418 -0.1594 -0.1594 -0.1488 -0.1488 2.8365 2.8365 2.8386 2.8386 5.3179 5.3179 5.4565 5.4565 5.8168 5.8168 5.9540 5.9540 6.3047 6.3047 6.3173 6.3173 k = 0.1609 0.2787 0.4669 ( 13462 PWs) bands (ev): -15.0279 -15.0279 -15.0279 -15.0279 -13.8514 -13.8514 -13.8399 -13.8399 -13.7799 -13.7799 -13.7678 -13.7678 -13.4208 -13.4208 -13.4207 -13.4207 -12.8525 -12.8525 -12.8525 -12.8525 -7.7630 -7.7630 -7.7626 -7.7626 -4.2600 -4.2600 -4.2195 -4.2195 -4.0680 -4.0680 -4.0456 -4.0456 -3.8311 -3.8311 -3.7619 -3.7619 -1.9660 -1.9660 -1.9589 -1.9589 -1.9254 -1.9254 -1.9216 -1.9216 -1.5775 -1.5775 -1.5664 -1.5664 -1.2862 -1.2862 -1.2722 -1.2722 -1.0938 -1.0938 -1.0543 -1.0543 -0.9532 -0.9532 -0.9292 -0.9292 -0.8867 -0.8867 -0.8715 -0.8715 -0.5406 -0.5406 -0.5221 -0.5221 -0.4826 -0.4826 -0.4629 -0.4629 -0.2433 -0.2433 -0.2342 -0.2342 -0.1544 -0.1544 -0.1451 -0.1451 2.8011 2.8011 2.8032 2.8032 5.3267 5.3267 5.4464 5.4464 5.8035 5.8035 5.9222 5.9222 6.2907 6.2907 6.3012 6.3012 k = 0.1494 0.2588 0.4669 ( 13462 PWs) bands (ev): -15.0311 -15.0311 -15.0311 -15.0311 -13.8438 -13.8438 -13.8331 -13.8331 -13.7789 -13.7789 -13.7679 -13.7679 -13.4208 -13.4208 -13.4207 -13.4207 -12.8555 -12.8555 -12.8554 -12.8554 -7.7754 -7.7754 -7.7751 -7.7751 -4.2487 -4.2487 -4.2174 -4.2174 -4.0536 -4.0536 -4.0270 -4.0270 -3.8352 -3.8352 -3.7721 -3.7721 -1.9645 -1.9645 -1.9598 -1.9598 -1.9223 -1.9223 -1.9208 -1.9208 -1.5583 -1.5583 -1.5483 -1.5483 -1.2829 -1.2829 -1.2701 -1.2701 -1.0918 -1.0918 -1.0589 -1.0589 -0.9491 -0.9491 -0.9326 -0.9326 -0.8963 -0.8963 -0.8801 -0.8801 -0.5444 -0.5444 -0.5292 -0.5292 -0.4860 -0.4860 -0.4699 -0.4699 -0.2342 -0.2342 -0.2262 -0.2262 -0.1495 -0.1495 -0.1414 -0.1414 2.7659 2.7659 2.7681 2.7681 5.3343 5.3343 5.4360 5.4360 5.7895 5.7895 5.8903 5.8903 6.2767 6.2767 6.2852 6.2852 k = 0.1379 0.2389 0.4669 ( 13458 PWs) bands (ev): -15.0342 -15.0342 -15.0342 -15.0342 -13.8361 -13.8361 -13.8264 -13.8264 -13.7780 -13.7780 -13.7679 -13.7679 -13.4208 -13.4208 -13.4208 -13.4208 -12.8584 -12.8584 -12.8584 -12.8584 -7.7877 -7.7877 -7.7874 -7.7874 -4.2391 -4.2391 -4.2155 -4.2155 -4.0379 -4.0379 -4.0089 -4.0089 -3.8386 -3.8386 -3.7819 -3.7819 -1.9629 -1.9629 -1.9600 -1.9600 -1.9191 -1.9191 -1.9191 -1.9191 -1.5383 -1.5383 -1.5293 -1.5293 -1.2796 -1.2796 -1.2681 -1.2681 -1.0945 -1.0945 -1.0690 -1.0690 -0.9414 -0.9414 -0.9343 -0.9343 -0.9056 -0.9056 -0.8872 -0.8872 -0.5486 -0.5486 -0.5364 -0.5364 -0.4897 -0.4897 -0.4768 -0.4768 -0.2249 -0.2249 -0.2179 -0.2179 -0.1447 -0.1447 -0.1378 -0.1378 2.7315 2.7315 2.7335 2.7335 5.3406 5.3406 5.4252 5.4252 5.7750 5.7750 5.8589 5.8589 6.2629 6.2629 6.2697 6.2697 k = 0.1264 0.2190 0.4669 ( 13434 PWs) bands (ev): -15.0372 -15.0372 -15.0372 -15.0372 -13.8286 -13.8286 -13.8199 -13.8199 -13.7769 -13.7769 -13.7679 -13.7679 -13.4208 -13.4208 -13.4208 -13.4208 -12.8614 -12.8614 -12.8614 -12.8614 -7.7997 -7.7997 -7.7995 -7.7995 -4.2312 -4.2312 -4.2137 -4.2137 -4.0212 -4.0212 -3.9916 -3.9916 -3.8414 -3.8414 -3.7911 -3.7911 -1.9610 -1.9610 -1.9595 -1.9595 -1.9168 -1.9168 -1.9157 -1.9157 -1.5175 -1.5175 -1.5096 -1.5096 -1.2765 -1.2765 -1.2662 -1.2662 -1.1015 -1.1015 -1.0828 -1.0828 -0.9367 -0.9367 -0.9351 -0.9351 -0.9113 -0.9113 -0.8910 -0.8910 -0.5530 -0.5530 -0.5434 -0.5434 -0.4937 -0.4937 -0.4837 -0.4837 -0.2155 -0.2155 -0.2097 -0.2097 -0.1400 -0.1400 -0.1342 -0.1342 2.6981 2.6981 2.6999 2.6999 5.3454 5.3454 5.4140 5.4140 5.7606 5.7606 5.8287 5.8287 6.2495 6.2495 6.2547 6.2547 k = 0.1149 0.1991 0.4669 ( 13432 PWs) bands (ev): -15.0401 -15.0401 -15.0401 -15.0401 -13.8213 -13.8213 -13.8136 -13.8136 -13.7758 -13.7758 -13.7679 -13.7679 -13.4208 -13.4208 -13.4208 -13.4208 -12.8643 -12.8643 -12.8643 -12.8643 -7.8113 -7.8113 -7.8111 -7.8111 -4.2248 -4.2248 -4.2122 -4.2122 -4.0042 -4.0042 -3.9756 -3.9756 -3.8431 -3.8431 -3.7995 -3.7995 -1.9587 -1.9587 -1.9581 -1.9581 -1.9140 -1.9140 -1.9123 -1.9123 -1.4963 -1.4963 -1.4893 -1.4893 -1.2736 -1.2736 -1.2644 -1.2644 -1.1119 -1.1119 -1.0988 -1.0988 -0.9421 -0.9421 -0.9390 -0.9390 -0.9061 -0.9061 -0.8896 -0.8896 -0.5576 -0.5576 -0.5503 -0.5503 -0.4980 -0.4980 -0.4903 -0.4903 -0.2064 -0.2064 -0.2016 -0.2016 -0.1354 -0.1354 -0.1307 -0.1307 2.6662 2.6662 2.6677 2.6677 5.3486 5.3486 5.4026 5.4026 5.7466 5.7466 5.8003 5.8003 6.2365 6.2365 6.2405 6.2405 k = 0.1034 0.1792 0.4669 ( 13418 PWs) bands (ev): -15.0429 -15.0429 -15.0429 -15.0429 -13.8144 -13.8144 -13.8078 -13.8078 -13.7746 -13.7746 -13.7678 -13.7678 -13.4208 -13.4208 -13.4208 -13.4208 -12.8671 -12.8671 -12.8671 -12.8671 -7.8223 -7.8223 -7.8222 -7.8222 -4.2196 -4.2196 -4.2108 -4.2108 -3.9875 -3.9875 -3.9614 -3.9614 -3.8438 -3.8438 -3.8070 -3.8070 -1.9561 -1.9561 -1.9560 -1.9560 -1.9108 -1.9108 -1.9090 -1.9090 -1.4746 -1.4746 -1.4685 -1.4685 -1.2709 -1.2709 -1.2629 -1.2629 -1.1249 -1.1249 -1.1159 -1.1159 -0.9509 -0.9509 -0.9493 -0.9493 -0.8944 -0.8944 -0.8834 -0.8834 -0.5623 -0.5623 -0.5570 -0.5570 -0.5024 -0.5024 -0.4968 -0.4968 -0.1978 -0.1978 -0.1939 -0.1939 -0.1309 -0.1309 -0.1271 -0.1271 2.6360 2.6360 2.6373 2.6373 5.3501 5.3501 5.3912 5.3912 5.7334 5.7334 5.7743 5.7743 6.2243 6.2243 6.2271 6.2271 k = 0.0920 0.1593 0.4669 ( 13422 PWs) bands (ev): -15.0455 -15.0455 -15.0455 -15.0455 -13.8080 -13.8080 -13.8025 -13.8025 -13.7732 -13.7732 -13.7676 -13.7676 -13.4208 -13.4208 -13.4208 -13.4208 -12.8698 -12.8698 -12.8698 -12.8698 -7.8326 -7.8326 -7.8325 -7.8325 -4.2155 -4.2155 -4.2095 -4.2095 -3.9716 -3.9716 -3.9493 -3.9493 -3.8431 -3.8431 -3.8135 -3.8135 -1.9534 -1.9534 -1.9532 -1.9532 -1.9075 -1.9075 -1.9057 -1.9057 -1.4527 -1.4527 -1.4475 -1.4475 -1.2685 -1.2685 -1.2616 -1.2616 -1.1396 -1.1396 -1.1337 -1.1337 -0.9618 -0.9618 -0.9613 -0.9613 -0.8814 -0.8814 -0.8745 -0.8745 -0.5671 -0.5671 -0.5633 -0.5633 -0.5069 -0.5069 -0.5029 -0.5029 -0.1898 -0.1898 -0.1868 -0.1868 -0.1264 -0.1264 -0.1236 -0.1236 2.6080 2.6080 2.6090 2.6090 5.3501 5.3501 5.3800 5.3800 5.7213 5.7213 5.7510 5.7510 6.2129 6.2129 6.2149 6.2149 k = 0.0805 0.1394 0.4669 ( 13426 PWs) bands (ev): -15.0479 -15.0479 -15.0479 -15.0479 -13.8022 -13.8022 -13.7979 -13.7979 -13.7716 -13.7716 -13.7673 -13.7673 -13.4208 -13.4208 -13.4208 -13.4208 -12.8724 -12.8724 -12.8723 -12.8723 -7.8420 -7.8420 -7.8419 -7.8419 -4.2122 -4.2122 -4.2083 -4.2083 -3.9572 -3.9572 -3.9394 -3.9394 -3.8412 -3.8412 -3.8187 -3.8187 -1.9505 -1.9505 -1.9501 -1.9501 -1.9040 -1.9040 -1.9026 -1.9026 -1.4307 -1.4307 -1.4264 -1.4264 -1.2664 -1.2664 -1.2605 -1.2605 -1.1551 -1.1551 -1.1515 -1.1515 -0.9738 -0.9738 -0.9738 -0.9738 -0.8686 -0.8686 -0.8643 -0.8643 -0.5717 -0.5717 -0.5692 -0.5692 -0.5113 -0.5113 -0.5086 -0.5086 -0.1826 -0.1826 -0.1805 -0.1805 -0.1221 -0.1221 -0.1201 -0.1201 2.5824 2.5824 2.5831 2.5831 5.3486 5.3486 5.3692 5.3692 5.7103 5.7103 5.7307 5.7307 6.2024 6.2024 6.2037 6.2037 k = 0.0690 0.1195 0.4669 ( 13416 PWs) bands (ev): -15.0500 -15.0500 -15.0500 -15.0500 -13.7971 -13.7971 -13.7940 -13.7940 -13.7699 -13.7699 -13.7668 -13.7668 -13.4208 -13.4208 -13.4208 -13.4208 -12.8746 -12.8746 -12.8746 -12.8746 -7.8504 -7.8504 -7.8504 -7.8504 -4.2097 -4.2097 -4.2073 -4.2073 -3.9448 -3.9448 -3.9319 -3.9319 -3.8382 -3.8382 -3.8224 -3.8224 -1.9474 -1.9474 -1.9470 -1.9470 -1.9006 -1.9006 -1.8995 -1.8995 -1.4089 -1.4089 -1.4055 -1.4055 -1.2646 -1.2646 -1.2598 -1.2598 -1.1710 -1.1710 -1.1690 -1.1690 -0.9862 -0.9862 -0.9860 -0.9860 -0.8565 -0.8565 -0.8540 -0.8540 -0.5762 -0.5762 -0.5746 -0.5746 -0.5156 -0.5156 -0.5139 -0.5139 -0.1764 -0.1764 -0.1750 -0.1750 -0.1180 -0.1180 -0.1167 -0.1167 2.5596 2.5596 2.5601 2.5601 5.3459 5.3459 5.3592 5.3592 5.7006 5.7006 5.7137 5.7137 6.1930 6.1930 6.1938 6.1938 k = 0.0575 0.0995 0.4669 ( 13428 PWs) bands (ev): -15.0518 -15.0518 -15.0518 -15.0518 -13.7930 -13.7930 -13.7910 -13.7910 -13.7681 -13.7681 -13.7661 -13.7661 -13.4208 -13.4208 -13.4208 -13.4208 -12.8767 -12.8767 -12.8767 -12.8767 -7.8577 -7.8577 -7.8577 -7.8577 -4.2078 -4.2078 -4.2064 -4.2064 -3.9346 -3.9346 -3.9264 -3.9264 -3.8346 -3.8346 -3.8247 -3.8247 -1.9444 -1.9444 -1.9441 -1.9441 -1.8973 -1.8973 -1.8966 -1.8966 -1.3876 -1.3876 -1.3850 -1.3850 -1.2632 -1.2632 -1.2594 -1.2594 -1.1866 -1.1866 -1.1858 -1.1858 -0.9980 -0.9980 -0.9978 -0.9978 -0.8455 -0.8455 -0.8442 -0.8442 -0.5804 -0.5804 -0.5794 -0.5794 -0.5195 -0.5195 -0.5185 -0.5185 -0.1712 -0.1712 -0.1703 -0.1703 -0.1142 -0.1142 -0.1134 -0.1134 2.5398 2.5398 2.5401 2.5401 5.3425 5.3425 5.3502 5.3502 5.6922 5.6922 5.6999 5.6999 6.1849 6.1849 6.1853 6.1853 k = 0.0460 0.0796 0.4669 ( 13456 PWs) bands (ev): -15.0534 -15.0534 -15.0534 -15.0534 -13.7898 -13.7898 -13.7887 -13.7887 -13.7664 -13.7664 -13.7652 -13.7652 -13.4208 -13.4208 -13.4208 -13.4208 -12.8784 -12.8784 -12.8784 -12.8784 -7.8638 -7.8638 -7.8638 -7.8638 -4.2063 -4.2063 -4.2056 -4.2056 -3.9270 -3.9270 -3.9224 -3.9224 -3.8309 -3.8309 -3.8256 -3.8256 -1.9416 -1.9416 -1.9415 -1.9415 -1.8943 -1.8943 -1.8939 -1.8939 -1.3671 -1.3671 -1.3653 -1.3653 -1.2624 -1.2624 -1.2597 -1.2597 -1.2016 -1.2016 -1.2015 -1.2015 -1.0089 -1.0089 -1.0087 -1.0087 -0.8360 -0.8360 -0.8354 -0.8354 -0.5841 -0.5841 -0.5836 -0.5836 -0.5230 -0.5230 -0.5225 -0.5225 -0.1670 -0.1670 -0.1666 -0.1666 -0.1109 -0.1109 -0.1104 -0.1104 2.5232 2.5232 2.5234 2.5234 5.3386 5.3386 5.3426 5.3426 5.6853 5.6853 5.6892 5.6892 6.1780 6.1780 6.1783 6.1783 k = 0.0345 0.0597 0.4669 ( 13472 PWs) bands (ev): -15.0546 -15.0546 -15.0546 -15.0546 -13.7875 -13.7875 -13.7870 -13.7870 -13.7648 -13.7648 -13.7643 -13.7643 -13.4208 -13.4208 -13.4208 -13.4208 -12.8798 -12.8798 -12.8798 -12.8798 -7.8687 -7.8687 -7.8687 -7.8687 -4.2053 -4.2053 -4.2050 -4.2050 -3.9217 -3.9217 -3.9197 -3.9197 -3.8277 -3.8277 -3.8253 -3.8253 -1.9394 -1.9394 -1.9393 -1.9393 -1.8918 -1.8918 -1.8916 -1.8916 -1.3479 -1.3479 -1.3468 -1.3468 -1.2626 -1.2626 -1.2608 -1.2608 -1.2156 -1.2156 -1.2153 -1.2153 -1.0182 -1.0182 -1.0181 -1.0181 -0.8283 -0.8283 -0.8280 -0.8280 -0.5872 -0.5872 -0.5870 -0.5870 -0.5258 -0.5258 -0.5256 -0.5256 -0.1639 -0.1639 -0.1637 -0.1637 -0.1081 -0.1081 -0.1079 -0.1079 2.5101 2.5101 2.5102 2.5102 5.3348 5.3348 5.3365 5.3365 5.6797 5.6797 5.6814 5.6814 6.1726 6.1726 6.1727 6.1727 k = 0.0230 0.0398 0.4669 ( 13480 PWs) bands (ev): -15.0555 -15.0555 -15.0555 -15.0555 -13.7860 -13.7860 -13.7858 -13.7858 -13.7636 -13.7636 -13.7634 -13.7634 -13.4208 -13.4208 -13.4208 -13.4208 -12.8808 -12.8808 -12.8808 -12.8808 -7.8722 -7.8722 -7.8722 -7.8722 -4.2046 -4.2046 -4.2046 -4.2046 -3.9185 -3.9185 -3.9179 -3.9179 -3.8252 -3.8252 -3.8245 -3.8245 -1.9377 -1.9377 -1.9376 -1.9376 -1.8898 -1.8898 -1.8898 -1.8898 -1.3308 -1.3308 -1.3303 -1.3303 -1.2643 -1.2643 -1.2635 -1.2635 -1.2268 -1.2268 -1.2266 -1.2266 -1.0254 -1.0254 -1.0254 -1.0254 -0.8226 -0.8226 -0.8225 -0.8225 -0.5895 -0.5895 -0.5895 -0.5895 -0.5280 -0.5280 -0.5280 -0.5280 -0.1618 -0.1618 -0.1617 -0.1617 -0.1060 -0.1060 -0.1060 -0.1060 2.5006 2.5006 2.5006 2.5006 5.3317 5.3317 5.3322 5.3322 5.6756 5.6756 5.6761 5.6761 6.1687 6.1687 6.1687 6.1687 k = 0.0115 0.0199 0.4669 ( 13500 PWs) bands (ev): -15.0560 -15.0560 -15.0560 -15.0560 -13.7851 -13.7851 -13.7851 -13.7851 -13.7628 -13.7628 -13.7628 -13.7628 -13.4208 -13.4208 -13.4208 -13.4208 -12.8814 -12.8814 -12.8814 -12.8814 -7.8743 -7.8743 -7.8743 -7.8743 -4.2043 -4.2043 -4.2043 -4.2043 -3.9168 -3.9168 -3.9168 -3.9168 -3.8237 -3.8237 -3.8236 -3.8236 -1.9366 -1.9366 -1.9366 -1.9366 -1.8886 -1.8886 -1.8886 -1.8886 -1.3174 -1.3174 -1.3173 -1.3173 -1.2678 -1.2678 -1.2676 -1.2676 -1.2340 -1.2340 -1.2339 -1.2339 -1.0300 -1.0300 -1.0300 -1.0300 -0.8190 -0.8190 -0.8190 -0.8190 -0.5910 -0.5910 -0.5910 -0.5910 -0.5294 -0.5294 -0.5294 -0.5294 -0.1605 -0.1605 -0.1605 -0.1605 -0.1048 -0.1048 -0.1047 -0.1047 2.4949 2.4949 2.4949 2.4949 5.3295 5.3295 5.3296 5.3296 5.6731 5.6731 5.6732 5.6732 6.1663 6.1663 6.1663 6.1663 k = 0.0000 0.0000 0.4669 ( 13508 PWs) bands (ev): -15.0562 -15.0562 -15.0562 -15.0562 -13.7849 -13.7849 -13.7849 -13.7849 -13.7626 -13.7626 -13.7626 -13.7626 -13.4208 -13.4208 -13.4208 -13.4208 -12.8816 -12.8816 -12.8816 -12.8816 -7.8750 -7.8750 -7.8750 -7.8750 -4.2042 -4.2042 -4.2042 -4.2042 -3.9164 -3.9164 -3.9164 -3.9164 -3.8232 -3.8232 -3.8232 -3.8232 -1.9363 -1.9363 -1.9363 -1.9363 -1.8882 -1.8882 -1.8882 -1.8882 -1.3118 -1.3118 -1.3118 -1.3118 -1.2702 -1.2702 -1.2701 -1.2701 -1.2363 -1.2363 -1.2363 -1.2363 -1.0316 -1.0316 -1.0316 -1.0316 -0.8179 -0.8179 -0.8179 -0.8179 -0.5915 -0.5915 -0.5915 -0.5915 -0.5298 -0.5298 -0.5298 -0.5298 -0.1601 -0.1601 -0.1601 -0.1601 -0.1043 -0.1043 -0.1043 -0.1043 2.4929 2.4929 2.4930 2.4930 5.3287 5.3287 5.3287 5.3287 5.6722 5.6722 5.6722 5.6722 6.1655 6.1655 6.1655 6.1655 k = 0.5000 0.2887 0.4669 ( 13432 PWs) bands (ev): -15.0072 -15.0072 -15.0072 -15.0072 -13.8939 -13.8939 -13.8939 -13.8939 -13.7738 -13.7738 -13.7738 -13.7738 -13.4210 -13.4210 -13.4210 -13.4210 -12.8347 -12.8347 -12.8347 -12.8347 -7.6802 -7.6802 -7.6802 -7.6802 -4.3181 -4.3181 -4.3181 -4.3181 -4.1269 -4.1269 -4.1269 -4.1269 -3.7530 -3.7530 -3.7530 -3.7530 -1.9741 -1.9741 -1.9741 -1.9741 -1.9018 -1.9018 -1.9018 -1.9018 -1.7134 -1.7134 -1.7134 -1.7134 -1.3013 -1.3013 -1.3013 -1.3013 -1.0417 -1.0417 -1.0417 -1.0417 -0.9487 -0.9487 -0.9487 -0.9487 -0.8243 -0.8243 -0.8242 -0.8242 -0.4989 -0.4989 -0.4989 -0.4989 -0.4426 -0.4426 -0.4426 -0.4426 -0.3128 -0.3128 -0.3128 -0.3128 -0.1613 -0.1613 -0.1613 -0.1613 3.0271 3.0271 3.0271 3.0271 5.3535 5.3535 5.3535 5.3535 6.0599 6.0599 6.0599 6.0599 6.4052 6.4052 6.4052 6.4052 k = 0.5000 0.2887 0.4436 ( 13428 PWs) bands (ev): -15.0087 -15.0087 -15.0059 -15.0059 -13.8950 -13.8950 -13.8928 -13.8928 -13.7746 -13.7746 -13.7730 -13.7730 -13.4214 -13.4214 -13.4193 -13.4193 -12.8363 -12.8363 -12.8342 -12.8342 -7.6822 -7.6822 -7.6800 -7.6800 -4.3198 -4.3198 -4.3147 -4.3147 -4.1269 -4.1269 -4.1224 -4.1224 -3.7563 -3.7563 -3.7496 -3.7496 -1.9803 -1.9803 -1.9672 -1.9672 -1.9180 -1.9180 -1.8846 -1.8846 -1.7186 -1.7186 -1.7085 -1.7085 -1.3041 -1.3041 -1.3002 -1.3002 -1.0435 -1.0435 -1.0403 -1.0403 -0.9640 -0.9640 -0.9390 -0.9390 -0.8437 -0.8437 -0.8038 -0.8038 -0.5006 -0.5006 -0.4997 -0.4997 -0.4459 -0.4459 -0.4418 -0.4418 -0.3158 -0.3158 -0.3059 -0.3059 -0.1616 -0.1616 -0.1596 -0.1596 3.0223 3.0223 3.0245 3.0245 5.3470 5.3470 5.3598 5.3598 6.0567 6.0567 6.0646 6.0646 6.4099 6.4099 6.4116 6.4116 k = 0.5000 0.2887 0.4202 ( 13448 PWs) bands (ev): -15.0103 -15.0103 -15.0049 -15.0049 -13.8961 -13.8961 -13.8917 -13.8917 -13.7755 -13.7755 -13.7722 -13.7722 -13.4204 -13.4204 -13.4162 -13.4162 -12.8390 -12.8390 -12.8349 -12.8349 -7.6859 -7.6859 -7.6814 -7.6814 -4.3201 -4.3201 -4.3100 -4.3100 -4.1221 -4.1221 -4.1134 -4.1134 -3.7594 -3.7594 -3.7461 -3.7461 -1.9855 -1.9855 -1.9609 -1.9609 -1.9319 -1.9319 -1.8667 -1.8667 -1.7240 -1.7240 -1.7039 -1.7039 -1.3087 -1.3087 -1.3009 -1.3009 -1.0460 -1.0460 -1.0393 -1.0393 -0.9831 -0.9831 -0.9382 -0.9382 -0.8589 -0.8589 -0.7840 -0.7840 -0.5050 -0.5050 -0.5031 -0.5031 -0.4504 -0.4504 -0.4442 -0.4442 -0.3142 -0.3142 -0.2963 -0.2963 -0.1608 -0.1608 -0.1566 -0.1566 3.0105 3.0105 3.0147 3.0147 5.3403 5.3403 5.3656 5.3656 6.0544 6.0544 6.0709 6.0709 6.4254 6.4254 6.4294 6.4294 k = 0.5000 0.2887 0.3969 ( 13440 PWs) bands (ev): -15.0122 -15.0122 -15.0041 -15.0041 -13.8971 -13.8971 -13.8905 -13.8905 -13.7763 -13.7763 -13.7714 -13.7714 -13.4180 -13.4180 -13.4119 -13.4119 -12.8429 -12.8429 -12.8368 -12.8368 -7.6913 -7.6913 -7.6845 -7.6845 -4.3190 -4.3190 -4.3042 -4.3042 -4.1123 -4.1123 -4.0997 -4.0997 -3.7624 -3.7624 -3.7426 -3.7426 -1.9898 -1.9898 -1.9612 -1.9612 -1.9371 -1.9371 -1.8486 -1.8486 -1.7298 -1.7298 -1.6996 -1.6996 -1.3148 -1.3148 -1.3034 -1.3034 -1.0508 -1.0508 -1.0389 -1.0389 -1.0039 -1.0039 -0.9496 -0.9496 -0.8661 -0.8661 -0.7654 -0.7654 -0.5118 -0.5118 -0.5087 -0.5087 -0.4552 -0.4552 -0.4494 -0.4494 -0.3083 -0.3083 -0.2850 -0.2850 -0.1588 -0.1588 -0.1523 -0.1523 2.9920 2.9920 2.9981 2.9981 5.3337 5.3337 5.3708 5.3708 6.0523 6.0523 6.0784 6.0784 6.4518 6.4518 6.4588 6.4588 k = 0.5000 0.2887 0.3735 ( 13444 PWs) bands (ev): -15.0143 -15.0143 -15.0036 -15.0036 -13.8981 -13.8981 -13.8893 -13.8893 -13.7770 -13.7770 -13.7706 -13.7706 -13.4143 -13.4143 -13.4062 -13.4062 -12.8478 -12.8478 -12.8397 -12.8397 -7.6981 -7.6981 -7.6891 -7.6891 -4.3171 -4.3171 -4.2980 -4.2980 -4.0972 -4.0972 -4.0813 -4.0813 -3.7652 -3.7652 -3.7390 -3.7390 -1.9934 -1.9934 -1.9713 -1.9713 -1.9304 -1.9304 -1.8304 -1.8304 -1.7357 -1.7357 -1.6957 -1.6957 -1.3224 -1.3224 -1.3077 -1.3077 -1.0625 -1.0625 -1.0396 -1.0396 -1.0216 -1.0216 -0.9707 -0.9707 -0.8665 -0.8665 -0.7483 -0.7483 -0.5206 -0.5206 -0.5166 -0.5166 -0.4607 -0.4607 -0.4554 -0.4554 -0.2992 -0.2992 -0.2730 -0.2730 -0.1558 -0.1558 -0.1468 -0.1468 2.9678 2.9678 2.9756 2.9756 5.3269 5.3269 5.3751 5.3751 6.0496 6.0496 6.0864 6.0864 6.4891 6.4891 6.4997 6.4997 k = 0.5000 0.2887 0.3502 ( 13442 PWs) bands (ev): -15.0164 -15.0164 -15.0032 -15.0032 -13.8990 -13.8990 -13.8881 -13.8881 -13.7778 -13.7778 -13.7698 -13.7698 -13.4094 -13.4094 -13.3994 -13.3994 -12.8538 -12.8538 -12.8437 -12.8437 -7.7062 -7.7062 -7.6951 -7.6951 -4.3148 -4.3148 -4.2919 -4.2919 -4.0767 -4.0767 -4.0582 -4.0582 -3.7675 -3.7675 -3.7354 -3.7354 -1.9973 -1.9973 -1.9824 -1.9824 -1.9194 -1.9194 -1.8126 -1.8126 -1.7416 -1.7416 -1.6922 -1.6922 -1.3314 -1.3314 -1.3136 -1.3136 -1.0861 -1.0861 -1.0418 -1.0418 -1.0332 -1.0332 -0.9946 -0.9946 -0.8642 -0.8642 -0.7330 -0.7330 -0.5309 -0.5309 -0.5262 -0.5262 -0.4679 -0.4679 -0.4602 -0.4602 -0.2880 -0.2880 -0.2607 -0.2607 -0.1520 -0.1520 -0.1403 -0.1403 2.9390 2.9390 2.9481 2.9481 5.3201 5.3201 5.3785 5.3785 6.0459 6.0459 6.0940 6.0940 6.5368 6.5368 6.5514 6.5514 k = 0.5000 0.2887 0.3268 ( 13448 PWs) bands (ev): -15.0187 -15.0187 -15.0031 -15.0031 -13.8999 -13.8999 -13.8870 -13.8870 -13.7785 -13.7785 -13.7691 -13.7691 -13.4032 -13.4032 -13.3916 -13.3916 -12.8608 -12.8608 -12.8488 -12.8488 -7.7154 -7.7154 -7.7023 -7.7023 -4.3125 -4.3125 -4.2863 -4.2863 -4.0508 -4.0508 -4.0306 -4.0306 -3.7694 -3.7694 -3.7316 -3.7316 -2.0046 -2.0046 -1.9892 -1.9892 -1.9065 -1.9065 -1.7964 -1.7964 -1.7466 -1.7466 -1.6892 -1.6892 -1.3414 -1.3414 -1.3212 -1.3212 -1.1183 -1.1183 -1.0544 -1.0544 -1.0411 -1.0411 -1.0104 -1.0104 -0.8613 -0.8613 -0.7193 -0.7193 -0.5432 -0.5432 -0.5364 -0.5364 -0.4755 -0.4755 -0.4641 -0.4641 -0.2756 -0.2756 -0.2487 -0.2487 -0.1476 -0.1476 -0.1330 -0.1330 2.9065 2.9065 2.9166 2.9166 5.3131 5.3131 5.3808 5.3808 6.0410 6.0410 6.1007 6.1007 