Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 5:45:17 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: ./K3N.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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 66 36 10 3636 1466 214 Max 67 37 11 3645 1489 219 Sum 4807 2635 745 262023 106351 15571 bravais-lattice index = 14 lattice parameter (alat) = 14.7361 a.u. unit-cell volume = 2698.0488 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.736083 celldm(2)= 1.000000 celldm(3)= 0.973583 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 0.973583 ) 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 1.027134 ) PseudoPot. # 1 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 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 N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd 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 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential K 9.00 39.09830 K( 1.00) N 5.00 14.00670 N( 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 [0,1,0] 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 [1,-1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [2,1,0] cryst. s( 6) = ( 1 1 0 ) ( 0 -1 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 [0,1,0] 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 [1,-1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( -0.5000000 0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(12) = ( -1 -1 0 ) ( 0 1 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 -6 -5 180 deg rotation - cart. axis [0,1,0] 3C2' 5 6 -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 -12 -11 inv. 180 deg rotation - cart. axis [0,1,0] 3s_v 11 12 -8 inv. 180 deg rotation - cryst. axis [1,-1,0] Cartesian axes number of k points= 202 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 2) = ( 0.0208333 0.0120281 -0.0000000), wk = 0.0049505 k( 3) = ( 0.0416667 0.0240563 -0.0000000), wk = 0.0049505 k( 4) = ( 0.0625000 0.0360844 -0.0000000), wk = 0.0049505 k( 5) = ( 0.0833333 0.0481125 -0.0000000), wk = 0.0049505 k( 6) = ( 0.1041667 0.0601407 -0.0000000), wk = 0.0049505 k( 7) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0049505 k( 8) = ( 0.1458333 0.0841969 -0.0000000), wk = 0.0049505 k( 9) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0049505 k( 10) = ( 0.1875000 0.1082532 -0.0000000), wk = 0.0049505 k( 11) = ( 0.2083333 0.1202813 -0.0000000), wk = 0.0049505 k( 12) = ( 0.2291667 0.1323094 -0.0000000), wk = 0.0049505 k( 13) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0049505 k( 14) = ( 0.2708333 0.1563657 -0.0000000), wk = 0.0049505 k( 15) = ( 0.2916667 0.1683938 -0.0000000), wk = 0.0049505 k( 16) = ( 0.3125000 0.1804220 -0.0000000), wk = 0.0049505 k( 17) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0049505 k( 18) = ( 0.3541667 0.2044782 -0.0000000), wk = 0.0049505 k( 19) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0049505 k( 20) = ( 0.3958333 0.2285345 -0.0000000), wk = 0.0049505 k( 21) = ( 0.4166667 0.2405626 -0.0000000), wk = 0.0049505 k( 22) = ( 0.4375000 0.2525907 -0.0000000), wk = 0.0049505 k( 23) = ( 0.4583333 0.2646189 -0.0000000), wk = 0.0049505 k( 24) = ( 0.4791667 0.2766470 -0.0000000), wk = 0.0049505 k( 25) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0049505 k( 26) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0049505 k( 27) = ( 0.4880952 0.3092948 -0.0000000), wk = 0.0049505 k( 28) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0049505 k( 29) = ( 0.4642857 0.3505341 -0.0000000), wk = 0.0049505 k( 30) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0049505 k( 31) = ( 0.4404762 0.3917734 -0.0000000), wk = 0.0049505 k( 32) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0049505 k( 33) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0049505 k( 34) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0049505 k( 35) = ( 0.3928571 0.4742520 -0.0000000), wk = 0.0049505 k( 36) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0049505 k( 37) = ( 0.3690476 0.5154913 -0.0000000), wk = 0.0049505 k( 38) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0049505 k( 39) = ( 0.3452381 0.5567306 -0.0000000), wk = 0.0049505 k( 40) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0049505 k( 41) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0049505 k( 42) = ( 0.3209877 0.5559669 -0.0000000), wk = 0.0049505 k( 43) = ( 0.3086420 0.5345836 -0.0000000), wk = 0.0049505 k( 44) = ( 0.2962963 0.5132002 -0.0000000), wk = 0.0049505 k( 45) = ( 0.2839506 0.4918169 -0.0000000), wk = 0.0049505 k( 46) = ( 0.2716049 0.4704336 -0.0000000), wk = 0.0049505 k( 47) = ( 0.2592593 0.4490502 -0.0000000), wk = 0.0049505 k( 48) = ( 0.2469136 0.4276669 -0.0000000), wk = 0.0049505 k( 49) = ( 0.2345679 0.4062835 -0.0000000), wk = 0.0049505 k( 50) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0049505 k( 51) = ( 0.2098765 0.3635168 -0.0000000), wk = 0.0049505 k( 52) = ( 0.1975309 0.3421335 -0.0000000), wk = 0.0049505 k( 53) = ( 0.1851852 0.3207502 -0.0000000), wk = 0.0049505 k( 54) = ( 0.1728395 0.2993668 -0.0000000), wk = 0.0049505 k( 55) = ( 0.1604938 0.2779835 -0.0000000), wk = 0.0049505 k( 56) = ( 0.1481482 0.2566001 -0.0000000), wk = 0.0049505 k( 57) = ( 0.1358025 0.2352168 -0.0000000), wk = 0.0049505 k( 58) = ( 0.1234568 0.2138334 -0.0000000), wk = 0.0049505 k( 59) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0049505 k( 60) = ( 0.0987654 0.1710667 -0.0000000), wk = 0.0049505 k( 61) = ( 0.0864198 0.1496834 -0.0000000), wk = 0.0049505 k( 62) = ( 0.0740741 0.1283001 -0.0000000), wk = 0.0049505 k( 63) = ( 0.0617284 0.1069167 -0.0000000), wk = 0.0049505 k( 64) = ( 0.0493827 0.0855334 -0.0000000), wk = 0.0049505 k( 65) = ( 0.0370370 0.0641500 -0.0000000), wk = 0.0049505 k( 66) = ( 0.0246914 0.0427667 -0.0000000), wk = 0.0049505 k( 67) = ( 0.0123457 0.0213833 -0.0000000), wk = 0.0049505 k( 68) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 69) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 70) = ( 0.0000000 0.0000000 0.0244556), wk = 0.0049505 k( 71) = ( 0.0000000 0.0000000 0.0489111), wk = 0.0049505 k( 72) = ( 0.0000000 0.0000000 0.0733667), wk = 0.0049505 k( 73) = ( 0.0000000 0.0000000 0.0978223), wk = 0.0049505 k( 74) = ( 0.0000000 0.0000000 0.1222778), wk = 0.0049505 k( 75) = ( 0.0000000 0.0000000 0.1467334), wk = 0.0049505 k( 76) = ( 0.0000000 0.0000000 0.1711890), wk = 0.0049505 k( 77) = ( 0.0000000 0.0000000 0.1956445), wk = 0.0049505 k( 78) = ( 0.0000000 0.0000000 0.2201001), wk = 0.0049505 k( 79) = ( 0.0000000 0.0000000 0.2445557), wk = 0.0049505 k( 80) = ( 0.0000000 0.0000000 0.2690112), wk = 0.0049505 k( 81) = ( 0.0000000 0.0000000 0.2934668), wk = 0.0049505 k( 82) = ( 0.0000000 0.0000000 0.3179224), wk = 0.0049505 k( 83) = ( 0.0000000 0.0000000 0.3423779), wk = 0.0049505 k( 84) = ( 0.0000000 0.0000000 0.3668335), wk = 0.0049505 k( 85) = ( 0.0000000 0.0000000 0.3912891), wk = 0.0049505 k( 86) = ( 0.0000000 0.0000000 0.4157446), wk = 0.0049505 k( 87) = ( 0.0000000 0.0000000 0.4402002), wk = 0.0049505 k( 88) = ( 0.0000000 0.0000000 0.4646558), wk = 0.0049505 k( 89) = ( 0.0000000 0.0000000 0.4891113), wk = 0.0049505 k( 90) = ( 0.0000000 0.0000000 0.5135669), wk = 0.0049505 k( 91) = ( 0.0000000 0.0000000 0.5135669), wk = 0.0049505 k( 92) = ( 0.0208333 0.0120281 0.5135669), wk = 0.0049505 k( 93) = ( 0.0416667 0.0240563 0.5135669), wk = 0.0049505 k( 94) = ( 0.0625000 0.0360844 0.5135669), wk = 0.0049505 k( 95) = ( 0.0833333 0.0481125 0.5135669), wk = 0.0049505 k( 96) = ( 0.1041667 0.0601407 0.5135669), wk = 0.0049505 k( 97) = ( 0.1250000 0.0721688 0.5135669), wk = 0.0049505 k( 98) = ( 0.1458333 0.0841969 0.5135669), wk = 0.0049505 k( 99) = ( 0.1666667 0.0962250 0.5135669), wk = 0.0049505 k( 100) = ( 0.1875000 0.1082532 0.5135669), wk = 0.0049505 k( 101) = ( 0.2083333 0.1202813 0.5135669), wk = 0.0049505 k( 102) = ( 0.2291667 0.1323094 0.5135669), wk = 0.0049505 k( 103) = ( 0.2500000 0.1443376 0.5135669), wk = 0.0049505 k( 104) = ( 0.2708333 0.1563657 0.5135669), wk = 0.0049505 k( 105) = ( 0.2916667 0.1683938 0.5135669), wk = 0.0049505 k( 106) = ( 0.3125000 0.1804220 0.5135669), wk = 0.0049505 k( 107) = ( 0.3333333 0.1924501 0.5135669), wk = 0.0049505 k( 108) = ( 0.3541667 0.2044782 0.5135669), wk = 0.0049505 k( 109) = ( 0.3750000 0.2165064 0.5135669), wk = 0.0049505 k( 110) = ( 0.3958333 0.2285345 0.5135669), wk = 0.0049505 k( 111) = ( 0.4166667 0.2405626 0.5135669), wk = 0.0049505 k( 112) = ( 0.4375000 0.2525907 0.5135669), wk = 0.0049505 k( 113) = ( 0.4583333 0.2646189 0.5135669), wk = 0.0049505 k( 114) = ( 0.4791667 0.2766470 0.5135669), wk = 0.0049505 k( 115) = ( 0.5000000 0.2886751 0.5135669), wk = 0.0049505 k( 116) = ( 0.5000000 0.2886751 0.5135669), wk = 0.0049505 k( 117) = ( 0.4880952 0.3092948 0.5135669), wk = 0.0049505 k( 118) = ( 0.4761905 0.3299144 0.5135669), wk = 0.0049505 k( 119) = ( 0.4642857 0.3505341 0.5135669), wk = 0.0049505 k( 120) = ( 0.4523810 0.3711537 0.5135669), wk = 0.0049505 k( 121) = ( 0.4404762 0.3917734 0.5135669), wk = 0.0049505 k( 122) = ( 0.4285714 0.4123930 0.5135669), wk = 0.0049505 k( 123) = ( 0.4166667 0.4330127 0.5135669), wk = 0.0049505 k( 124) = ( 0.4047619 0.4536324 0.5135669), wk = 0.0049505 k( 125) = ( 0.3928571 0.4742520 0.5135669), wk = 0.0049505 k( 126) = ( 0.3809524 0.4948717 0.5135669), wk = 0.0049505 k( 127) = ( 0.3690476 0.5154913 0.5135669), wk = 0.0049505 k( 128) = ( 0.3571429 0.5361110 0.5135669), wk = 0.0049505 k( 129) = ( 0.3452381 0.5567306 0.5135669), wk = 0.0049505 k( 130) = ( 0.3333333 0.5773503 0.5135669), wk = 0.0049505 k( 131) = ( 0.3333333 0.5773503 0.5135669), wk = 0.0049505 k( 132) = ( 0.3209877 0.5559669 0.5135669), wk = 0.0049505 k( 133) = ( 0.3086420 0.5345836 0.5135669), wk = 0.0049505 k( 134) = ( 0.2962963 0.5132002 0.5135669), wk = 0.0049505 k( 135) = ( 0.2839506 0.4918169 0.5135669), wk = 0.0049505 k( 136) = ( 0.2716049 0.4704336 0.5135669), wk = 0.0049505 k( 137) = ( 0.2592593 0.4490502 0.5135669), wk = 0.0049505 k( 138) = ( 0.2469136 0.4276669 0.5135669), wk = 0.0049505 k( 139) = ( 0.2345679 0.4062835 0.5135669), wk = 0.0049505 k( 140) = ( 0.2222222 0.3849002 0.5135669), wk = 0.0049505 k( 141) = ( 0.2098765 0.3635168 0.5135669), wk = 0.0049505 k( 142) = ( 0.1975309 0.3421335 0.5135669), wk = 0.0049505 k( 143) = ( 0.1851852 0.3207502 0.5135669), wk = 0.0049505 k( 144) = ( 0.1728395 0.2993668 0.5135669), wk = 0.0049505 k( 145) = ( 0.1604938 0.2779835 0.5135669), wk = 0.0049505 k( 146) = ( 0.1481482 0.2566001 0.5135669), wk = 0.0049505 k( 147) = ( 0.1358025 0.2352168 0.5135669), wk = 0.0049505 k( 148) = ( 0.1234568 0.2138334 0.5135669), wk = 0.0049505 k( 149) = ( 0.1111111 0.1924501 0.5135669), wk = 0.0049505 k( 150) = ( 0.0987654 0.1710667 0.5135669), wk = 0.0049505 k( 151) = ( 0.0864198 0.1496834 0.5135669), wk = 0.0049505 k( 152) = ( 0.0740741 0.1283001 0.5135669), wk = 0.0049505 k( 153) = ( 0.0617284 0.1069167 0.5135669), wk = 0.0049505 k( 154) = ( 0.0493827 0.0855334 0.5135669), wk = 0.0049505 k( 155) = ( 0.0370370 0.0641500 0.5135669), wk = 0.0049505 k( 156) = ( 0.0246914 0.0427667 0.5135669), wk = 0.0049505 k( 157) = ( 0.0123457 0.0213833 0.5135669), wk = 0.0049505 k( 158) = ( 0.0000000 0.0000000 0.5135669), wk = 0.0049505 k( 159) = ( 0.5000000 0.2886751 0.5135669), wk = 0.0049505 k( 160) = ( 0.5000000 0.2886751 0.4891113), wk = 0.0049505 k( 161) = ( 0.5000000 0.2886751 0.4646558), wk = 0.0049505 k( 162) = ( 0.5000000 0.2886751 0.4402002), wk = 0.0049505 k( 163) = ( 0.5000000 0.2886751 0.4157446), wk = 0.0049505 k( 164) = ( 0.5000000 0.2886751 0.3912891), wk = 0.0049505 k( 165) = ( 0.5000000 0.2886751 0.3668335), wk = 0.0049505 k( 166) = ( 0.5000000 0.2886751 0.3423779), wk = 0.0049505 k( 167) = ( 0.5000000 0.2886751 0.3179224), wk = 0.0049505 k( 168) = ( 0.5000000 0.2886751 0.2934668), wk = 0.0049505 k( 169) = ( 0.5000000 0.2886751 0.2690112), wk = 0.0049505 k( 170) = ( 0.5000000 0.2886751 0.2445557), wk = 0.0049505 k( 171) = ( 0.5000000 0.2886751 0.2201001), wk = 0.0049505 k( 172) = ( 0.5000000 0.2886751 0.1956445), wk = 0.0049505 k( 173) = ( 0.5000000 0.2886751 0.1711890), wk = 0.0049505 k( 174) = ( 0.5000000 0.2886751 0.1467334), wk = 0.0049505 k( 175) = ( 0.5000000 0.2886751 0.1222778), wk = 0.0049505 k( 176) = ( 0.5000000 0.2886751 0.0978223), wk = 0.0049505 k( 177) = ( 0.5000000 0.2886751 0.0733667), wk = 0.0049505 k( 178) = ( 0.5000000 0.2886751 0.0489111), wk = 0.0049505 k( 179) = ( 0.5000000 0.2886751 0.0244556), wk = 0.0049505 k( 180) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0049505 k( 181) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0049505 k( 182) = ( 0.3333333 0.5773503 0.0244556), wk = 0.0049505 k( 183) = ( 0.3333333 0.5773503 0.0489111), wk = 0.0049505 k( 184) = ( 0.3333333 0.5773503 0.0733667), wk = 0.0049505 k( 185) = ( 0.3333333 0.5773503 0.0978223), wk = 0.0049505 k( 186) = ( 0.3333333 0.5773503 0.1222778), wk = 0.0049505 k( 187) = ( 0.3333333 0.5773503 0.1467334), wk = 0.0049505 k( 188) = ( 0.3333333 0.5773503 0.1711890), wk = 0.0049505 k( 189) = ( 0.3333333 0.5773503 0.1956445), wk = 0.0049505 k( 190) = ( 0.3333333 0.5773503 0.2201001), wk = 0.0049505 k( 191) = ( 0.3333333 0.5773503 0.2445557), wk = 0.0049505 k( 192) = ( 0.3333333 0.5773503 0.2690112), wk = 0.0049505 k( 193) = ( 0.3333333 0.5773503 0.2934668), wk = 0.0049505 k( 194) = ( 0.3333333 0.5773503 0.3179224), wk = 0.0049505 k( 195) = ( 0.3333333 0.5773503 0.3423779), wk = 0.0049505 k( 196) = ( 0.3333333 0.5773503 0.3668335), wk = 0.0049505 k( 197) = ( 0.3333333 0.5773503 0.3912891), wk = 0.0049505 k( 198) = ( 0.3333333 0.5773503 0.4157446), wk = 0.0049505 k( 199) = ( 0.3333333 0.5773503 0.4402002), wk = 0.0049505 k( 200) = ( 0.3333333 0.5773503 0.4646558), wk = 0.0049505 k( 201) = ( 0.3333333 0.5773503 0.4891113), wk = 0.0049505 k( 202) = ( 0.3333333 0.5773503 0.5135669), wk = 0.0049505 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 2) = ( 0.0208333 -0.0000000 -0.0000000), wk = 0.0049505 k( 3) = ( 0.0416667 -0.0000000 -0.0000000), wk = 0.0049505 k( 4) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0049505 k( 5) = ( 0.0833333 -0.0000000 -0.0000000), wk = 0.0049505 k( 6) = ( 0.1041667 -0.0000000 -0.0000000), wk = 0.0049505 k( 7) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0049505 k( 8) = ( 0.1458333 -0.0000000 -0.0000000), wk = 0.0049505 k( 9) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0049505 k( 10) = ( 0.1875000 0.0000000 -0.0000000), wk = 0.0049505 k( 11) = ( 0.2083333 -0.0000000 -0.0000000), wk = 0.0049505 k( 12) = ( 0.2291667 -0.0000000 -0.0000000), wk = 0.0049505 k( 13) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0049505 k( 14) = ( 0.2708333 -0.0000000 -0.0000000), wk = 0.0049505 k( 15) = ( 0.2916667 0.0000000 0.0000000), wk = 0.0049505 k( 16) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0049505 k( 17) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0049505 k( 18) = ( 0.3541667 -0.0000000 -0.0000000), wk = 0.0049505 k( 19) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0049505 k( 20) = ( 0.3958333 -0.0000000 -0.0000000), wk = 0.0049505 k( 21) = ( 0.4166667 0.0000000 -0.0000000), wk = 0.0049505 k( 22) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0049505 k( 23) = ( 0.4583333 -0.0000000 -0.0000000), wk = 0.0049505 k( 24) = ( 0.4791667 -0.0000000 -0.0000000), wk = 0.0049505 k( 25) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0049505 k( 26) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0049505 k( 27) = ( 0.4880952 0.0238095 -0.0000000), wk = 0.0049505 k( 28) = ( 0.4761905 0.0476191 -0.0000000), wk = 0.0049505 k( 29) = ( 0.4642857 0.0714286 -0.0000000), wk = 0.0049505 k( 30) = ( 0.4523810 0.0952381 -0.0000000), wk = 0.0049505 k( 31) = ( 0.4404762 0.1190476 -0.0000000), wk = 0.0049505 k( 32) = ( 0.4285714 0.1428571 0.0000000), wk = 0.0049505 k( 33) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0049505 k( 34) = ( 0.4047619 0.1904762 -0.0000000), wk = 0.0049505 k( 35) = ( 0.3928571 0.2142857 -0.0000000), wk = 0.0049505 k( 36) = ( 0.3809524 0.2380952 0.0000000), wk = 0.0049505 k( 37) = ( 0.3690476 0.2619048 -0.0000000), wk = 0.0049505 k( 38) = ( 0.3571429 0.2857143 -0.0000000), wk = 0.0049505 k( 39) = ( 0.3452381 0.3095238 0.0000000), wk = 0.0049505 k( 40) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0049505 k( 41) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0049505 k( 42) = ( 0.3209877 0.3209877 -0.0000000), wk = 0.0049505 k( 43) = ( 0.3086420 0.3086420 0.0000000), wk = 0.0049505 k( 44) = ( 0.2962963 0.2962963 0.0000000), wk = 0.0049505 k( 45) = ( 0.2839506 0.2839506 -0.0000000), wk = 0.0049505 k( 46) = ( 0.2716049 0.2716049 -0.0000000), wk = 0.0049505 k( 47) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0049505 k( 48) = ( 0.2469136 0.2469136 0.0000000), wk = 0.0049505 k( 49) = ( 0.2345679 0.2345679 0.0000000), wk = 0.0049505 k( 50) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0049505 k( 51) = ( 0.2098765 0.2098765 -0.0000000), wk = 0.0049505 k( 52) = ( 0.1975309 0.1975309 -0.0000000), wk = 0.0049505 k( 53) = ( 0.1851852 0.1851852 0.0000000), wk = 0.0049505 k( 54) = ( 0.1728395 0.1728395 -0.0000000), wk = 0.0049505 k( 55) = ( 0.1604938 0.1604938 0.0000000), wk = 0.0049505 k( 56) = ( 0.1481482 0.1481482 0.0000000), wk = 0.0049505 k( 57) = ( 0.1358025 0.1358025 -0.0000000), wk = 0.0049505 k( 58) = ( 0.1234568 0.1234568 0.0000000), wk = 0.0049505 k( 59) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0049505 k( 60) = ( 0.0987654 0.0987654 -0.0000000), wk = 0.0049505 k( 61) = ( 0.0864198 0.0864198 -0.0000000), wk = 0.0049505 k( 62) = ( 0.0740741 0.0740741 0.0000000), wk = 0.0049505 k( 63) = ( 0.0617284 0.0617284 0.0000000), wk = 0.0049505 k( 64) = ( 0.0493827 0.0493827 0.0000000), wk = 0.0049505 k( 65) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0049505 k( 66) = ( 0.0246914 0.0246914 0.0000000), wk = 0.0049505 k( 67) = ( 0.0123457 0.0123457 0.0000000), wk = 0.0049505 k( 68) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 69) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049505 k( 70) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0049505 k( 71) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0049505 k( 72) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0049505 k( 73) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0049505 k( 74) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0049505 k( 75) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0049505 k( 76) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0049505 k( 77) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0049505 