6.5942 6.5942 6.6126 6.6126 k = 0.5000 0.2887 0.3035 ( 13444 PWs) bands (ev): -15.0211 -15.0211 -15.0031 -15.0031 -13.9008 -13.9008 -13.8858 -13.8858 -13.7792 -13.7792 -13.7683 -13.7683 -13.3959 -13.3959 -13.3827 -13.3827 -12.8687 -12.8687 -12.8547 -12.8547 -7.7254 -7.7254 -7.7104 -7.7104 -4.3103 -4.3103 -4.2814 -4.2814 -4.0202 -4.0202 -3.9991 -3.9991 -3.7704 -3.7704 -3.7275 -3.7275 -2.0152 -2.0152 -1.9909 -1.9909 -1.8924 -1.8924 -1.7850 -1.7850 -1.7476 -1.7476 -1.6867 -1.6867 -1.3525 -1.3525 -1.3304 -1.3304 -1.1554 -1.1554 -1.0845 -1.0845 -1.0433 -1.0433 -1.0151 -1.0151 -0.8586 -0.8586 -0.7073 -0.7073 -0.5577 -0.5577 -0.5460 -0.5460 -0.4826 -0.4826 -0.4677 -0.4677 -0.2627 -0.2627 -0.2370 -0.2370 -0.1428 -0.1428 -0.1251 -0.1251 2.8716 2.8716 2.8825 2.8825 5.3060 5.3060 5.3822 5.3822 6.0350 6.0350 6.1062 6.1062 6.6603 6.6603 6.6818 6.6818 k = 0.5000 0.2887 0.2801 ( 13442 PWs) bands (ev): -15.0235 -15.0235 -15.0033 -15.0033 -13.9015 -13.9015 -13.8847 -13.8847 -13.7799 -13.7799 -13.7677 -13.7677 -13.3876 -13.3876 -13.3731 -13.3731 -12.8774 -12.8774 -12.8615 -12.8615 -7.7361 -7.7361 -7.7192 -7.7192 -4.3084 -4.3084 -4.2772 -4.2772 -3.9855 -3.9855 -3.9645 -3.9645 -3.7701 -3.7701 -3.7231 -3.7231 -2.0265 -2.0265 -1.9904 -1.9904 -1.8774 -1.8774 -1.7837 -1.7837 -1.7399 -1.7399 -1.6849 -1.6849 -1.3642 -1.3642 -1.3411 -1.3411 -1.1955 -1.1955 -1.1202 -1.1202 -1.0448 -1.0448 -1.0156 -1.0156 -0.8562 -0.8562 -0.6972 -0.6972 -0.5739 -0.5739 -0.5545 -0.5545 -0.4889 -0.4889 -0.4712 -0.4712 -0.2498 -0.2498 -0.2259 -0.2259 -0.1377 -0.1377 -0.1168 -0.1168 2.8354 2.8354 2.8468 2.8468 5.2988 5.2988 5.3826 5.3826 6.0282 6.0282 6.1104 6.1104 6.7332 6.7332 6.7571 6.7571 k = 0.5000 0.2887 0.2568 ( 13456 PWs) bands (ev): -15.0259 -15.0259 -15.0036 -15.0036 -13.9023 -13.9023 -13.8837 -13.8837 -13.7805 -13.7805 -13.7670 -13.7670 -13.3785 -13.3785 -13.3627 -13.3627 -12.8868 -12.8868 -12.8690 -12.8690 -7.7472 -7.7472 -7.7284 -7.7284 -4.3069 -4.3069 -4.2737 -4.2737 -3.9480 -3.9480 -3.9284 -3.9284 -3.7675 -3.7675 -3.7180 -3.7180 -2.0373 -2.0373 -1.9887 -1.9887 -1.8616 -1.8616 -1.7903 -1.7903 -1.7263 -1.7263 -1.6835 -1.6835 -1.3765 -1.3765 -1.3531 -1.3531 -1.2375 -1.2375 -1.1580 -1.1580 -1.0461 -1.0461 -1.0147 -1.0147 -0.8542 -0.8542 -0.6890 -0.6890 -0.5913 -0.5913 -0.5618 -0.5618 -0.4945 -0.4945 -0.4746 -0.4746 -0.2371 -0.2371 -0.2156 -0.2156 -0.1324 -0.1324 -0.1083 -0.1083 2.7990 2.7990 2.8105 2.8105 5.2916 5.2916 5.3822 5.3822 6.0209 6.0209 6.1134 6.1134 6.8113 6.8113 6.8366 6.8366 k = 0.5000 0.2887 0.2334 ( 13444 PWs) bands (ev): -15.0282 -15.0282 -15.0041 -15.0041 -13.9030 -13.9030 -13.8827 -13.8827 -13.7811 -13.7811 -13.7664 -13.7664 -13.3687 -13.3687 -13.3518 -13.3518 -12.8968 -12.8968 -12.8771 -12.8771 -7.7583 -7.7583 -7.7379 -7.7379 -4.3058 -4.3058 -4.2707 -4.2707 -3.9092 -3.9092 -3.8933 -3.8933 -3.7609 -3.7609 -3.7117 -3.7117 -2.0473 -2.0473 -1.9862 -1.9862 -1.8455 -1.8455 -1.8003 -1.8003 -1.7124 -1.7124 -1.6816 -1.6816 -1.3891 -1.3891 -1.3665 -1.3665 -1.2802 -1.2802 -1.1962 -1.1962 -1.0473 -1.0473 -1.0133 -1.0133 -0.8523 -0.8523 -0.6829 -0.6829 -0.6091 -0.6091 -0.5677 -0.5677 -0.4992 -0.4992 -0.4779 -0.4779 -0.2251 -0.2251 -0.2059 -0.2059 -0.1272 -0.1272 -0.0998 -0.0998 2.7632 2.7632 2.7746 2.7746 5.2844 5.2844 5.3812 5.3812 6.0133 6.0133 6.1152 6.1152 6.8926 6.8926 6.9185 6.9185 k = 0.5000 0.2887 0.2101 ( 13442 PWs) bands (ev): -15.0304 -15.0304 -15.0046 -15.0046 -13.9036 -13.9036 -13.8817 -13.8817 -13.7817 -13.7817 -13.7658 -13.7658 -13.3584 -13.3584 -13.3407 -13.3407 -12.9071 -12.9071 -12.8856 -12.8856 -7.7692 -7.7692 -7.7473 -7.7473 -4.3050 -4.3050 -4.2683 -4.2683 -3.8720 -3.8720 -3.8621 -3.8621 -3.7470 -3.7470 -3.7034 -3.7034 -2.0565 -2.0565 -1.9831 -1.9831 -1.8310 -1.8310 -1.8105 -1.8105 -1.7036 -1.7036 -1.6762 -1.6762 -1.4016 -1.4016 -1.3810 -1.3810 -1.3222 -1.3222 -1.2338 -1.2338 -1.0485 -1.0485 -1.0118 -1.0118 -0.8504 -0.8504 -0.6792 -0.6792 -0.6265 -0.6265 -0.5724 -0.5724 -0.5033 -0.5033 -0.4810 -0.4810 -0.2137 -0.2137 -0.1972 -0.1972 -0.1221 -0.1221 -0.0916 -0.0916 2.7289 2.7289 2.7400 2.7400 5.2774 5.2774 5.3797 5.3797 6.0058 6.0058 6.1162 6.1162 6.9750 6.9750 7.0006 7.0006 k = 0.5000 0.2887 0.1868 ( 13440 PWs) bands (ev): -15.0326 -15.0326 -15.0051 -15.0051 -13.9042 -13.9042 -13.8808 -13.8808 -13.7821 -13.7821 -13.7653 -13.7653 -13.3477 -13.3477 -13.3294 -13.3294 -12.9176 -12.9176 -12.8944 -12.8944 -7.7797 -7.7797 -7.7564 -7.7564 -4.3044 -4.3044 -4.2663 -4.2663 -3.8464 -3.8464 -3.8317 -3.8317 -3.7231 -3.7231 -3.6916 -3.6916 -2.0646 -2.0646 -1.9795 -1.9795 -1.8327 -1.8327 -1.8061 -1.8061 -1.7034 -1.7034 -1.6647 -1.6647 -1.4140 -1.4140 -1.3969 -1.3969 -1.3618 -1.3618 -1.2698 -1.2698 -1.0497 -1.0497 -1.0102 -1.0102 -0.8482 -0.8482 -0.6790 -0.6790 -0.6421 -0.6421 -0.5758 -0.5758 -0.5067 -0.5067 -0.4839 -0.4839 -0.2032 -0.2032 -0.1893 -0.1893 -0.1171 -0.1171 -0.0838 -0.0838 2.6967 2.6967 2.7074 2.7074 5.2708 5.2708 5.3779 5.3779 5.9984 5.9984 6.1165 6.1165 7.0566 7.0566 7.0811 7.0811 k = 0.5000 0.2887 0.1634 ( 13446 PWs) bands (ev): -15.0345 -15.0345 -15.0057 -15.0057 -13.9047 -13.9047 -13.8800 -13.8800 -13.7826 -13.7826 -13.7648 -13.7648 -13.3371 -13.3371 -13.3183 -13.3183 -12.9281 -12.9281 -12.9032 -12.9032 -7.7896 -7.7896 -7.7650 -7.7650 -4.3040 -4.3040 -4.2646 -4.2646 -3.8339 -3.8339 -3.8028 -3.8028 -3.6906 -3.6906 -3.6746 -3.6746 -2.0717 -2.0717 -1.9757 -1.9757 -1.8473 -1.8473 -1.7903 -1.7903 -1.7093 -1.7093 -1.6504 -1.6504 -1.4258 -1.4258 -1.4154 -1.4154 -1.3959 -1.3959 -1.3035 -1.3035 -1.0507 -1.0507 -1.0086 -1.0086 -0.8456 -0.8456 -0.6848 -0.6848 -0.6527 -0.6527 -0.5780 -0.5780 -0.5095 -0.5095 -0.4865 -0.4865 -0.1938 -0.1938 -0.1822 -0.1822 -0.1125 -0.1125 -0.0765 -0.0765 2.6674 2.6674 2.6773 2.6773 5.2645 5.2645 5.3758 5.3758 5.9914 5.9914 6.1163 6.1163 7.1352 7.1352 7.1582 7.1582 k = 0.5000 0.2887 0.1401 ( 13432 PWs) bands (ev): -15.0363 -15.0363 -15.0063 -15.0063 -13.9051 -13.9051 -13.8793 -13.8793 -13.7830 -13.7830 -13.7644 -13.7644 -13.3268 -13.3268 -13.3076 -13.3076 -12.9382 -12.9382 -12.9117 -12.9117 -7.7985 -7.7985 -7.7729 -7.7729 -4.3038 -4.3038 -4.2632 -4.2632 -3.8278 -3.8278 -3.7812 -3.7812 -3.6541 -3.6541 -3.6515 -3.6515 -2.0778 -2.0778 -1.9719 -1.9719 -1.8641 -1.8641 -1.7736 -1.7736 -1.7190 -1.7190 -1.6360 -1.6360 -1.4395 -1.4395 -1.4366 -1.4366 -1.4201 -1.4201 -1.3340 -1.3340 -1.0517 -1.0517 -1.0072 -1.0072 -0.8424 -0.8424 -0.6971 -0.6971 -0.6575 -0.6575 -0.5794 -0.5794 -0.5117 -0.5117 -0.4889 -0.4889 -0.1855 -0.1855 -0.1761 -0.1761 -0.1083 -0.1083 -0.0700 -0.0700 2.6412 2.6412 2.6503 2.6503 5.2589 5.2589 5.3737 5.3737 5.9851 5.9851 6.1157 6.1157 7.2089 7.2089 7.2299 7.2299 k = 0.5000 0.2887 0.1167 ( 13438 PWs) bands (ev): -15.0379 -15.0379 -15.0068 -15.0068 -13.9055 -13.9055 -13.8787 -13.8787 -13.7833 -13.7833 -13.7641 -13.7641 -13.3170 -13.3170 -13.2978 -13.2978 -12.9477 -12.9477 -12.9198 -12.9198 -7.8065 -7.8065 -7.7798 -7.7798 -4.3037 -4.3037 -4.2621 -4.2621 -3.8248 -3.8248 -3.7670 -3.7670 -3.6244 -3.6244 -3.6175 -3.6175 -2.0827 -2.0827 -1.9682 -1.9682 -1.8814 -1.8814 -1.7580 -1.7580 -1.7312 -1.7312 -1.6224 -1.6224 -1.4634 -1.4634 -1.4473 -1.4473 -1.4376 -1.4376 -1.3608 -1.3608 -1.0526 -1.0526 -1.0059 -1.0059 -0.8384 -0.8384 -0.7122 -0.7122 -0.6594 -0.6594 -0.5802 -0.5802 -0.5134 -0.5134 -0.4909 -0.4909 -0.1784 -0.1784 -0.1710 -0.1710 -0.1046 -0.1046 -0.0642 -0.0642 2.6186 2.6186 2.6268 2.6268 5.2539 5.2539 5.3717 5.3717 5.9795 5.9795 6.1150 6.1150 7.2757 7.2757 7.2945 7.2945 k = 0.5000 0.2887 0.0934 ( 13450 PWs) bands (ev): -15.0392 -15.0392 -15.0072 -15.0072 -13.9058 -13.9058 -13.8782 -13.8782 -13.7836 -13.7836 -13.7638 -13.7638 -13.3083 -13.3083 -13.2890 -13.2890 -12.9563 -12.9563 -12.9271 -12.9271 -7.8132 -7.8132 -7.7858 -7.7858 -4.3036 -4.3036 -4.2612 -4.2612 -3.8233 -3.8233 -3.7581 -3.7581 -3.5968 -3.5968 -3.5839 -3.5839 -2.0866 -2.0866 -1.9648 -1.9648 -1.8982 -1.8982 -1.7517 -1.7517 -1.7370 -1.7370 -1.6101 -1.6101 -1.4828 -1.4828 -1.4581 -1.4581 -1.4511 -1.4511 -1.3834 -1.3834 -1.0533 -1.0533 -1.0048 -1.0048 -0.8336 -0.8336 -0.7275 -0.7275 -0.6604 -0.6604 -0.5805 -0.5805 -0.5146 -0.5146 -0.4926 -0.4926 -0.1725 -0.1725 -0.1668 -0.1668 -0.1014 -0.1014 -0.0594 -0.0594 2.5998 2.5998 2.6071 2.6071 5.2497 5.2497 5.3699 5.3699 5.9747 5.9747 6.1143 6.1143 7.3337 7.3337 7.3503 7.3503 k = 0.5000 0.2887 0.0700 ( 13468 PWs) bands (ev): -15.0402 -15.0402 -15.0076 -15.0076 -13.9060 -13.9060 -13.8778 -13.8778 -13.7838 -13.7838 -13.7636 -13.7636 -13.3010 -13.3010 -13.2817 -13.2817 -12.9634 -12.9634 -12.9332 -12.9332 -7.8186 -7.8186 -7.7905 -7.7905 -4.3036 -4.3036 -4.2605 -4.2605 -3.8226 -3.8226 -3.7526 -3.7526 -3.5721 -3.5721 -3.5555 -3.5555 -2.0895 -2.0895 -1.9620 -1.9620 -1.9131 -1.9131 -1.7637 -1.7637 -1.7264 -1.7264 -1.5995 -1.5995 -1.4967 -1.4967 -1.4703 -1.4703 -1.4599 -1.4599 -1.4014 -1.4014 -1.0539 -1.0539 -1.0040 -1.0040 -0.8282 -0.8282 -0.7419 -0.7419 -0.6611 -0.6611 -0.5806 -0.5806 -0.5155 -0.5155 -0.4940 -0.4940 -0.1679 -0.1679 -0.1635 -0.1635 -0.0988 -0.0988 -0.0556 -0.0556 2.5851 2.5851 2.5915 2.5915 5.2463 5.2463 5.3684 5.3684 5.9709 5.9709 6.1136 6.1136 7.3810 7.3810 7.3958 7.3958 k = 0.5000 0.2887 0.0467 ( 13480 PWs) bands (ev): -15.0410 -15.0410 -15.0079 -15.0079 -13.9062 -13.9062 -13.8776 -13.8776 -13.7840 -13.7840 -13.7634 -13.7634 -13.2953 -13.2953 -13.2762 -13.2762 -12.9689 -12.9689 -12.9378 -12.9378 -7.8225 -7.8225 -7.7940 -7.7940 -4.3036 -4.3036 -4.2601 -4.2601 -3.8223 -3.8223 -3.7492 -3.7492 -3.5527 -3.5527 -3.5338 -3.5338 -2.0914 -2.0914 -1.9599 -1.9599 -1.9249 -1.9249 -1.7758 -1.7758 -1.7161 -1.7161 -1.5911 -1.5911 -1.5056 -1.5056 -1.4814 -1.4814 -1.4655 -1.4655 -1.4147 -1.4147 -1.0543 -1.0543 -1.0033 -1.0033 -0.8225 -0.8225 -0.7543 -0.7543 -0.6616 -0.6616 -0.5806 -0.5806 -0.5161 -0.5161 -0.4950 -0.4950 -0.1646 -0.1646 -0.1611 -0.1611 -0.0969 -0.0969 -0.0528 -0.0528 2.5745 2.5745 2.5801 2.5801 5.2439 5.2439 5.3673 5.3673 5.9681 5.9681 6.1130 6.1130 7.4161 7.4161 7.4295 7.4295 k = 0.5000 0.2887 0.0233 ( 13472 PWs) bands (ev): -15.0415 -15.0415 -15.0081 -15.0081 -13.9063 -13.9063 -13.8774 -13.8774 -13.7840 -13.7840 -13.7633 -13.7633 -13.2918 -13.2918 -13.2728 -13.2728 -12.9723 -12.9723 -12.9407 -12.9407 -7.8248 -7.8248 -7.7961 -7.7961 -4.3036 -4.3036 -4.2598 -4.2598 -3.8222 -3.8222 -3.7474 -3.7474 -3.5404 -3.5404 -3.5202 -3.5202 -2.0925 -2.0925 -1.9585 -1.9585 -1.9326 -1.9326 -1.7841 -1.7841 -1.7094 -1.7094 -1.5856 -1.5856 -1.5104 -1.5104 -1.4892 -1.4892 -1.4688 -1.4688 -1.4228 -1.4228 -1.0546 -1.0546 -1.0030 -1.0030 -0.8175 -0.8175 -0.7634 -0.7634 -0.6619 -0.6619 -0.5806 -0.5806 -0.5164 -0.5164 -0.4956 -0.4956 -0.1627 -0.1627 -0.1597 -0.1597 -0.0958 -0.0958 -0.0511 -0.0511 2.5682 2.5682 2.5732 2.5732 5.2424 5.2424 5.3666 5.3666 5.9664 5.9664 6.1126 6.1126 7.4376 7.4376 7.4502 7.4502 k = 0.5000 0.2887-0.0000 ( 13474 PWs) bands (ev): -15.0416 -15.0416 -15.0081 -15.0081 -13.9064 -13.9064 -13.8773 -13.8773 -13.7841 -13.7841 -13.7633 -13.7633 -13.2906 -13.2906 -13.2716 -13.2716 -12.9735 -12.9735 -12.9417 -12.9417 -7.8256 -7.8256 -7.7968 -7.7968 -4.3036 -4.3036 -4.2597 -4.2597 -3.8222 -3.8222 -3.7468 -3.7468 -3.5362 -3.5362 -3.5156 -3.5156 -2.0929 -2.0929 -1.9581 -1.9581 -1.9352 -1.9352 -1.7870 -1.7870 -1.7070 -1.7070 -1.5836 -1.5836 -1.5119 -1.5119 -1.4920 -1.4920 -1.4699 -1.4699 -1.4255 -1.4255 -1.0547 -1.0547 -1.0028 -1.0028 -0.8154 -0.8154 -0.7669 -0.7669 -0.6620 -0.6620 -0.5806 -0.5806 -0.5165 -0.5165 -0.4958 -0.4958 -0.1620 -0.1620 -0.1592 -0.1592 -0.0954 -0.0954 -0.0505 -0.0505 2.5661 2.5661 2.5709 2.5709 5.2419 5.2419 5.3663 5.3663 5.9659 5.9659 6.1125 6.1125 7.4449 7.4449 7.4572 7.4572 k = 0.3333 0.5774-0.0000 ( 13467 PWs) bands (ev): -15.0187 -15.0187 -15.0186 -15.0186 -13.9278 -13.9278 -13.8815 -13.8815 -13.7866 -13.7866 -13.7645 -13.7645 -13.2812 -13.2812 -13.2810 -13.2810 -12.9524 -12.9524 -12.9524 -12.9524 -7.7861 -7.7861 -7.7853 -7.7853 -4.4161 -4.4161 -4.2499 -4.2499 -3.8530 -3.8530 -3.6601 -3.6601 -3.5392 -3.5392 -3.5139 -3.5139 -2.1786 -2.1786 -1.8954 -1.8954 -1.8635 -1.8635 -1.7731 -1.7731 -1.7445 -1.7445 -1.5961 -1.5961 -1.5327 -1.5327 -1.4909 -1.4909 -1.4616 -1.4616 -1.2491 -1.2491 -1.2236 -1.2236 -1.2171 -1.2171 -0.6661 -0.6661 -0.6638 -0.6638 -0.6321 -0.6321 -0.6034 -0.6034 -0.5960 -0.5960 -0.5715 -0.5715 -0.2124 -0.2124 -0.1365 -0.1365 -0.0988 -0.0988 -0.0440 -0.0440 2.6861 2.6861 2.6961 2.6961 5.1518 5.1518 5.5296 5.5296 5.8293 5.8293 6.1280 6.1280 7.4883 7.4883 7.4940 7.4940 k = 0.3333 0.5774 0.0233 ( 13461 PWs) bands (ev): -15.0186 -15.0186 -15.0185 -15.0185 -13.9277 -13.9277 -13.8816 -13.8816 -13.7866 -13.7866 -13.7645 -13.7645 -13.2824 -13.2824 -13.2822 -13.2822 -12.9513 -12.9513 -12.9513 -12.9513 -7.7853 -7.7853 -7.7845 -7.7845 -4.4161 -4.4161 -4.2499 -4.2499 -3.8535 -3.8535 -3.6602 -3.6602 -3.5439 -3.5439 -3.5182 -3.5182 -2.1781 -2.1781 -1.8933 -1.8933 -1.8611 -1.8611 -1.7734 -1.7734 -1.7449 -1.7449 -1.5992 -1.5992 -1.5308 -1.5308 -1.4891 -1.4891 -1.4593 -1.4593 -1.2479 -1.2479 -1.2223 -1.2223 -1.2172 -1.2172 -0.6660 -0.6660 -0.6647 -0.6647 -0.6325 -0.6325 -0.6023 -0.6023 -0.5958 -0.5958 -0.5698 -0.5698 -0.2126 -0.2126 -0.1372 -0.1372 -0.0994 -0.0994 -0.0446 -0.0446 2.6883 2.6883 2.6983 2.6983 5.1522 5.1522 5.5299 5.5299 5.8296 5.8296 6.1284 6.1284 7.4812 7.4812 7.4869 7.4869 k = 0.3333 0.5774 0.0467 ( 13458 PWs) bands (ev): -15.0182 -15.0182 -15.0182 -15.0182 -13.9276 -13.9276 -13.8817 -13.8817 -13.7866 -13.7866 -13.7646 -13.7646 -13.2858 -13.2858 -13.2857 -13.2857 -12.9482 -12.9482 -12.9482 -12.9482 -7.7831 -7.7831 -7.7823 -7.7823 -4.4160 -4.4160 -4.2501 -4.2501 -3.8551 -3.8551 -3.6606 -3.6606 -3.5575 -3.5575 -3.5308 -3.5308 -2.1765 -2.1765 -1.8872 -1.8872 -1.8545 -1.8545 -1.7744 -1.7744 -1.7460 -1.7460 -1.6081 -1.6081 -1.5253 -1.5253 -1.4836 -1.4836 -1.4530 -1.4530 -1.2444 -1.2444 -1.2184 -1.2184 -1.2178 -1.2178 -0.6670 -0.6670 -0.6659 -0.6659 -0.6333 -0.6333 -0.5991 -0.5991 -0.5949 -0.5949 -0.5653 -0.5653 -0.2135 -0.2135 -0.1391 -0.1391 -0.1011 -0.1011 -0.0465 -0.0465 2.6947 2.6947 2.7047 2.7047 5.1532 5.1532 5.5309 5.5309 5.8304 5.8304 6.1298 6.1298 7.4599 7.4599 7.4658 7.4658 k = 0.3333 0.5774 0.0700 ( 13455 PWs) bands (ev): -15.0177 -15.0177 -15.0177 -15.0177 -13.9273 -13.9273 -13.8820 -13.8820 -13.7867 -13.7867 -13.7647 -13.7647 -13.2913 -13.2913 -13.2912 -13.2912 -12.9432 -12.9432 -12.9432 -12.9432 -7.7793 -7.7793 -7.7785 -7.7785 -4.4159 -4.4159 -4.2503 -4.2503 -3.8579 -3.8579 -3.6614 -3.6614 -3.5791 -3.5791 -3.5508 -3.5508 -2.1738 -2.1738 -1.8783 -1.8783 -1.8446 -1.8446 -1.7756 -1.7756 -1.7476 -1.7476 -1.6213 -1.6213 -1.5160 -1.5160 -1.4743 -1.4743 -1.4439 -1.4439 -1.2384 -1.2384 -1.2187 -1.2187 -1.2119 -1.2119 -0.6706 -0.6706 -0.6664 -0.6664 -0.6337 -0.6337 -0.5942 -0.5942 -0.5929 -0.5929 -0.5587 -0.5587 -0.2149 -0.2149 -0.1421 -0.1421 -0.1041 -0.1041 -0.0495 -0.0495 2.7054 2.7054 2.7153 2.7153 5.1549 5.1549 5.5325 5.5325 5.8316 5.8316 6.1320 6.1320 7.4253 7.4253 7.4314 7.4314 k = 0.3333 0.5774 0.0934 ( 13455 PWs) bands (ev): -15.0170 -15.0170 -15.0170 -15.0170 -13.9269 -13.9269 -13.8824 -13.8824 -13.7868 -13.7868 -13.7648 -13.7648 -13.2986 -13.2986 -13.2984 -13.2984 -12.9366 -12.9366 -12.9366 -12.9366 -7.7742 -7.7742 -7.7734 -7.7734 -4.4158 -4.4158 -4.2507 -4.2507 -3.8622 -3.8622 -3.6639 -3.6639 -3.6066 -3.6066 -3.5768 -3.5768 -2.1702 -2.1702 -1.8679 -1.8679 -1.8330 -1.8330 -1.7769 -1.7769 -1.7492 -1.7492 -1.6375 -1.6375 -1.5030 -1.5030 -1.4614 -1.4614 -1.4332 -1.4332 -1.2301 -1.2301 -1.2198 -1.2198 -1.2028 -1.2028 -0.6749 -0.6749 -0.6683 -0.6683 -0.6325 -0.6325 -0.5895 -0.5895 -0.5879 -0.5879 -0.5506 -0.5506 -0.2168 -0.2168 -0.1464 -0.1464 -0.1082 -0.1082 -0.0537 -0.0537 2.7202 2.7202 2.7300 2.7300 5.1573 5.1573 5.5346 5.5346 5.8333 5.8333 6.1351 6.1351 7.3785 7.3785 7.3849 7.3849 k = 0.3333 0.5774 0.1167 ( 13449 PWs) bands (ev): -15.0161 -15.0161 -15.0160 -15.0160 -13.9264 -13.9264 -13.8829 -13.8829 -13.7870 -13.7870 -13.7649 -13.7649 -13.3073 -13.3073 -13.3071 -13.3071 -12.9287 -12.9287 -12.9287 -12.9287 -7.7679 -7.7679 -7.7671 -7.7671 -4.4156 -4.4156 -4.2511 -4.2511 -3.8687 -3.8687 -3.6726 -3.6726 -3.6338 -3.6338 -3.6069 -3.6069 -2.1654 -2.1654 -1.8579 -1.8579 -1.8218 -1.8218 -1.7775 -1.7775 -1.7504 -1.7504 -1.6557 -1.6557 -1.4864 -1.4864 -1.4448 -1.4448 -1.4218 -1.4218 -1.2219 -1.2219 -1.2187 -1.2187 -1.1910 -1.1910 -0.6797 -0.6797 -0.6720 -0.6720 -0.6294 -0.6294 -0.5847 -0.5847 -0.5807 -0.5807 -0.5416 -0.5416 -0.2195 -0.2195 -0.1516 -0.1516 -0.1134 -0.1134 -0.0591 -0.0591 2.7390 2.7390 2.7487 2.7487 5.1602 5.1602 5.5372 5.5372 5.8352 5.8352 6.1388 6.1388 7.3210 7.3210 7.3279 7.3279 k = 0.3333 0.5774 0.1401 ( 13431 PWs) bands (ev): -15.0150 -15.0150 -15.0150 -15.0150 -13.9258 -13.9258 -13.8835 -13.8835 -13.7871 -13.7871 -13.7651 -13.7651 -13.3170 -13.3170 -13.3169 -13.3169 -12.9199 -12.9199 -12.9199 -12.9199 -7.7603 -7.7603 -7.7595 -7.7595 -4.4155 -4.4155 -4.2516 -4.2516 -3.8782 -3.8782 -3.6996 -3.6996 -3.6475 -3.6475 -3.6389 -3.6389 -2.1597 -2.1597 -1.8498 -1.8498 -1.8129 -1.8129 -1.7770 -1.7770 -1.7503 -1.7503 -1.6749 -1.6749 -1.4666 -1.4666 -1.4253 -1.4253 -1.4100 -1.4100 -1.2235 -1.2235 -1.2054 -1.2054 -1.1763 -1.1763 -0.6848 -0.6848 -0.6770 -0.6770 -0.6244 -0.6244 -0.5785 -0.5785 -0.5727 -0.5727 -0.5318 -0.5318 -0.2228 -0.2228 -0.1578 -0.1578 -0.1196 -0.1196 -0.0655 -0.0655 2.7615 2.7615 2.7711 2.7711 5.1635 5.1635 5.5403 5.5403 5.8374 5.8374 6.1433 6.1433 7.2544 7.2544 7.2620 7.2620 k = 0.3333 0.5774 0.1634 ( 13449 PWs) bands (ev): -15.0138 -15.0138 -15.0138 -15.0138 -13.9251 -13.9251 -13.8842 -13.8842 -13.7873 -13.7873 -13.7653 -13.7653 -13.3274 -13.3274 -13.3273 -13.3273 -12.9106 -12.9106 -12.9106 -12.9106 -7.7518 -7.7518 -7.7510 -7.7510 -4.4154 -4.4154 -4.2522 -4.2522 -3.8917 -3.8917 -3.7399 -3.7399 -3.6702 -3.6702 -3.6512 -3.6512 -2.1530 -2.1530 -1.8449 -1.8449 -1.8077 -1.8077 -1.7749 -1.7749 -1.7489 -1.7489 -1.6944 -1.6944 -1.4445 -1.4445 -1.4047 -1.4047 -1.3969 -1.3969 -1.2256 -1.2256 -1.1889 -1.1889 -1.1589 -1.1589 -0.6902 -0.6902 -0.6830 -0.6830 -0.6182 -0.6182 -0.5711 -0.5711 -0.5641 -0.5641 -0.5214 -0.5214 -0.2268 -0.2268 -0.1647 -0.1647 -0.1269 -0.1269 -0.0730 -0.0730 2.7875 2.7875 2.7970 2.7970 5.1672 5.1672 5.5438 5.5438 5.8395 5.8395 6.1482 6.1482 7.1806 7.1806 7.1890 7.1890 k = 0.3333 0.5774 0.1868 ( 13458 PWs) bands (ev): -15.0125 -15.0125 -15.0125 -15.0125 -13.9244 -13.9244 -13.8850 -13.8850 -13.7875 -13.7875 -13.7655 -13.7655 -13.3382 -13.3382 -13.3381 -13.3381 -12.9009 -12.9009 -12.9009 -12.9009 -7.7425 -7.7425 -7.7417 -7.7417 -4.4155 -4.4155 -4.2529 -4.2529 -3.9104 -3.9104 -3.7846 -3.7846 -3.6984 -3.6984 -3.6524 -3.6524 -2.1452 -2.1452 -1.8432 -1.8432 -1.8065 -1.8065 -1.7715 -1.7715 -1.7480 -1.7480 -1.7122 -1.7122 -1.4210 -1.4210 -1.3900 -1.3900 -1.3771 -1.3771 -1.2280 -1.2280 -1.1693 -1.1693 -1.1385 -1.1385 -0.6959 -0.6959 -0.6898 -0.6898 -0.6110 -0.6110 -0.5624 -0.5624 -0.5550 -0.5550 -0.5106 -0.5106 -0.2316 -0.2316 -0.1722 -0.1722 -0.1351 -0.1351 -0.0815 -0.0815 2.8167 2.8167 2.8260 2.8260 5.1711 5.1711 5.5475 5.5475 5.8415 5.8415 6.1535 6.1535 7.1014 7.1014 7.1110 7.1110 k = 0.3333 0.5774 0.2101 ( 13437 PWs) bands (ev): -15.0112 -15.0112 -15.0111 -15.0111 -13.9235 -13.9235 -13.8859 -13.8859 -13.7878 -13.7878 -13.7657 -13.7657 -13.3491 -13.3491 -13.3490 -13.3490 -12.8913 -12.8913 -12.8913 -12.8913 -7.7326 -7.7326 -7.7318 -7.7318 -4.4156 -4.4156 -4.2536 -4.2536 -3.9349 -3.9349 -3.8307 -3.8307 -3.7216 -3.7216 -3.6528 -3.6528 -2.1365 -2.1365 -1.8442 -1.8442 -1.8082 -1.8082 -1.7673 -1.7673 -1.7542 -1.7542 -1.7223 -1.7223 -1.3973 -1.3973 -1.3790 -1.3790 -1.3542 -1.3542 -1.2306 -1.2306 -1.1465 -1.1465 -1.1153 -1.1153 -0.7018 -0.7018 -0.6971 -0.6971 -0.6032 -0.6032 -0.5527 -0.5527 -0.5454 -0.5454 -0.4994 -0.4994 -0.2372 -0.2372 -0.1801 -0.1801 -0.1441 -0.1441 -0.0908 -0.0908 2.8485 2.8485 2.8577 2.8577 5.1752 5.1752 5.5514 5.5514 5.8431 5.8431 6.1590 6.1590 7.0188 7.0188 7.0298 7.0298 k = 0.3333 0.5774 0.2334 ( 13449 PWs) bands (ev): -15.0098 -15.0098 -15.0097 -15.0097 -13.9226 -13.9226 -13.8868 -13.8868 -13.7880 -13.7880 -13.7660 -13.7660 -13.3598 -13.3598 -13.3597 -13.3597 -12.8819 -12.8819 -12.8818 -12.8818 -7.7223 -7.7223 -7.7215 -7.7215 -4.4160 -4.4160 -4.2543 -4.2543 -3.9645 -3.9645 -3.8765 -3.8765 -3.7393 -3.7393 -3.6528 -3.6528 -2.1268 -2.1268 -1.8468 -1.8468 -1.8118 -1.8118 -1.7705 -1.7705 -1.7632 -1.7632 -1.7228 -1.7228 -1.3745 -1.3745 -1.3688 -1.3688 -1.3322 -1.3322 -1.2334 -1.2334 -1.1204 -1.1204 -1.0896 -1.0896 -0.7080 -0.7080 -0.7049 -0.7049 -0.5949 -0.5949 -0.5424 -0.5424 -0.5354 -0.5354 -0.4878 -0.4878 -0.2434 -0.2434 -0.1882 -0.1882 -0.1539 -0.1539 -0.1010 -0.1010 2.8823 2.8823 2.8914 2.8914 5.1792 5.1792 5.5554 5.5554 5.8441 5.8441 6.1645 6.1645 6.9348 6.9348 6.9476 6.9476 k = 0.3333 0.5774 0.2568 ( 13467 PWs) bands (ev): -15.0083 -15.0083 -15.0083 -15.0083 -13.9217 -13.9217 -13.8878 -13.8878 -13.7883 -13.7883 -13.7662 -13.7662 -13.3701 -13.3701 -13.3700 -13.3700 -12.8728 -12.8728 -12.8728 -12.8728 -7.7119 -7.7119 -7.7111 -7.7111 -4.4165 -4.4165 -4.2550 -4.2550 -3.9975 -3.9975 -3.9209 -3.9209 -3.7522 -3.7522 -3.6527 -3.6527 -2.1162 -2.1162 -1.8504 -1.8504 -1.8166 -1.8166 -1.7903 -1.7903 -1.7594 -1.7594 -1.7201 -1.7201 -1.3593 -1.3593 -1.3534 -1.3534 -1.3125 -1.3125 -1.2362 -1.2362 -1.0915 -1.0915 -1.0616 -1.0616 -0.7147 -0.7147 -0.7132 -0.7132 -0.5863 -0.5863 -0.5315 -0.5315 -0.5252 -0.5252 -0.4761 -0.4761 -0.2504 -0.2504 -0.1964 -0.1964 -0.1643 -0.1643 -0.1117 -0.1117 2.9176 2.9176 2.9265 2.9265 5.1830 5.1830 5.5594 5.5594 5.8443 5.8443 6.1699 6.1699 6.8513 6.8513 6.8663 6.8663 k = 0.3333 0.5774 0.2801 ( 13470 PWs) bands (ev): -15.0070 -15.0070 -15.0069 -15.0069 -13.9207 -13.9207 -13.8888 -13.8888 -13.7885 -13.7885 -13.7665 -13.7665 -13.3798 -13.3798 -13.3796 -13.3796 -12.8644 -12.8644 -12.8643 -12.8643 -7.7017 -7.7017 -7.7009 -7.7009 -4.4173 -4.4173 -4.2556 -4.2556 -4.0320 -4.0320 -3.9629 -3.9629 -3.7613 -3.7613 -3.6525 -3.6525 -2.1046 -2.1046 -1.8545 -1.8545 -1.8235 -1.8235 -1.8093 -1.8093 -1.7562 -1.7562 -1.7171 -1.7171 -1.3504 -1.3504 -1.3344 -1.3344 -1.2955 -1.2955 -1.2388 -1.2388 -1.0605 -1.0605 -1.0322 -1.0322 -0.7222 -0.7222 -0.7218 -0.7218 -0.5774 -0.5774 -0.5207 -0.5207 -0.5148 -0.5148 -0.4642 -0.4642 -0.2577 -0.2577 -0.2045 -0.2045 -0.1751 -0.1751 -0.1229 -0.1229 2.9535 2.9535 2.9622 2.9622 5.1865 5.1865 5.5633 5.5633 5.8434 5.8434 6.1748 6.1748 6.7703 6.7703 6.7879 6.7879 k = 0.3333 0.5774 0.3035 ( 13506 PWs) bands (ev): -15.0056 -15.0056 -15.0056 -15.0056 -13.9197 -13.9197 -13.8898 -13.8898 -13.7888 -13.7888 -13.7667 -13.7667 -13.3887 -13.3887 -13.3886 -13.3886 -12.8566 -12.8566 -12.8566 -12.8566 -7.6919 -7.6919 -7.6910 -7.6910 -4.4184 -4.4184 -4.2563 -4.2563 -4.0659 -4.0659 -4.0015 -4.0015 -3.7678 -3.7678 -3.6522 -3.6522 -2.0922 -2.0922 -1.8586 -1.8586 -1.8383 -1.8383 -1.8208 -1.8208 -1.7536 -1.7536 -1.7144 -1.7144 -1.3421 -1.3421 -1.3179 -1.3179 -1.2820 -1.2820 -1.2407 -1.2407 -1.0285 -1.0285 -1.0020 -1.0020 -0.7318 -0.7318 -0.7297 -0.7297 -0.5685 -0.5685 -0.5101 -0.5101 -0.5043 -0.5043 -0.4523 -0.4523 -0.2652 -0.2652 -0.2125 -0.2125 -0.1861 -0.1861 -0.1344 -0.1344 2.9891 2.9891 2.9977 2.9977 5.1895 5.1895 5.5669 5.5669 5.8414 5.8414 6.1792 6.1792 6.6937 6.6937 6.7143 6.7143 k = 0.3333 0.5774 0.3268 ( 13500 PWs) bands (ev): -15.0044 -15.0044 -15.0044 -15.0044 -13.9187 -13.9187 -13.8908 -13.8908 -13.7890 -13.7890 -13.7670 -13.7670 -13.3967 -13.3967 -13.3966 -13.3966 -12.8497 -12.8497 -12.8497 -12.8497 -7.6827 -7.6827 -7.6818 -7.6818 -4.4198 -4.4198 -4.2568 -4.2568 -4.0979 -4.0979 -4.0360 -4.0360 -3.7723 -3.7723 -3.6520 -3.6520 -2.0788 -2.0788 -1.8626 -1.8626 -1.8585 -1.8585 -1.8265 -1.8265 -1.7515 -1.7515 -1.7122 -1.7122 -1.3342 -1.3342 -1.3038 -1.3038 -1.2725 -1.2725 -1.2412 -1.2412 -0.9963 -0.9963 -0.9720 -0.9720 -0.7423 -0.7423 -0.7383 -0.7383 -0.5595 -0.5595 -0.5004 -0.5004 -0.4939 -0.4939 -0.4407 -0.4407 -0.2724 -0.2724 -0.2203 -0.2203 -0.1970 -0.1970 -0.1459 -0.1459 3.0233 3.0233 3.0317 3.0317 5.1920 5.1920 5.5703 5.5703 5.8382 5.8382 6.1826 6.1826 6.6235 6.6235 6.6473 6.6473 k = 0.3333 0.5774 0.3502 ( 13467 PWs) bands (ev): -15.0033 -15.0033 -15.0033 -15.0033 -13.9178 -13.9178 -13.8917 -13.8917 -13.7893 -13.7893 -13.7672 -13.7672 -13.4036 -13.4036 -13.4035 -13.4035 -12.8436 -12.8436 -12.8436 -12.8436 -7.6744 -7.6744 -7.6736 -7.6736 -4.4213 -4.4213 -4.2573 -4.2573 -4.1267 -4.1267 -4.0660 -4.0660 -3.7756 -3.7756 -3.6517 -3.6517 -2.0646 -2.0646 -1.8795 -1.8795 -1.8662 -1.8662 -1.8307 -1.8307 -1.7499 -1.7499 -1.7106 -1.7106 -1.3270 -1.3270 -1.2921 -1.2921 -1.2679 -1.2679 -1.2392 -1.2392 -0.9648 -0.9648 -0.9427 -0.9427 -0.7538 -0.7538 -0.7479 -0.7479 -0.5509 -0.5509 -0.4917 -0.4917 -0.4840 -0.4840 -0.4296 -0.4296 -0.2790 -0.2790 -0.2277 -0.2277 -0.2076 -0.2076 -0.1570 -0.1570 3.0550 3.0550 3.0633 3.0633 5.1939 5.1939 5.5733 5.5733 5.8339 5.8339 6.1850 6.1850 6.5614 6.5614 6.5885 6.5885 k = 0.3333 0.5774 0.3735 ( 13467 PWs) bands (ev): -15.0024 -15.0024 -15.0023 -15.0023 -13.9169 -13.9169 -13.8926 -13.8926 -13.7895 -13.7895 -13.7674 -13.7674 -13.4095 -13.4095 -13.4094 -13.4094 -12.8386 -12.8386 -12.8386 -12.8386 -7.6673 -7.6673 -7.6664 -7.6664 -4.4230 -4.4230 -4.2577 -4.2577 -4.1513 -4.1513 -4.0909 -4.0909 -3.7779 -3.7779 -3.6515 -3.6515 -2.0496 -2.0496 -1.9003 -1.9003 -1.8693 -1.8693 -1.8341 -1.8341 -1.7488 -1.7488 -1.7093 -1.7093 -1.3204 -1.3204 -1.2827 -1.2827 -1.2674 -1.2674 -1.2352 -1.2352 -0.9347 -0.9347 -0.9148 -0.9148 -0.7665 -0.7665 -0.7587 -0.7587 -0.5428 -0.5428 -0.4846 -0.4846 -0.4748 -0.4748 -0.4193 -0.4193 -0.2847 -0.2847 -0.2345 -0.2345 -0.2174 -0.2174 -0.1674 -0.1674 3.0830 3.0830 3.0912 3.0912 5.1953 5.1953 5.5759 5.5759 5.8288 5.8288 6.1861 6.1861 6.5091 6.5091 6.5392 6.5392 k = 0.3333 0.5774 0.3969 ( 13446 PWs) bands (ev): -15.0016 -15.0016 -15.0016 -15.0016 -13.9162 -13.9162 -13.8934 -13.8934 -13.7896 -13.7896 -13.7675 -13.7675 -13.4141 -13.4141 -13.4140 -13.4140 -12.8346 -12.8346 -12.8346 -12.8346 -7.6615 -7.6615 -7.6607 -7.6607 -4.4245 -4.4245 -4.2579 -4.2579 -4.1711 -4.1711 -4.1104 -4.1104 -3.7794 -3.7794 -3.6514 -3.6514 -2.0339 -2.0339 -1.9207 -1.9207 -1.8718 -1.8718 -1.8368 -1.8368 -1.7479 -1.7479 -1.7084 -1.7084 -1.3145 -1.3145 -1.2755 -1.2755 -1.2691 -1.2691 -1.2308 -1.2308 -0.9064 -0.9064 -0.8888 -0.8888 -0.7806 -0.7806 -0.7707 -0.7707 -0.5356 -0.5356 -0.4793 -0.4793 -0.4668 -0.4668 -0.4104 -0.4104 -0.2891 -0.2891 -0.2404 -0.2404 -0.2259 -0.2259 -0.1764 -0.1764 3.1063 3.1063 3.1144 3.1144 5.1962 5.1962 5.5780 5.5780 5.8237 5.8237 6.1861 6.1861 6.4678 6.4678 6.5003 6.5003 k = 0.3333 0.5774 0.4202 ( 13428 PWs) bands (ev): -15.0011 -15.0011 -15.0010 -15.0010 -13.9156 -13.9156 -13.8940 -13.8940 -13.7897 -13.7897 -13.7677 -13.7677 -13.4174 -13.4174 -13.4173 -13.4173 -12.8318 -12.8318 -12.8318 -12.8318 -7.6573 -7.6573 -7.6564 -7.6564 -4.4258 -4.4258 -4.2581 -4.2581 -4.1856 -4.1856 -4.1245 -4.1245 -3.7805 -3.7805 -3.6512 -3.6512 -2.0176 -2.0176 -1.9403 -1.9403 -1.8736 -1.8736 -1.8388 -1.8388 -1.7474 -1.7474 -1.7078 -1.7078 -1.3097 -1.3097 -1.2715 -1.2715 -1.2704 -1.2704 -1.2273 -1.2273 -0.8804 -0.8804 -0.8652 -0.8652 -0.7962 -0.7962 -0.7840 -0.7840 -0.5298 -0.5298 -0.4757 -0.4757 -0.4605 -0.4605 -0.4033 -0.4033 -0.2921 -0.2921 -0.2451 -0.2451 -0.2325 -0.2325 -0.1836 -0.1836 3.1237 3.1237 3.1318 3.1318 5.1967 5.1967 5.5796 5.5796 5.8192 5.8192 6.1853 6.1853 6.4383 6.4383 6.4722 6.4722 k = 0.3333 0.5774 0.4436 ( 13437 PWs) bands (ev): -15.0007 -15.0007 -15.0007 -15.0007 -13.9153 -13.9153 -13.8943 -13.8943 -13.7898 -13.7898 -13.7677 -13.7677 -13.4194 -13.4194 -13.4194 -13.4194 -12.8300 -12.8300 -12.8300 -12.8300 -7.6547 -7.6547 -7.6538 -7.6538 -4.4267 -4.4267 -4.2582 -4.2582 -4.1945 -4.1945 -4.1329 -4.1329 -3.7811 -3.7811 -3.6512 -3.6512 -2.0014 -2.0014 -1.9586 -1.9586 -1.8747 -1.8747 -1.8399 -1.8399 -1.7470 -1.7470 -1.7075 -1.7075 -1.3064 -1.3064 -1.2735 -1.2735 -1.2673 -1.2673 -1.2251 -1.2251 -0.8569 -0.8569 -0.8452 -0.8452 -0.8133 -0.8133 -0.7977 -0.7977 -0.5260 -0.5260 -0.4737 -0.4737 -0.4564 -0.4564 -0.3987 -0.3987 -0.2938 -0.2938 -0.2482 -0.2482 -0.2368 -0.2368 -0.1882 -0.1882 3.1346 3.1346 3.1426 3.1426 5.1970 5.1970 5.5805 5.5805 5.8161 5.8161 6.1843 6.1843 6.4207 6.4207 6.4554 6.4554 k = 0.3333 0.5774 0.4669 ( 13440 PWs) bands (ev): -15.0006 -15.0006 -15.0006 -15.0006 -13.9151 -13.9151 -13.8944 -13.8944 -13.7898 -13.7898 -13.7678 -13.7678 -13.4201 -13.4201 -13.4201 -13.4201 -12.8295 -12.8295 -12.8295 -12.8295 -7.6538 -7.6538 -7.6529 -7.6529 -4.4270 -4.4270 -4.2582 -4.2582 -4.1975 -4.1975 -4.1358 -4.1358 -3.7813 -3.7813 -3.6511 -3.6511 -1.9910 -1.9910 -1.9697 -1.9697 -1.8751 -1.8751 -1.8403 -1.8403 -1.7469 -1.7469 -1.7074 -1.7074 -1.3052 -1.3052 -1.2742 -1.2742 -1.2663 -1.2663 -1.2243 -1.2243 -0.8409 -0.8409 -0.8347 -0.8347 -0.8271 -0.8271 -0.8061 -0.8061 -0.5247 -0.5247 -0.4731 -0.4731 -0.4550 -0.4550 -0.3971 -0.3971 -0.2944 -0.2944 -0.2492 -0.2492 -0.2383 -0.2383 -0.1898 -0.1898 3.1383 3.1383 3.1462 3.1462 5.1970 5.1970 5.5808 5.5808 5.8150 5.8150 6.1839 6.1839 6.4149 6.4149 6.4497 6.4497 Writing output data file SbCl5.save init_run : 0.42s CPU 0.51s WALL ( 1 calls) electrons : 378.97s CPU 382.65s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.03s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 378.96s CPU 382.64s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.16s CPU 0.19s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.15s WALL ( 207 calls) cegterg : 347.27s CPU 349.91s WALL ( 249 calls) Called by sum_band: Called by *egterg: h_psi : 206.48s CPU 209.43s WALL ( 3826 calls) s_psi : 25.75s CPU 25.72s WALL ( 3826 calls) g_psi : 0.40s CPU 0.40s WALL ( 3370 calls) cdiaghg : 94.69s CPU 94.95s WALL ( 3577 calls) cegterg:over : 18.74s CPU 18.66s WALL ( 3370 calls) cegterg:upda : 13.34s CPU 13.30s WALL ( 3370 calls) cegterg:last : 7.92s CPU 7.94s WALL ( 663 calls) cdiaghg:chol : 4.32s CPU 4.34s WALL ( 3577 calls) cdiaghg:inve : 3.21s CPU 3.29s WALL ( 3577 calls) cdiaghg:para : 6.53s CPU 6.44s WALL ( 7154 calls) Called by h_psi: h_psi:vloc : 162.07s CPU 164.93s WALL ( 3826 calls) h_psi:vnl : 44.04s CPU 44.06s WALL ( 3826 calls) add_vuspsi : 23.95s CPU 23.81s WALL ( 3826 calls) General routines calbec : 20.06s CPU 20.24s WALL ( 3826 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 154.79s CPU 157.45s WALL ( 849804 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.38s WALL ( 414 calls) Parallel routines fft_scatter : 94.36s CPU 95.70s WALL ( 849827 calls) PWSCF : 7m10.72s CPU 7m31.30s WALL This run was terminated on: 8:44:47 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=