k( 78) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0049505 k( 79) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0049505 k( 80) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0049505 k( 81) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0049505 k( 82) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0049505 k( 83) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0049505 k( 84) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0049505 k( 85) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0049505 k( 86) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0049505 k( 87) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0049505 k( 88) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0049505 k( 89) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0049505 k( 90) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049505 k( 91) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049505 k( 92) = ( 0.0208333 -0.0000000 0.5000000), wk = 0.0049505 k( 93) = ( 0.0416667 -0.0000000 0.5000000), wk = 0.0049505 k( 94) = ( 0.0625000 -0.0000000 0.5000000), wk = 0.0049505 k( 95) = ( 0.0833333 -0.0000000 0.5000000), wk = 0.0049505 k( 96) = ( 0.1041667 -0.0000000 0.5000000), wk = 0.0049505 k( 97) = ( 0.1250000 -0.0000000 0.5000000), wk = 0.0049505 k( 98) = ( 0.1458333 -0.0000000 0.5000000), wk = 0.0049505 k( 99) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0049505 k( 100) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0049505 k( 101) = ( 0.2083333 -0.0000000 0.5000000), wk = 0.0049505 k( 102) = ( 0.2291667 -0.0000000 0.5000000), wk = 0.0049505 k( 103) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0049505 k( 104) = ( 0.2708333 -0.0000000 0.5000000), wk = 0.0049505 k( 105) = ( 0.2916667 0.0000000 0.5000000), wk = 0.0049505 k( 106) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0049505 k( 107) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0049505 k( 108) = ( 0.3541667 -0.0000000 0.5000000), wk = 0.0049505 k( 109) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0049505 k( 110) = ( 0.3958333 -0.0000000 0.5000000), wk = 0.0049505 k( 111) = ( 0.4166667 0.0000000 0.5000000), wk = 0.0049505 k( 112) = ( 0.4375000 -0.0000000 0.5000000), wk = 0.0049505 k( 113) = ( 0.4583333 -0.0000000 0.5000000), wk = 0.0049505 k( 114) = ( 0.4791667 -0.0000000 0.5000000), wk = 0.0049505 k( 115) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 k( 116) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 k( 117) = ( 0.4880952 0.0238095 0.5000000), wk = 0.0049505 k( 118) = ( 0.4761905 0.0476191 0.5000000), wk = 0.0049505 k( 119) = ( 0.4642857 0.0714286 0.5000000), wk = 0.0049505 k( 120) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0049505 k( 121) = ( 0.4404762 0.1190476 0.5000000), wk = 0.0049505 k( 122) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0049505 k( 123) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0049505 k( 124) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0049505 k( 125) = ( 0.3928571 0.2142857 0.5000000), wk = 0.0049505 k( 126) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0049505 k( 127) = ( 0.3690476 0.2619048 0.5000000), wk = 0.0049505 k( 128) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0049505 k( 129) = ( 0.3452381 0.3095238 0.5000000), wk = 0.0049505 k( 130) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0049505 k( 131) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0049505 k( 132) = ( 0.3209877 0.3209877 0.5000000), wk = 0.0049505 k( 133) = ( 0.3086420 0.3086420 0.5000000), wk = 0.0049505 k( 134) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0049505 k( 135) = ( 0.2839506 0.2839506 0.5000000), wk = 0.0049505 k( 136) = ( 0.2716049 0.2716049 0.5000000), wk = 0.0049505 k( 137) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0049505 k( 138) = ( 0.2469136 0.2469136 0.5000000), wk = 0.0049505 k( 139) = ( 0.2345679 0.2345679 0.5000000), wk = 0.0049505 k( 140) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0049505 k( 141) = ( 0.2098765 0.2098765 0.5000000), wk = 0.0049505 k( 142) = ( 0.1975309 0.1975309 0.5000000), wk = 0.0049505 k( 143) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0049505 k( 144) = ( 0.1728395 0.1728395 0.5000000), wk = 0.0049505 k( 145) = ( 0.1604938 0.1604938 0.5000000), wk = 0.0049505 k( 146) = ( 0.1481482 0.1481482 0.5000000), wk = 0.0049505 k( 147) = ( 0.1358025 0.1358025 0.5000000), wk = 0.0049505 k( 148) = ( 0.1234568 0.1234568 0.5000000), wk = 0.0049505 k( 149) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0049505 k( 150) = ( 0.0987654 0.0987654 0.5000000), wk = 0.0049505 k( 151) = ( 0.0864198 0.0864198 0.5000000), wk = 0.0049505 k( 152) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0049505 k( 153) = ( 0.0617284 0.0617284 0.5000000), wk = 0.0049505 k( 154) = ( 0.0493827 0.0493827 0.5000000), wk = 0.0049505 k( 155) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0049505 k( 156) = ( 0.0246914 0.0246914 0.5000000), wk = 0.0049505 k( 157) = ( 0.0123457 0.0123457 0.5000000), wk = 0.0049505 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049505 k( 159) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0049505 k( 160) = ( 0.5000000 -0.0000000 0.4761905), wk = 0.0049505 k( 161) = ( 0.5000000 -0.0000000 0.4523810), wk = 0.0049505 k( 162) = ( 0.5000000 -0.0000000 0.4285714), wk = 0.0049505 k( 163) = ( 0.5000000 -0.0000000 0.4047619), wk = 0.0049505 k( 164) = ( 0.5000000 -0.0000000 0.3809524), wk = 0.0049505 k( 165) = ( 0.5000000 -0.0000000 0.3571429), wk = 0.0049505 k( 166) = ( 0.5000000 -0.0000000 0.3333333), wk = 0.0049505 k( 167) = ( 0.5000000 -0.0000000 0.3095238), wk = 0.0049505 k( 168) = ( 0.5000000 -0.0000000 0.2857143), wk = 0.0049505 k( 169) = ( 0.5000000 -0.0000000 0.2619048), wk = 0.0049505 k( 170) = ( 0.5000000 -0.0000000 0.2380952), wk = 0.0049505 k( 171) = ( 0.5000000 -0.0000000 0.2142857), wk = 0.0049505 k( 172) = ( 0.5000000 -0.0000000 0.1904762), wk = 0.0049505 k( 173) = ( 0.5000000 -0.0000000 0.1666667), wk = 0.0049505 k( 174) = ( 0.5000000 -0.0000000 0.1428571), wk = 0.0049505 k( 175) = ( 0.5000000 -0.0000000 0.1190476), wk = 0.0049505 k( 176) = ( 0.5000000 -0.0000000 0.0952381), wk = 0.0049505 k( 177) = ( 0.5000000 -0.0000000 0.0714286), wk = 0.0049505 k( 178) = ( 0.5000000 -0.0000000 0.0476191), wk = 0.0049505 k( 179) = ( 0.5000000 -0.0000000 0.0238095), wk = 0.0049505 k( 180) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0049505 k( 181) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0049505 k( 182) = ( 0.3333333 0.3333333 0.0238095), wk = 0.0049505 k( 183) = ( 0.3333333 0.3333333 0.0476191), wk = 0.0049505 k( 184) = ( 0.3333333 0.3333333 0.0714286), wk = 0.0049505 k( 185) = ( 0.3333333 0.3333333 0.0952381), wk = 0.0049505 k( 186) = ( 0.3333333 0.3333333 0.1190476), wk = 0.0049505 k( 187) = ( 0.3333333 0.3333333 0.1428571), wk = 0.0049505 k( 188) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0049505 k( 189) = ( 0.3333333 0.3333333 0.1904762), wk = 0.0049505 k( 190) = ( 0.3333333 0.3333333 0.2142857), wk = 0.0049505 k( 191) = ( 0.3333333 0.3333333 0.2380952), wk = 0.0049505 k( 192) = ( 0.3333333 0.3333333 0.2619048), wk = 0.0049505 k( 193) = ( 0.3333333 0.3333333 0.2857143), wk = 0.0049505 k( 194) = ( 0.3333333 0.3333333 0.3095238), wk = 0.0049505 k( 195) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0049505 k( 196) = ( 0.3333333 0.3333333 0.3571429), wk = 0.0049505 k( 197) = ( 0.3333333 0.3333333 0.3809524), wk = 0.0049505 k( 198) = ( 0.3333333 0.3333333 0.4047619), wk = 0.0049505 k( 199) = ( 0.3333333 0.3333333 0.4285714), wk = 0.0049505 k( 200) = ( 0.3333333 0.3333333 0.4523810), wk = 0.0049505 k( 201) = ( 0.3333333 0.3333333 0.4761905), wk = 0.0049505 k( 202) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0049505 Dense grid: 262023 G-vectors FFT dimensions: ( 90, 90, 81) Smooth grid: 106351 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.46 Mb ( 394, 76) NL pseudopotentials 0.70 Mb ( 197, 232) Each V/rho on FFT grid 0.25 Mb ( 16200) Each G-vector array 0.03 Mb ( 3638) G-vector shells 0.01 Mb ( 1767) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.83 Mb ( 394, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.54 Mb ( 232, 2, 76) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./K3N.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.5 secs Computing kpt #: 2 total cpu time spent up to now is 7.9 secs Computing kpt #: 3 total cpu time spent up to now is 10.3 secs Computing kpt #: 4 total cpu time spent up to now is 12.7 secs Computing kpt #: 5 total cpu time spent up to now is 15.2 secs Computing kpt #: 6 total cpu time spent up to now is 17.8 secs Computing kpt #: 7 total cpu time spent up to now is 20.3 secs Computing kpt #: 8 total cpu time spent up to now is 23.1 secs Computing kpt #: 9 total cpu time spent up to now is 26.1 secs Computing kpt #: 10 total cpu time spent up to now is 29.2 secs Computing kpt #: 11 total cpu time spent up to now is 32.4 secs Computing kpt #: 12 total cpu time spent up to now is 35.5 secs Computing kpt #: 13 total cpu time spent up to now is 38.3 secs Computing kpt #: 14 total cpu time spent up to now is 40.9 secs Computing kpt #: 15 total cpu time spent up to now is 43.8 secs Computing kpt #: 16 total cpu time spent up to now is 46.5 secs Computing kpt #: 17 total cpu time spent up to now is 49.4 secs Computing kpt #: 18 total cpu time spent up to now is 52.2 secs Computing kpt #: 19 total cpu time spent up to now is 54.9 secs Computing kpt #: 20 total cpu time spent up to now is 57.7 secs Computing kpt #: 21 total cpu time spent up to now is 60.3 secs Computing kpt #: 22 total cpu time spent up to now is 62.9 secs Computing kpt #: 23 total cpu time spent up to now is 65.7 secs Computing kpt #: 24 total cpu time spent up to now is 68.6 secs Computing kpt #: 25 total cpu time spent up to now is 71.4 secs Computing kpt #: 26 total cpu time spent up to now is 74.1 secs Computing kpt #: 27 total cpu time spent up to now is 76.9 secs Computing kpt #: 28 total cpu time spent up to now is 80.1 secs Computing kpt #: 29 total cpu time spent up to now is 83.3 secs Computing kpt #: 30 total cpu time spent up to now is 86.7 secs Computing kpt #: 31 total cpu time spent up to now is 90.1 secs Computing kpt #: 32 total cpu time spent up to now is 93.5 secs Computing kpt #: 33 total cpu time spent up to now is 96.8 secs Computing kpt #: 34 total cpu time spent up to now is 100.3 secs Computing kpt #: 35 total cpu time spent up to now is 103.7 secs Computing kpt #: 36 total cpu time spent up to now is 107.1 secs Computing kpt #: 37 total cpu time spent up to now is 110.3 secs Computing kpt #: 38 total cpu time spent up to now is 113.7 secs Computing kpt #: 39 total cpu time spent up to now is 116.9 secs Computing kpt #: 40 total cpu time spent up to now is 120.2 secs Computing kpt #: 41 total cpu time spent up to now is 123.5 secs Computing kpt #: 42 total cpu time spent up to now is 126.8 secs Computing kpt #: 43 total cpu time spent up to now is 130.2 secs Computing kpt #: 44 total cpu time spent up to now is 133.6 secs Computing kpt #: 45 total cpu time spent up to now is 137.2 secs Computing kpt #: 46 total cpu time spent up to now is 140.7 secs Computing kpt #: 47 total cpu time spent up to now is 144.2 secs Computing kpt #: 48 total cpu time spent up to now is 147.5 secs Computing kpt #: 49 total cpu time spent up to now is 151.3 secs Computing kpt #: 50 total cpu time spent up to now is 154.8 secs Computing kpt #: 51 total cpu time spent up to now is 158.3 secs Computing kpt #: 52 total cpu time spent up to now is 161.8 secs Computing kpt #: 53 total cpu time spent up to now is 165.6 secs Computing kpt #: 54 total cpu time spent up to now is 169.3 secs Computing kpt #: 55 total cpu time spent up to now is 174.0 secs Computing kpt #: 56 total cpu time spent up to now is 178.4 secs Computing kpt #: 57 total cpu time spent up to now is 181.6 secs Computing kpt #: 58 total cpu time spent up to now is 185.0 secs Computing kpt #: 59 total cpu time spent up to now is 188.0 secs Computing kpt #: 60 total cpu time spent up to now is 191.2 secs Computing kpt #: 61 total cpu time spent up to now is 194.0 secs Computing kpt #: 62 total cpu time spent up to now is 196.8 secs Computing kpt #: 63 total cpu time spent up to now is 199.4 secs Computing kpt #: 64 total cpu time spent up to now is 201.9 secs Computing kpt #: 65 total cpu time spent up to now is 204.6 secs Computing kpt #: 66 total cpu time spent up to now is 207.2 secs Computing kpt #: 67 total cpu time spent up to now is 209.6 secs Computing kpt #: 68 total cpu time spent up to now is 211.8 secs Computing kpt #: 69 total cpu time spent up to now is 214.2 secs Computing kpt #: 70 total cpu time spent up to now is 216.6 secs Computing kpt #: 71 total cpu time spent up to now is 219.1 secs Computing kpt #: 72 total cpu time spent up to now is 221.8 secs Computing kpt #: 73 total cpu time spent up to now is 224.5 secs Computing kpt #: 74 total cpu time spent up to now is 227.0 secs Computing kpt #: 75 total cpu time spent up to now is 229.6 secs Computing kpt #: 76 total cpu time spent up to now is 232.5 secs Computing kpt #: 77 total cpu time spent up to now is 237.2 secs Computing kpt #: 78 total cpu time spent up to now is 243.6 secs Computing kpt #: 79 total cpu time spent up to now is 250.1 secs Computing kpt #: 80 total cpu time spent up to now is 254.4 secs Computing kpt #: 81 total cpu time spent up to now is 258.7 secs Computing kpt #: 82 total cpu time spent up to now is 262.4 secs Computing kpt #: 83 total cpu time spent up to now is 266.0 secs Computing kpt #: 84 total cpu time spent up to now is 269.7 secs Computing kpt #: 85 total cpu time spent up to now is 273.2 secs Computing kpt #: 86 total cpu time spent up to now is 276.6 secs Computing kpt #: 87 total cpu time spent up to now is 280.2 secs Computing kpt #: 88 total cpu time spent up to now is 284.4 secs Computing kpt #: 89 total cpu time spent up to now is 287.8 secs Computing kpt #: 90 total cpu time spent up to now is 291.1 secs Computing kpt #: 91 total cpu time spent up to now is 294.5 secs Computing kpt #: 92 total cpu time spent up to now is 298.0 secs Computing kpt #: 93 total cpu time spent up to now is 301.1 secs Computing kpt #: 94 total cpu time spent up to now is 303.9 secs Computing kpt #: 95 total cpu time spent up to now is 306.6 secs Computing kpt #: 96 total cpu time spent up to now is 309.3 secs Computing kpt #: 97 total cpu time spent up to now is 312.1 secs Computing kpt #: 98 total cpu time spent up to now is 314.7 secs Computing kpt #: 99 total cpu time spent up to now is 317.3 secs Computing kpt #: 100 total cpu time spent up to now is 320.0 secs Computing kpt #: 101 total cpu time spent up to now is 322.5 secs Computing kpt #: 102 total cpu time spent up to now is 325.2 secs Computing kpt #: 103 total cpu time spent up to now is 327.9 secs Computing kpt #: 104 total cpu time spent up to now is 330.6 secs Computing kpt #: 105 total cpu time spent up to now is 333.2 secs Computing kpt #: 106 total cpu time spent up to now is 335.7 secs Computing kpt #: 107 total cpu time spent up to now is 338.3 secs Computing kpt #: 108 total cpu time spent up to now is 340.9 secs Computing kpt #: 109 total cpu time spent up to now is 343.5 secs Computing kpt #: 110 total cpu time spent up to now is 346.1 secs Computing kpt #: 111 total cpu time spent up to now is 348.5 secs Computing kpt #: 112 total cpu time spent up to now is 351.2 secs Computing kpt #: 113 total cpu time spent up to now is 353.8 secs Computing kpt #: 114 total cpu time spent up to now is 356.5 secs Computing kpt #: 115 total cpu time spent up to now is 359.1 secs Computing kpt #: 116 total cpu time spent up to now is 361.8 secs Computing kpt #: 117 total cpu time spent up to now is 364.5 secs Computing kpt #: 118 total cpu time spent up to now is 367.1 secs Computing kpt #: 119 total cpu time spent up to now is 369.6 secs Computing kpt #: 120 total cpu time spent up to now is 372.2 secs Computing kpt #: 121 total cpu time spent up to now is 374.7 secs Computing kpt #: 122 total cpu time spent up to now is 377.2 secs Computing kpt #: 123 total cpu time spent up to now is 379.6 secs Computing kpt #: 124 total cpu time spent up to now is 381.9 secs Computing kpt #: 125 total cpu time spent up to now is 384.2 secs Computing kpt #: 126 total cpu time spent up to now is 386.8 secs Computing kpt #: 127 total cpu time spent up to now is 389.2 secs Computing kpt #: 128 total cpu time spent up to now is 391.7 secs Computing kpt #: 129 total cpu time spent up to now is 393.9 secs Computing kpt #: 130 total cpu time spent up to now is 396.4 secs Computing kpt #: 131 total cpu time spent up to now is 398.7 secs Computing kpt #: 132 total cpu time spent up to now is 401.2 secs Computing kpt #: 133 total cpu time spent up to now is 403.4 secs Computing kpt #: 134 total cpu time spent up to now is 405.7 secs Computing kpt #: 135 total cpu time spent up to now is 408.2 secs Computing kpt #: 136 total cpu time spent up to now is 410.6 secs Computing kpt #: 137 total cpu time spent up to now is 413.0 secs Computing kpt #: 138 total cpu time spent up to now is 415.7 secs Computing kpt #: 139 total cpu time spent up to now is 418.2 secs Computing kpt #: 140 total cpu time spent up to now is 420.7 secs Computing kpt #: 141 total cpu time spent up to now is 423.1 secs Computing kpt #: 142 total cpu time spent up to now is 425.6 secs Computing kpt #: 143 total cpu time spent up to now is 428.2 secs Computing kpt #: 144 total cpu time spent up to now is 430.8 secs Computing kpt #: 145 total cpu time spent up to now is 433.4 secs Computing kpt #: 146 total cpu time spent up to now is 436.1 secs Computing kpt #: 147 total cpu time spent up to now is 438.4 secs Computing kpt #: 148 total cpu time spent up to now is 440.8 secs Computing kpt #: 149 total cpu time spent up to now is 443.8 secs Computing kpt #: 150 total cpu time spent up to now is 446.1 secs Computing kpt #: 151 total cpu time spent up to now is 448.9 secs Computing kpt #: 152 total cpu time spent up to now is 451.5 secs Computing kpt #: 153 total cpu time spent up to now is 454.1 secs Computing kpt #: 154 total cpu time spent up to now is 456.7 secs Computing kpt #: 155 total cpu time spent up to now is 459.5 secs Computing kpt #: 156 total cpu time spent up to now is 462.7 secs Computing kpt #: 157 total cpu time spent up to now is 466.2 secs Computing kpt #: 158 total cpu time spent up to now is 469.6 secs Computing kpt #: 159 total cpu time spent up to now is 472.3 secs Computing kpt #: 160 total cpu time spent up to now is 474.9 secs Computing kpt #: 161 total cpu time spent up to now is 477.5 secs Computing kpt #: 162 total cpu time spent up to now is 480.3 secs Computing kpt #: 163 total cpu time spent up to now is 482.9 secs Computing kpt #: 164 total cpu time spent up to now is 485.5 secs Computing kpt #: 165 total cpu time spent up to now is 488.0 secs Computing kpt #: 166 total cpu time spent up to now is 490.8 secs Computing kpt #: 167 total cpu time spent up to now is 493.5 secs Computing kpt #: 168 total cpu time spent up to now is 496.4 secs Computing kpt #: 169 total cpu time spent up to now is 499.4 secs Computing kpt #: 170 total cpu time spent up to now is 502.4 secs Computing kpt #: 171 total cpu time spent up to now is 505.4 secs Computing kpt #: 172 total cpu time spent up to now is 508.0 secs Computing kpt #: 173 total cpu time spent up to now is 511.7 secs Computing kpt #: 174 total cpu time spent up to now is 517.3 secs Computing kpt #: 175 total cpu time spent up to now is 521.6 secs Computing kpt #: 176 total cpu time spent up to now is 525.5 secs Computing kpt #: 177 total cpu time spent up to now is 529.3 secs Computing kpt #: 178 total cpu time spent up to now is 532.7 secs Computing kpt #: 179 total cpu time spent up to now is 535.9 secs Computing kpt #: 180 total cpu time spent up to now is 538.9 secs Computing kpt #: 181 total cpu time spent up to now is 542.3 secs Computing kpt #: 182 total cpu time spent up to now is 545.8 secs Computing kpt #: 183 total cpu time spent up to now is 549.0 secs Computing kpt #: 184 total cpu time spent up to now is 552.8 secs Computing kpt #: 185 total cpu time spent up to now is 557.9 secs Computing kpt #: 186 total cpu time spent up to now is 560.7 secs Computing kpt #: 187 total cpu time spent up to now is 563.5 secs Computing kpt #: 188 total cpu time spent up to now is 566.2 secs Computing kpt #: 189 total cpu time spent up to now is 568.7 secs Computing kpt #: 190 total cpu time spent up to now is 571.5 secs Computing kpt #: 191 total cpu time spent up to now is 574.0 secs Computing kpt #: 192 total cpu time spent up to now is 576.7 secs Computing kpt #: 193 total cpu time spent up to now is 579.1 secs Computing kpt #: 194 total cpu time spent up to now is 581.7 secs Computing kpt #: 195 total cpu time spent up to now is 587.5 secs Computing kpt #: 196 total cpu time spent up to now is 590.2 secs Computing kpt #: 197 total cpu time spent up to now is 592.6 secs Computing kpt #: 198 total cpu time spent up to now is 595.0 secs Computing kpt #: 199 total cpu time spent up to now is 597.4 secs Computing kpt #: 200 total cpu time spent up to now is 599.8 secs Computing kpt #: 201 total cpu time spent up to now is 602.2 secs Computing kpt #: 202 total cpu time spent up to now is 604.5 secs ethr = 1.56E-08, avg # of iterations = 19.9 total cpu time spent up to now is 604.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13243 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7142 -12.7142 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5081 -12.5081 -12.4187 -12.4187 -12.3599 -12.3599 -12.3486 -12.3486 -12.2961 -12.2961 -12.2405 -12.2405 -12.2156 -12.2156 -12.1966 -12.1966 -12.1928 -12.1928 -12.1554 -12.1554 -12.1264 -12.1264 -12.1231 -12.1231 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9130 0.9130 1.0922 1.0922 1.4087 1.4087 1.4120 1.4120 1.7466 1.7466 1.7553 1.7553 1.9936 1.9936 3.4394 3.4394 3.4689 3.4689 3.4890 3.4890 3.7587 3.7587 3.7706 3.7706 k = 0.0208 0.0120-0.0000 ( 13263 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7142 -12.7142 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5081 -12.5081 -12.4187 -12.4187 -12.3599 -12.3599 -12.3486 -12.3486 -12.2961 -12.2961 -12.2405 -12.2405 -12.2156 -12.2156 -12.1966 -12.1966 -12.1929 -12.1929 -12.1554 -12.1554 -12.1264 -12.1264 -12.1232 -12.1232 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9125 0.9125 1.0925 1.0925 1.4091 1.4091 1.4131 1.4131 1.7465 1.7465 1.7553 1.7553 1.9935 1.9935 3.4228 3.4228 3.4699 3.4699 3.4896 3.4896 3.7632 3.7632 3.7837 3.7837 k = 0.0417 0.0241-0.0000 ( 13269 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7141 -12.7141 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5082 -12.5082 -12.4187 -12.4187 -12.3598 -12.3598 -12.3485 -12.3485 -12.2961 -12.2961 -12.2406 -12.2406 -12.2157 -12.2157 -12.1966 -12.1966 -12.1929 -12.1929 -12.1554 -12.1554 -12.1266 -12.1266 -12.1232 -12.1232 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9112 0.9112 1.0933 1.0933 1.4085 1.4085 1.4185 1.4185 1.7464 1.7464 1.7552 1.7552 1.9934 1.9934 3.3809 3.3809 3.4730 3.4730 3.4915 3.4915 3.7659 3.7659 3.8264 3.8264 k = 0.0625 0.0361-0.0000 ( 13277 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8056 -28.8056 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7140 -12.7140 -12.6067 -12.6067 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5083 -12.5083 -12.4186 -12.4186 -12.3597 -12.3597 -12.3484 -12.3484 -12.2961 -12.2961 -12.2407 -12.2407 -12.2157 -12.2157 -12.1966 -12.1966 -12.1929 -12.1929 -12.1553 -12.1553 -12.1268 -12.1268 -12.1233 -12.1233 -12.1090 -12.1090 -8.8768 -8.8768 -8.8211 -8.8211 0.9090 0.9090 1.0946 1.0946 1.4067 1.4067 1.4280 1.4280 1.7462 1.7462 1.7550 1.7550 1.9931 1.9931 3.3256 3.3256 3.4780 3.4780 3.4948 3.4948 3.7683 3.7683 3.8845 3.8845 k = 0.0833 0.0481-0.0000 ( 13279 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8056 -28.8056 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7139 -12.7139 -12.6067 -12.6067 -12.6017 -12.6017 -12.5956 -12.5956 -12.5868 -12.5868 -12.5084 -12.5084 -12.4186 -12.4186 -12.3595 -12.3595 -12.3482 -12.3482 -12.2961 -12.2961 -12.2409 -12.2409 -12.2158 -12.2158 -12.1966 -12.1966 -12.1930 -12.1930 -12.1552 -12.1552 -12.1271 -12.1271 -12.1235 -12.1235 -12.1091 -12.1091 -8.8767 -8.8767 -8.8210 -8.8210 0.9061 0.9061 1.0964 1.0964 1.4041 1.4041 1.4412 1.4412 1.7460 1.7460 1.7548 1.7548 1.9928 1.9928 3.2645 3.2645 3.4850 3.4850 3.4995 3.4995 3.7714 3.7714 3.9493 3.9493 k = 0.1042 0.0601-0.0000 ( 13295 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8056 -28.8056 -28.8056 -28.8056 -28.8012 -28.8012 -28.8012 -28.8012 -12.7137 -12.7137 -12.6066 -12.6066 -12.6017 -12.6017 -12.5956 -12.5956 -12.5868 -12.5868 -12.5086 -12.5086 -12.4185 -12.4185 -12.3593 -12.3593 -12.3480 -12.3480 -12.2960 -12.2960 -12.2411 -12.2411 -12.2159 -12.2159 -12.1965 -12.1965 -12.1931 -12.1931 -12.1551 -12.1551 -12.1275 -12.1275 -12.1236 -12.1236 -12.1091 -12.1091 -8.8766 -8.8766 -8.8210 -8.8210 0.9028 0.9028 1.0987 1.0987 1.4008 1.4008 1.4579 1.4579 1.7456 1.7456 1.7545 1.7545 1.9923 1.9923 3.2012 3.2012 3.4939 3.4939 3.5056 3.5056 3.7751 3.7751 4.0166 4.0166 k = 0.1250 0.0722-0.0000 ( 13307 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8056 -28.8056 -28.8056 -28.8056 -28.8013 -28.8013 -28.8012 -28.8012 -12.7136 -12.7136 -12.6065 -12.6065 -12.6016 -12.6016 -12.5956 -12.5956 -12.5867 -12.5867 -12.5088 -12.5088 -12.4184 -12.4184 -12.3590 -12.3590 -12.3478 -12.3478 -12.2960 -12.2960 -12.2413 -12.2413 -12.2160 -12.2160 -12.1965 -12.1965 -12.1932 -12.1932 -12.1550 -12.1550 -12.1279 -12.1279 -12.1238 -12.1238 -12.1092 -12.1092 -8.8764 -8.8764 -8.8210 -8.8210 0.8991 0.8991 1.1013 1.1013 1.3970 1.3970 1.4776 1.4776 1.7452 1.7452 1.7543 1.7543 1.9918 1.9918 3.1373 3.1373 3.5047 3.5047 3.5133 3.5133 3.7795 3.7795 4.0837 4.0837 k = 0.1458 0.0842-0.0000 ( 13307 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8057 -28.8057 -28.8056 -28.8056 -28.8013 -28.8013 -28.8012 -28.8012 -12.7133 -12.7133 -12.6064 -12.6064 -12.6016 -12.6016 -12.5955 -12.5955 -12.5867 -12.5867 -12.5091 -12.5091 -12.4182 -12.4182 -12.3586 -12.3586 -12.3476 -12.3476 -12.2960 -12.2960 -12.2416 -12.2416 -12.2161 -12.2161 -12.1965 -12.1965 -12.1933 -12.1933 -12.1549 -12.1549 -12.1285 -12.1285 -12.1240 -12.1240 -12.1092 -12.1092 -8.8762 -8.8762 -8.8210 -8.8210 0.8953 0.8953 1.1043 1.1043 1.3926 1.3926 1.5001 1.5001 1.7447 1.7447 1.7540 1.7540 1.9912 1.9912 3.0739 3.0739 3.5173 3.5173 3.5226 3.5226 3.7845 3.7845 4.1485 4.1485 k = 0.1667 0.0962-0.0000 ( 13309 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8057 -28.8057 -28.8056 -28.8056 -28.8013 -28.8013 -28.8012 -28.8012 -12.7131 -12.7131 -12.6063 -12.6063 -12.6015 -12.6015 -12.5955 -12.5955 -12.5866 -12.5866 -12.5094 -12.5094 -12.4181 -12.4181 -12.3583 -12.3583 -12.3473 -12.3473 -12.2960 -12.2960 -12.2419 -12.2419 -12.2162 -12.2162 -12.1966 -12.1966 -12.1934 -12.1934 -12.1547 -12.1547 -12.1291 -12.1291 -12.1242 -12.1242 -12.1093 -12.1093 -8.8760 -8.8760 -8.8210 -8.8210 0.8914 0.8914 1.1077 1.1077 1.3878 1.3878 1.5252 1.5252 1.7441 1.7441 1.7537 1.7537 1.9905 1.9905 3.0117 3.0117 3.5313 3.5313 3.5337 3.5337 3.7900 3.7900 4.2083 4.2083 k = 0.1875 0.1083-0.0000 ( 13325 PWs) bands (ev): -28.8435 -28.8435 -28.8335 -28.8335 -28.8058 -28.8058 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7128 -12.7128 -12.6062 -12.6062 -12.6014 -12.6014 -12.5955 -12.5955 -12.5866 -12.5866 -12.5097 -12.5097 -12.4179 -12.4179 -12.3579 -12.3579 -12.3470 -12.3470 -12.2960 -12.2960 -12.2423 -12.2423 -12.2164 -12.2164 -12.1966 -12.1966 -12.1934 -12.1934 -12.1545 -12.1545 -12.1298 -12.1298 -12.1244 -12.1244 -12.1094 -12.1094 -8.8758 -8.8758 -8.8210 -8.8210 0.8877 0.8877 1.1112 1.1112 1.3827 1.3827 1.5525 1.5525 1.7435 1.7435 1.7534 1.7534 1.9898 1.9898 2.9509 2.9509 3.5452 3.5452 3.5484 3.5484 3.7959 3.7959 4.2599 4.2599 k = 0.2083 0.1203-0.0000 ( 13327 PWs) bands (ev): -28.8435 -28.8435 -28.8334 -28.8334 -28.8058 -28.8058 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7125 -12.7125 -12.6061 -12.6061 -12.6012 -12.6012 -12.5954 -12.5954 -12.5865 -12.5865 -12.5100 -12.5100 -12.4178 -12.4178 -12.3575 -12.3575 -12.3466 -12.3466 -12.2959 -12.2959 -12.2426 -12.2426 -12.2165 -12.2165 -12.1967 -12.1967 -12.1935 -12.1935 -12.1543 -12.1543 -12.1305 -12.1305 -12.1246 -12.1246 -12.1095 -12.1095 -8.8756 -8.8756 -8.8209 -8.8209 0.8842 0.8842 1.1148 1.1148 1.3775 1.3775 1.5817 1.5817 1.7427 1.7427 1.7532 1.7532 1.9891 1.9891 2.8918 2.8918 3.5594 3.5594 3.5659 3.5659 3.8022 3.8022 4.2994 4.2994 k = 0.2292 0.1323-0.0000 ( 13321 PWs) bands (ev): -28.8434 -28.8434 -28.8334 -28.8334 -28.8058 -28.8058 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7122 -12.7122 -12.6060 -12.6060 -12.6010 -12.6010 -12.5954 -12.5954 -12.5865 -12.5865 -12.5103 -12.5103 -12.4176 -12.4176 -12.3571 -12.3571 -12.3463 -12.3463 -12.2959 -12.2959 -12.2430 -12.2430 -12.2166 -12.2166 -12.1968 -12.1968 -12.1935 -12.1935 -12.1541 -12.1541 -12.1313 -12.1313 -12.1248 -12.1248 -12.1096 -12.1096 -8.8754 -8.8754 -8.8209 -8.8209 0.8810 0.8810 1.1186 1.1186 1.3721 1.3721 1.6125 1.6125 1.7420 1.7420 1.7530 1.7530 1.9883 1.9883 2.8347 2.8347 3.5750 3.5750 3.5850 3.5850 3.8090 3.8090 4.3226 4.3226 k = 0.2500 0.1443-0.0000 ( 13289 PWs) bands (ev): -28.8434 -28.8434 -28.8333 -28.8333 -28.8059 -28.8059 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7119 -12.7119 -12.6059 -12.6059 -12.6008 -12.6008 -12.5953 -12.5953 -12.5865 -12.5865 -12.5106 -12.5106 -12.4175 -12.4175 -12.3566 -12.3566 -12.3459 -12.3459 -12.2959 -12.2959 -12.2433 -12.2433 -12.2167 -12.2167 -12.1969 -12.1969 -12.1935 -12.1935 -12.1539 -12.1539 -12.1320 -12.1320 -12.1250 -12.1250 -12.1096 -12.1096 -8.8752 -8.8752 -8.8209 -8.8209 0.8782 0.8782 1.1223 1.1223 1.3667 1.3667 1.6447 1.6447 1.7412 1.7412 1.7528 1.7528 1.9876 1.9876 2.7797 2.7797 3.5919 3.5919 3.6056 3.6056 3.8161 3.8161 4.3274 4.3274 k = 0.2708 0.1564-0.0000 ( 13289 PWs) bands (ev): -28.8433 -28.8433 -28.8333 -28.8333 -28.8059 -28.8059 -28.8057 -28.8057 -28.8013 -28.8013 -28.8013 -28.8013 -12.7116 -12.7116 -12.6058 -12.6058 -12.6006 -12.6006 -12.5952 -12.5952 -12.5865 -12.5865 -12.5110 -12.5110 -12.4173 -12.4173 -12.3562 -12.3562 -12.3456 -12.3456 -12.2958 -12.2958 -12.2437 -12.2437 -12.2169 -12.2169 -12.1971 -12.1971 -12.1934 -12.1934 -12.1537 -12.1537 -12.1328 -12.1328 -12.1252 -12.1252 -12.1097 -12.1097 -8.8750 -8.8750 -8.8209 -8.8209 0.8758 0.8758 1.1259 1.1259 1.3614 1.3614 1.6779 1.6779 1.7404 1.7404 1.7526 1.7526 1.9868 1.9868 2.7269 2.7269 3.6102 3.6102 3.6274 3.6274 3.8238 3.8238 4.3156 4.3156 k = 0.2917 0.1684-0.0000 ( 13285 PWs) bands (ev): -28.8433 -28.8433 -28.8333 -28.8333 -28.8060 -28.8060 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7113 -12.7113 -12.6057 -12.6057 -12.6004 -12.6004 -12.5951 -12.5951 -12.5866 -12.5866 -12.5113 -12.5113 -12.4171 -12.4171 -12.3558 -12.3558 -12.3452 -12.3452 -12.2958 -12.2958 -12.2440 -12.2440 -12.2170 -12.2170 -12.1972 -12.1972 -12.1934 -12.1934 -12.1535 -12.1535 -12.1336 -12.1336 -12.1254 -12.1254 -12.1098 -12.1098 -8.8747 -8.8747 -8.8208 -8.8208 0.8737 0.8737 1.1294 1.1294 1.3564 1.3564 1.7117 1.7117 1.7396 1.7396 1.7525 1.7525 1.9861 1.9861 2.6764 2.6764 3.6293 3.6293 3.6504 3.6504 3.8320 3.8320 4.2918 4.2918 k = 0.3125 0.1804-0.0000 ( 13289 PWs) bands (ev): -28.8432 -28.8432 -28.8333 -28.8333 -28.8060 -28.8060 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7110 -12.7110 -12.6057 -12.6057 -12.6002 -12.6002 -12.5949 -12.5949 -12.5867 -12.5867 -12.5116 -12.5116 -12.4170 -12.4170 -12.3553 -12.3553 -12.3449 -12.3449 -12.2958 -12.2958 -12.2444 -12.2444 -12.2171 -12.2171 -12.1974 -12.1974 -12.1933 -12.1933 -12.1534 -12.1534 -12.1344 -12.1344 -12.1255 -12.1255 -12.1099 -12.1099 -8.8745 -8.8745 -8.8208 -8.8208 0.8720 0.8720 1.1326 1.1326 1.3516 1.3516 1.7386 1.7386 1.7457 1.7457 1.7527 1.7527 1.9854 1.9854 2.6285 2.6285 3.6491 3.6491 3.6744 3.6744 3.8411 3.8411 4.2608 4.2608 k = 0.3333 0.1925-0.0000 ( 13299 PWs) bands (ev): -28.8432 -28.8432 -28.8332 -28.8332 -28.8061 -28.8061 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7107 -12.7107 -12.6056 -12.6056 -12.5999 -12.5999 -12.5948 -12.5948 -12.5868 -12.5868 -12.5120 -12.5120 -12.4169 -12.4169 -12.3550 -12.3550 -12.3446 -12.3446 -12.2958 -12.2958 -12.2447 -12.2447 -12.2172 -12.2172 -12.1976 -12.1976 -12.1933 -12.1933 -12.1532 -12.1532 -12.1351 -12.1351 -12.1257 -12.1257 -12.1100 -12.1100 -8.8743 -8.8743 -8.8208 -8.8208 0.8706 0.8706 1.1356 1.1356 1.3472 1.3472 1.7379 1.7379 1.7521 1.7521 1.7804 1.7804 1.9847 1.9847 2.5831 2.5831 3.6688 3.6688 3.6991 3.6991 3.8512 3.8512 4.2267 4.2267 k = 0.3542 0.2045-0.0000 ( 13303 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8061 -28.8061 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7104 -12.7104 -12.6056 -12.6056 -12.5997 -12.5997 -12.5947 -12.5947 -12.5869 -12.5869 -12.5123 -12.5123 -12.4167 -12.4167 -12.3546 -12.3546 -12.3443 -12.3443 -12.2958 -12.2958 -12.2450 -12.2450 -12.2173 -12.2173 -12.1978 -12.1978 -12.1932 -12.1932 -12.1530 -12.1530 -12.1357 -12.1357 -12.1259 -12.1259 -12.1100 -12.1100 -8.8741 -8.8741 -8.8208 -8.8208 0.8695 0.8695 1.1382 1.1382 1.3433 1.3433 1.7372 1.7372 1.7521 1.7521 1.8140 1.8140 1.9841 1.9841 2.5405 2.5405 3.6879 3.6879 3.7244 3.7244 3.8626 3.8626 4.1922 4.1922 k = 0.3750 0.2165-0.0000 ( 13309 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8061 -28.8061 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7102 -12.7102 -12.6055 -12.6055 -12.5995 -12.5995 -12.5945 -12.5945 -12.5871 -12.5871 -12.5125 -12.5125 -12.4166 -12.4166 -12.3543 -12.3543 -12.3441 -12.3441 -12.2958 -12.2958 -12.2453 -12.2453 -12.2174 -12.2174 -12.1980 -12.1980 -12.1931 -12.1931 -12.1529 -12.1529 -12.1364 -12.1364 -12.1260 -12.1260 -12.1101 -12.1101 -8.8740 -8.8740 -8.8208 -8.8208 0.8688 0.8688 1.1406 1.1406 1.3399 1.3399 1.7366 1.7366 1.7520 1.7520 1.8466 1.8466 1.9835 1.9835 2.5010 2.5010 3.7055 3.7055 3.7499 3.7499 3.8755 3.8755 4.1594 4.1594 k = 0.3958 0.2285-0.0000 ( 13297 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8062 -28.8062 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7100 -12.7100 -12.6055 -12.6055 -12.5993 -12.5993 -12.5943 -12.5943 -12.5872 -12.5872 -12.5128 -12.5128 -12.4165 -12.4165 -12.3540 -12.3540 -12.3439 -12.3439 -12.2957 -12.2957 -12.2455 -12.2455 -12.2175 -12.2175 -12.1982 -12.1982 -12.1930 -12.1930 -12.1527 -12.1527 -12.1369 -12.1369 -12.1261 -12.1261 -12.1101 -12.1101 -8.8738 -8.8738 -8.8207 -8.8207 0.8682 0.8682 1.1425 1.1425 1.3369 1.3369 1.7360 1.7360 1.7519 1.7519 1.8774 1.8774 1.9830 1.9830 2.4650 2.4650 3.7210 3.7210 3.7750 3.7750 3.8899 3.8899 4.1296 4.1296 k = 0.4167 0.2406-0.0000 ( 13305 PWs) bands (ev): -28.8430 -28.8430 -28.8332 -28.8332 -28.8062 -28.8062 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7098 -12.7098 -12.6054 -12.6054 -12.5992 -12.5992 -12.5941 -12.5941 -12.5874 -12.5874 -12.5130 -12.5130 -12.4164 -12.4164 -12.3537 -12.3537 -12.3437 -12.3437 -12.2957 -12.2957 -12.2457 -12.2457 -12.2176 -12.2176 -12.1983 -12.1983 -12.1930 -12.1930 -12.1526 -12.1526 -12.1373 -12.1373 -12.1262 -12.1262 -12.1102 -12.1102 -8.8737 -8.8737 -8.8207 -8.8207 0.8678 0.8678 1.1441 1.1441 1.3345 1.3345 1.7356 1.7356 1.7519 1.7519 1.9056 1.9056 1.9826 1.9826 2.4330 2.4330 3.7338 3.7338 3.7992 3.7992 3.9053 3.9053 4.1040 4.1040 k = 0.4375 0.2526-0.0000 ( 13297 PWs) bands (ev): -28.8430 -28.8430 -28.8332 -28.8332 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7096 -12.7096 -12.6054 -12.6054 -12.5990 -12.5990 -12.5940 -12.5940 -12.5875 -12.5875 -12.5131 -12.5131 -12.4164 -12.4164 -12.3535 -12.3535 -12.3435 -12.3435 -12.2957 -12.2957 -12.2459 -12.2459 -12.2176 -12.2176 -12.1984 -12.1984 -12.1929 -12.1929 -12.1525 -12.1525 -12.1377 -12.1377 -12.1263 -12.1263 -12.1102 -12.1102 -8.8736 -8.8736 -8.8207 -8.8207 0.8675 0.8675 1.1454 1.1454 1.3326 1.3326 1.7352 1.7352 1.7518 1.7518 1.9300 1.9300 1.9823 1.9823 2.4059 2.4059 3.7436 3.7436 3.8214 3.8214 3.9205 3.9205 4.0833 4.0833 k = 0.4583 0.2646-0.0000 ( 13287 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7095 -12.7095 -12.6054 -12.6054 -12.5989 -12.5989 -12.5939 -12.5939 -12.5876 -12.5876 -12.5133 -12.5133 -12.4163 -12.4163 -12.3534 -12.3534 -12.3434 -12.3434 -12.2957 -12.2957 -12.2460 -12.2460 -12.2176 -12.2176 -12.1985 -12.1985 -12.1929 -12.1929 -12.1525 -12.1525 -12.1380 -12.1380 -12.1263 -12.1263 -12.1103 -12.1103 -8.8735 -8.8735 -8.8207 -8.8207 0.8674 0.8674 1.1462 1.1462 1.3313 1.3313 1.7349 1.7349 1.7518 1.7518 1.9492 1.9492 1.9820 1.9820 2.3851 2.3851 3.7505 3.7505 3.8398 3.8398 3.9337 3.9337 4.0681 4.0681 k = 0.4792 0.2766-0.0000 ( 13292 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7095 -12.7095 -12.6054 -12.6054 -12.5989 -12.5989 -12.5938 -12.5938 -12.5877 -12.5877 -12.5133 -12.5133 -12.4163 -12.4163 -12.3533 -12.3533 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1986 -12.1986 -12.1928 -12.1928 -12.1524 -12.1524 -12.1381 -12.1381 -12.1264 -12.1264 -12.1103 -12.1103 -8.8735 -8.8735 -8.8207 -8.8207 0.8673 0.8673 1.1467 1.1467 1.3305 1.3305 1.7348 1.7348 1.7518 1.7518 1.9616 1.9616 1.9818 1.9818 2.3717 2.3717 3.7546 3.7546 3.8524 3.8524 3.9429 3.9429 4.0588 4.0588 k = 0.5000 0.2887-0.0000 ( 13298 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7095 -12.7095 -12.6054 -12.6054 -12.5989 -12.5989 -12.5937 -12.5937 -12.5877 -12.5877 -12.5134 -12.5134 -12.4163 -12.4163 -12.3533 -12.3533 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1986 -12.1986 -12.1928 -12.1928 -12.1524 -12.1524 -12.1382 -12.1382 -12.1264 -12.1264 -12.1103 -12.1103 -8.8734 -8.8734 -8.8207 -8.8207 0.8672 0.8672 1.1469 1.1469 1.3302 1.3302 1.7347 1.7347 1.7518 1.7518 1.9659 1.9659 1.9818 1.9818 2.3671 2.3671 3.7559 3.7559 3.8570 3.8570 3.9462 3.9462 4.0557 4.0557 k = 0.5000 0.2887-0.0000 ( 13298 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7095 -12.7095 -12.6054 -12.6054 -12.5989 -12.5989 -12.5937 -12.5937 -12.5877 -12.5877 -12.5134 -12.5134 -12.4163 -12.4163 -12.3533 -12.3533 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1986 -12.1986 -12.1928 -12.1928 -12.1524 -12.1524 -12.1382 -12.1382 -12.1264 -12.1264 -12.1103 -12.1103 -8.8734 -8.8734 -8.8207 -8.8207 0.8672 0.8672 1.1469 1.1469 1.3302 1.3302 1.7347 1.7347 1.7518 1.7518 1.9659 1.9659 1.9818 1.9818 2.3671 2.3671 3.7559 3.7559 3.8570 3.8570 3.9462 3.9462 4.0557 4.0557 k = 0.4881 0.3093-0.0000 ( 13290 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7094 -12.7094 -12.6053 -12.6053 -12.5988 -12.5988 -12.5938 -12.5938 -12.5877 -12.5877 -12.5134 -12.5134 -12.4163 -12.4163 -12.3533 -12.3533 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1986 -12.1986 -12.1928 -12.1928 -12.1524 -12.1524 -12.1382 -12.1382 -12.1264 -12.1264 -12.1103 -12.1103 -8.8734 -8.8734 -8.8207 -8.8207 0.8681 0.8681 1.1470 1.1470 1.3268 1.3268 1.7348 1.7348 1.7517 1.7517 1.9709 1.9709 1.9818 1.9818 2.3672 2.3672 3.7317 3.7317 3.8576 3.8576 3.9474 3.9474 4.0775 4.0775 k = 0.4762 0.3299-0.0000 ( 13294 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7094 -12.7094 -12.6053 -12.6053 -12.5988 -12.5988 -12.5938 -12.5938 -12.5878 -12.5878 -12.5134 -12.5134 -12.4163 -12.4163 -12.3532 -12.3532 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1985 -12.1985 -12.1929 -12.1929 -12.1524 -12.1524 -12.1382 -12.1382 -12.1265 -12.1265 -12.1103 -12.1103 -8.8734 -8.8734 -8.8207 -8.8207 0.8709 0.8709 1.1472 1.1472 1.3170 1.3170 1.7349 1.7349 1.7516 1.7516 1.9815 1.9815 1.9858 1.9858 2.3674 2.3674 3.6734 3.6734 3.8596 3.8596 3.9512 3.9512 4.1251 4.1251 k = 0.4643 0.3505-0.0000 ( 13292 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7094 -12.7094 -12.6052 -12.6052 -12.5988 -12.5988 -12.5938 -12.5938 -12.5878 -12.5878 -12.5135 -12.5135 -12.4163 -12.4163 -12.3532 -12.3532 -12.3433 -12.3433 -12.2957 -12.2957 -12.2462 -12.2462 -12.2177 -12.2177 -12.1984 -12.1984 -12.1930 -12.1930 -12.1524 -12.1524 -12.1382 -12.1382 -12.1266 -12.1266 -12.1102 -12.1102 -8.8734 -8.8734 -8.8207 -8.8207 0.8754 0.8754 1.1475 1.1475 1.3017 1.3017 1.7350 1.7350 1.7513 1.7513 1.9815 1.9815 2.0089 2.0089 2.3677 2.3677 3.6000 3.6000 3.8630 3.8630 3.9574 3.9574 4.1223 4.1223 k = 0.4524 0.3712-0.0000 ( 13278 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7093 -12.7093 -12.6052 -12.6052 -12.5988 -12.5988 -12.5938 -12.5938 -12.5878 -12.5878 -12.5135 -12.5135 -12.4163 -12.4163 -12.3531 -12.3531 -12.3432 -12.3432 -12.2956 -12.2956 -12.2463 -12.2463 -12.2177 -12.2177 -12.1983 -12.1983 -12.1931 -12.1931 -12.1523 -12.1523 -12.1381 -12.1381 -12.1267 -12.1267 -12.1102 -12.1102 -8.8734 -8.8734 -8.8207 -8.8207 0.8817 0.8817 1.1479 1.1479 1.2820 1.2820 1.7353 1.7353 1.7510 1.7510 1.9814 1.9814 2.0395 2.0395 2.3683 2.3683 3.5206 3.5206 3.8677 3.8677 3.9662 3.9662 4.1183 4.1183 k = 0.4405 0.3918-0.0000 ( 13280 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7092 -12.7092 -12.6051 -12.6051 -12.5987 -12.5987 -12.5939 -12.5939 -12.5878 -12.5878 -12.5136 -12.5136 -12.4163 -12.4163 -12.3531 -12.3531 -12.3432 -12.3432 -12.2956 -12.2956 -12.2463 -12.2463 -12.2178 -12.2178 -12.1981 -12.1981 -12.1933 -12.1933 -12.1523 -12.1523 -12.1381 -12.1381 -12.1269 -12.1269 -12.1102 -12.1102 -8.8733 -8.8733 -8.8207 -8.8207 0.8898 0.8898 1.1483 1.1483 1.2593 1.2593 1.7356 1.7356 1.7506 1.7506 1.9812 1.9812 2.0762 2.0762 2.3690 2.3690 3.4392 3.4392 3.8738 3.8738 3.9774 3.9774 4.1130 4.1130 k = 0.4286 0.4124-0.0000 ( 13284 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7091 -12.7091 -12.6049 -12.6049 -12.5987 -12.5987 -12.5939 -12.5939 -12.5879 -12.5879 -12.5137 -12.5137 -12.4163 -12.4163 -12.3530 -12.3530 -12.3431 -12.3431 -12.2955 -12.2955 -12.2465 -12.2465 -12.2178 -12.2178 -12.1979 -12.1979 -12.1935 -12.1935 -12.1523 -12.1523 -12.1381 -12.1381 -12.1271 -12.1271 -12.1102 -12.1102 -8.8733 -8.8733 -8.8207 -8.8207 0.8995 0.8995 1.1486 1.1486 1.2348 1.2348 1.7359 1.7359 1.7501 1.7501 1.9810 1.9810 2.1174 2.1174 2.3700 2.3700 3.3579 3.3579 3.8813 3.8813 3.9911 3.9911 4.1064 4.1064 k = 0.4167 0.4330-0.0000 ( 13276 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8062 -28.8062 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7090 -12.7090 -12.6048 -12.6048 -12.5986 -12.5986 -12.5940 -12.5940 -12.5879 -12.5879 -12.5139 -12.5139 -12.4163 -12.4163 -12.3529 -12.3529 -12.3430 -12.3430 -12.2955 -12.2955 -12.2466 -12.2466 -12.2178 -12.2178 -12.1977 -12.1977 -12.1937 -12.1937 -12.1522 -12.1522 -12.1381 -12.1381 -12.1274 -12.1274 -12.1102 -12.1102 -8.8733 -8.8733 -8.8207 -8.8207 0.9109 0.9109 1.1485 1.1485 1.2095 1.2095 1.7363 1.7363 1.7496 1.7496 1.9808 1.9808 2.1618 2.1618 2.3714 2.3714 3.2778 3.2778 3.8902 3.8902 4.0072 4.0072 4.0982 4.0982 k = 0.4048 0.4536-0.0000 ( 13288 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8062 -28.8062 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7089 -12.7089 -12.6047 -12.6047 -12.5986 -12.5986 -12.5941 -12.5941 -12.5879 -12.5879 -12.5140 -12.5140 -12.4163 -12.4163 -12.3528 -12.3528 -12.3430 -12.3430 -12.2954 -12.2954 -12.2467 -12.2467 -12.2179 -12.2179 -12.1975 -12.1975 -12.1939 -12.1939 -12.1522 -12.1522 -12.1381 -12.1381 -12.1276 -12.1276 -12.1101 -12.1101 -8.8732 -8.8732 -8.8207 -8.8207 0.9239 0.9239 1.1470 1.1470 1.1852 1.1852 1.7367 1.7367 1.7490 1.7490 1.9806 1.9806 2.2082 2.2082 2.3731 2.3731 3.2004 3.2004 3.9005 3.9005 4.0258 4.0258 4.0885 4.0885 k = 0.3929 0.4743-0.0000 ( 13282 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7088 -12.7088 -12.6046 -12.6046 -12.5985 -12.5985 -12.5941 -12.5941 -12.5880 -12.5880 -12.5141 -12.5141 -12.4163 -12.4163 -12.3527 -12.3527 -12.3429 -12.3429 -12.2954 -12.2954 -12.2468 -12.2468 -12.2179 -12.2179 -12.1973 -12.1973 -12.1942 -12.1942 -12.1522 -12.1522 -12.1381 -12.1381 -12.1278 -12.1278 -12.1101 -12.1101 -8.8732 -8.8732 -8.8207 -8.8207 0.9384 0.9384 1.1396 1.1396 1.1668 1.1668 1.7371 1.7371 1.7485 1.7485 1.9804 1.9804 2.2551 2.2551 2.3754 2.3754 3.1267 3.1267 3.9124 3.9124 4.0467 4.0467 4.0772 4.0772 k = 0.3810 0.4949-0.0000 ( 13290 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8014 -28.8014 -12.7087 -12.7087 -12.6045 -12.6045 -12.5985 -12.5985 -12.5941 -12.5941 -12.5880 -12.5880 -12.5142 -12.5142 -12.4163 -12.4163 -12.3527 -12.3527 -12.3428 -12.3428 -12.2953 -12.2953 -12.2469 -12.2469 -12.2179 -12.2179 -12.1970 -12.1970 -12.1944 -12.1944 -12.1521 -12.1521 -12.1381 -12.1381 -12.1280 -12.1280 -12.1101 -12.1101 -8.8731 -8.8731 -8.8207 -8.8207 0.9544 0.9544 1.1211 1.1211 1.1600 1.1600 1.7375 1.7375 1.7479 1.7479 1.9802 1.9802 2.3005 2.3005 2.3783 2.3783 3.0585 3.0585 3.9257 3.9257 4.0633 4.0633 4.0709 4.0709 k = 0.3690 0.5155-0.0000 ( 13282 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8013 -28.8013 -12.7087 -12.7087 -12.6044 -12.6044 -12.5985 -12.5985 -12.5942 -12.5942 -12.5881 -12.5881 -12.5143 -12.5143 -12.4163 -12.4163 -12.3526 -12.3526 -12.3428 -12.3428 -12.2953 -12.2953 -12.2470 -12.2470 -12.2179 -12.2179 -12.1968 -12.1968 -12.1947 -12.1947 -12.1521 -12.1521 -12.1381 -12.1381 -12.1281 -12.1281 -12.1101 -12.1101 -8.8731 -8.8731 -8.8207 -8.8207 0.9716 0.9716 1.0980 1.0980 1.1586 1.1586 1.7378 1.7378 1.7475 1.7475 1.9800 1.9800 2.3417 2.3417 2.3818 2.3818 2.9983 2.9983 3.9405 3.9405 4.0491 4.0491 4.0960 4.0960 k = 0.3571 0.5361-0.0000 ( 13274 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8013 -28.8013 -12.7086 -12.7086 -12.6043 -12.6043 -12.5984 -12.5984 -12.5942 -12.5942 -12.5881 -12.5881 -12.5143 -12.5143 -12.4162 -12.4162 -12.3525 -12.3525 -12.3427 -12.3427 -12.2953 -12.2953 -12.2470 -12.2470 -12.2180 -12.2180 -12.1966 -12.1966 -12.1949 -12.1949 -12.1521 -12.1521 -12.1381 -12.1381 -12.1282 -12.1282 -12.1101 -12.1101 -8.8731 -8.8731 -8.8207 -8.8207 0.9901 0.9901 1.0745 1.0745 1.1583 1.1583 1.7381 1.7381 1.7471 1.7471 1.9799 1.9799 2.3748 2.3748 2.3865 2.3865 2.9497 2.9497 3.9569 3.9569 4.0326 4.0326 4.1240 4.1240 k = 0.3452 0.5567-0.0000 ( 13286 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8013 -28.8013 -12.7086 -12.7086 -12.6042 -12.6042 -12.5984 -12.5984 -12.5942 -12.5942 -12.5881 -12.5881 -12.5144 -12.5144 -12.4163 -12.4163 -12.3525 -12.3525 -12.3427 -12.3427 -12.2952 -12.2952 -12.2471 -12.2471 -12.2180 -12.2180 -12.1964 -12.1964 -12.1951 -12.1951 -12.1520 -12.1520 -12.1381 -12.1381 -12.1283 -12.1283 -12.1101 -12.1101 -8.8730 -8.8730 -8.8207 -8.8207 1.0096 1.0096 1.0519 1.0519 1.1584 1.1584 1.7382 1.7382 1.7469 1.7469 1.9798 1.9798 2.3907 2.3907 2.3962 2.3962 2.9175 2.9175 3.9750 3.9750 4.0144 4.0144 4.1543 4.1543 k = 0.3333 0.5774-0.0000 ( 13308 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8061 -28.8061 -28.8014 -28.8014 -28.8014 -28.8014 -12.7086 -12.7086 -12.6042 -12.6042 -12.5984 -12.5984 -12.5942 -12.5942 -12.5882 -12.5882 -12.5144 -12.5144 -12.4163 -12.4163 -12.3525 -12.3525 -12.3427 -12.3427 -12.2952 -12.2952 -12.2471 -12.2471 -12.2180 -12.2180 -12.1964 -12.1964 -12.1951 -12.1951 -12.1520 -12.1520 -12.1382 -12.1382 -12.1283 -12.1283 -12.1101 -12.1101 -8.8730 -8.8730 -8.8207 -8.8207 1.0286 1.0286 1.0318 1.0318 1.1584 1.1584 1.7382 1.7382 1.7468 1.7468 1.9798 1.9798 2.3960 2.3960 2.4000 2.4000 2.9062 2.9062 3.9944 3.9944 3.9949 3.9949 4.1851 4.1851 k = 0.3333 0.5774-0.0000 ( 13308 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8061 -28.8061 -28.8014 -28.8014 -28.8014 -28.8014 -12.7086 -12.7086 -12.6042 -12.6042 -12.5984 -12.5984 -12.5942 -12.5942 -12.5882 -12.5882 -12.5144 -12.5144 -12.4163 -12.4163 -12.3525 -12.3525 -12.3427 -12.3427 -12.2952 -12.2952 -12.2471 -12.2471 -12.2180 -12.2180 -12.1964 -12.1964 -12.1951 -12.1951 -12.1520 -12.1520 -12.1382 -12.1382 -12.1283 -12.1283 -12.1101 -12.1101 -8.8730 -8.8730 -8.8207 -8.8207 1.0286 1.0286 1.0318 1.0318 1.1584 1.1584 1.7382 1.7382 1.7468 1.7468 1.9798 1.9798 2.3960 2.3960 2.4000 2.4000 2.9062 2.9062 3.9944 3.9944 3.9949 3.9949 4.1851 4.1851 k = 0.3210 0.5560-0.0000 ( 13284 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8014 -28.8014 -12.7086 -12.7086 -12.6042 -12.6042 -12.5984 -12.5984 -12.5942 -12.5942 -12.5881 -12.5881 -12.5144 -12.5144 -12.4163 -12.4163 -12.3525 -12.3525 -12.3427 -12.3427 -12.2952 -12.2952 -12.2471 -12.2471 -12.2180 -12.2180 -12.1964 -12.1964 -12.1951 -12.1951 -12.1520 -12.1520 -12.1381 -12.1381 -12.1283 -12.1283 -12.1101 -12.1101 -8.8730 -8.8730 -8.8207 -8.8207 1.0092 1.0092 1.0524 1.0524 1.1583 1.1583 1.7382 1.7382 1.7469 1.7469 1.9798 1.9798 2.3804 2.3804 2.4063 2.4063 2.9179 2.9179 3.9726 3.9726 4.0168 4.0168 4.1504 4.1504 k = 0.3086 0.5346-0.0000 ( 13282 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8014 -28.8014 -12.7086 -12.7086 -12.6043 -12.6043 -12.5984 -12.5984 -12.5942 -12.5942 -12.5881 -12.5881 -12.5143 -12.5143 -12.4163 -12.4163 -12.3526 -12.3526 -12.3428 -12.3428 -12.2953 -12.2953 -12.2470 -12.2470 -12.2180 -12.2180 -12.1966 -12.1966 -12.1949 -12.1949 -12.1521 -12.1521 -12.1381 -12.1381 -12.1282 -12.1282 -12.1101 -12.1101 -8.8731 -8.8731 -8.8207 -8.8207 0.9898 0.9898 1.0752 1.0752 1.1580 1.1580 1.7381 1.7381 1.7471 1.7471 1.9799 1.9799 2.3461 2.3461 2.4159 2.4159 2.9495 2.9495 3.9492 3.9492 4.0409 4.0409 4.1116 4.1116 k = 0.2963 0.5132-0.0000 ( 13268 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8013 -28.8013 -12.7087 -12.7087 -12.6044 -12.6044 -12.5985 -12.5985 -12.5942 -12.5942 -12.5880 -12.5880 -12.5142 -12.5142 -12.4163 -12.4163 -12.3526 -12.3526 -12.3428 -12.3428 -12.2953 -12.2953 -12.2469 -12.2469 -12.2179 -12.2179 -12.1967 -12.1967 -12.1947 -12.1947 -12.1521 -12.1521 -12.1380 -12.1380 -12.1281 -12.1281 -12.1101 -12.1101 -8.8731 -8.8731 -8.8207 -8.8207 0.9719 0.9719 1.0984 1.0984 1.1574 1.1574 1.7379 1.7379 1.7475 1.7475 1.9801 1.9801 2.3003 2.3003 2.4274 2.4274 2.9952 2.9952 3.9245 3.9245 4.0665 4.0665 4.0716 4.0716 k = 0.2840 0.4918-0.0000 ( 13266 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8060 -28.8060 -28.8014 -28.8014 -28.8013 -28.8013 -12.7088 -12.7088 -12.6044 -12.6044 -12.5986 -12.5986 -12.5942 -12.5942 -12.5879 -12.5879 -12.5141 -12.5141 -12.4163 -12.4163 -12.3528 -12.3528 -12.3429 -12.3429 -12.2953 -12.2953 -12.2468 -12.2468 -12.2179 -12.2179 -12.1969 -12.1969 -12.1945 -12.1945 -12.1522 -12.1522 -12.1379 -12.1379 -12.1279 -12.1279 -12.1101 -12.1101 -8.8732 -8.8732 -8.8207 -8.8207 0.9558 0.9558 1.1219 1.1219 1.1565 1.1565 1.7378 1.7378 1.7479 1.7479 1.9804 1.9804 2.2480 2.2480 2.4409 2.4409 3.0498 3.0498 3.8989 3.8989 4.0303 4.0303 4.0948 4.0948 k = 0.2716 0.4704-0.0000 ( 13264 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7090 -12.7090 -12.6045 -12.6045 -12.5987 -12.5987 -12.5943 -12.5943 -12.5878 -12.5878 -12.5139 -12.5139 -12.4163 -12.4163 -12.3529 -12.3529 -12.3430 -12.3430 -12.2954 -12.2954 -12.2466 -12.2466 -12.2178 -12.2178 -12.1970 -12.1970 -12.1943 -12.1943 -12.1522 -12.1522 -12.1377 -12.1377 -12.1278 -12.1278 -12.1101 -12.1101 -8.8733 -8.8733 -8.8207 -8.8207 0.9413 0.9413 1.1455 1.1455 1.1552 1.1552 1.7376 1.7376 1.7483 1.7483 1.9807 1.9807 2.1923 2.1923 2.4567 2.4567 3.1097 3.1097 3.8725 3.8725 3.9893 3.9893 4.1247 4.1247 k = 0.2593 0.4491-0.0000 ( 13268 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8061 -28.8061 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7091 -12.7091 -12.6047 -12.6047 -12.5988 -12.5988 -12.5944 -12.5944 -12.5876 -12.5876 -12.5137 -12.5137 -12.4164 -12.4164 -12.3531 -12.3531 -12.3432 -12.3432 -12.2954 -12.2954 -12.2464 -12.2464 -12.2178 -12.2178 -12.1972 -12.1972 -12.1942 -12.1942 -12.1523 -12.1523 -12.1374 -12.1374 -12.1275 -12.1275 -12.1101 -12.1101 -8.8734 -8.8734 -8.8207 -8.8207 0.9285 0.9285 1.1536 1.1536 1.1689 1.1689 1.7376 1.7376 1.7488 1.7488 1.9810 1.9810 2.1354 2.1354 2.4750 2.4750 3.1723 3.1723 3.8455 3.8455 3.9490 3.9490 4.1567 4.1567 k = 0.2469 0.4277-0.0000 ( 13278 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8061 -28.8061 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7094 -12.7094 -12.6048 -12.6048 -12.5990 -12.5990 -12.5945 -12.5945 -12.5875 -12.5875 -12.5135 -12.5135 -12.4164 -12.4164 -12.3534 -12.3534 -12.3434 -12.3434 -12.2955 -12.2955 -12.2462 -12.2462 -12.2177 -12.2177 -12.1972 -12.1972 -12.1941 -12.1941 -12.1525 -12.1525 -12.1371 -12.1371 -12.1273 -12.1273 -12.1101 -12.1101 -8.8735 -8.8735 -8.8207 -8.8207 0.9173 0.9173 1.1515 1.1515 1.1919 1.1919 1.7376 1.7376 1.7492 1.7492 1.9814 1.9814 2.0784 2.0784 2.4960 2.4960 3.2359 3.2359 3.8181 3.8181 3.9099 3.9099 4.1907 4.1907 k = 0.2346 0.4063-0.0000 ( 13286 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8061 -28.8061 -28.8059 -28.8059 -28.8014 -28.8014 -28.8013 -28.8013 -12.7096 -12.7096 -12.6049 -12.6049 -12.5992 -12.5992 -12.5946 -12.5946 -12.5873 -12.5873 -12.5132 -12.5132 -12.4165 -12.4165 -12.3537 -12.3537 -12.3436 -12.3436 -12.2955 -12.2955 -12.2459 -12.2459 -12.2176 -12.2176 -12.1973 -12.1973 -12.1939 -12.1939 -12.1526 -12.1526 -12.1367 -12.1367 -12.1271 -12.1271 -12.1100 -12.1100 -8.8736 -8.8736 -8.8207 -8.8207 0.9078 0.9078 1.1491 1.1491 1.2143 1.2143 1.7377 1.7377 1.7497 1.7497 1.9817 1.9817 2.0224 2.0224 2.5199 2.5199 3.2988 3.2988 3.7907 3.7907 3.8726 3.8726 4.2269 4.2269 k = 0.2222 0.3849-0.0000 ( 13270 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8061 -28.8061 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7098 -12.7098 -12.6050 -12.6050 -12.5994 -12.5994 -12.5947 -12.5947 -12.5872 -12.5872 -12.5129 -12.5129 -12.4166 -12.4166 -12.3540 -12.3540 -12.3438 -12.3438 -12.2956 -12.2956 -12.2456 -12.2456 -12.2175 -12.2175 -12.1973 -12.1973 -12.1938 -12.1938 -12.1527 -12.1527 -12.1362 -12.1362 -12.1268 -12.1268 -12.1100 -12.1100 -8.8738 -8.8738 -8.8207 -8.8207 0.8999 0.8999 1.1464 1.1464 1.2358 1.2358 1.7379 1.7379 1.7502 1.7502 1.9658 1.9658 1.9838 1.9838 2.5470 2.5470 3.3598 3.3598 3.7634 3.7634 3.8374 3.8374 4.2652 4.2652 k = 0.2099 0.3635-0.0000 ( 13293 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8061 -28.8061 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7101 -12.7101 -12.6052 -12.6052 -12.5996 -12.5996 -12.5948 -12.5948 -12.5870 -12.5870 -12.5126 -12.5126 -12.4167 -12.4167 -12.3543 -12.3543 -12.3441 -12.3441 -12.2956 -12.2956 -12.2453 -12.2453 -12.2174 -12.2174 -12.1972 -12.1972 -12.1938 -12.1938 -12.1529 -12.1529 -12.1356 -12.1356 -12.1266 -12.1266 -12.1099 -12.1099 -8.8740 -8.8740 -8.8208 -8.8208 0.8935 0.8935 1.1433 1.1433 1.2564 1.2564 1.7383 1.7383 1.7506 1.7506 1.9132 1.9132 1.9836 1.9836 2.5773 2.5773 3.4172 3.4172 3.7363 3.7363 3.8052 3.8052 4.3058 4.3058 k = 0.1975 0.3421-0.0000 ( 13281 PWs) bands (ev): -28.8431 -28.8431 -28.8332 -28.8332 -28.8060 -28.8060 -28.8058 -28.8058 -28.8014 -28.8014 -28.8013 -28.8013 -12.7104 -12.7104 -12.6053 -12.6053 -12.5999 -12.5999 -12.5949 -12.5949 -12.5869 -12.5869 -12.5122 -12.5122 -12.4168 -12.4168 -12.3547 -12.3547 -12.3444 -12.3444 -12.2957 -12.2957 -12.2450 -12.2450 -12.2173 -12.2173 -12.1972 -12.1972 -12.1937 -12.1937 -12.1531 -12.1531 -12.1350 -12.1350 -12.1263 -12.1263 -12.1099 -12.1099 -8.8742 -8.8742 -8.8208 -8.8208 0.8886 0.8886 1.1399 1.1399 1.2757 1.2757 1.7387 1.7387 1.7510 1.7510 1.8618 1.8618 1.9842 1.9842 2.6110 2.6110 3.4692 3.4692 3.7098 3.7098 3.7768 3.7768 4.3485 4.3485 k = 0.1852 0.3208-0.0000 ( 13277 PWs) bands (ev): -28.8432 -28.8432 -28.8332 -28.8332 -28.8060 -28.8060 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7108 -12.7108 -12.6054 -12.6054 -12.6001 -12.6001 -12.5950 -12.5950 -12.5867 -12.5867 -12.5118 -12.5118 -12.4170 -12.4170 -12.3551 -12.3551 -12.3448 -12.3448 -12.2957 -12.2957 -12.2446 -12.2446 -12.2172 -12.2172 -12.1971 -12.1971 -12.1937 -12.1937 -12.1533 -12.1533 -12.1344 -12.1344 -12.1260 -12.1260 -12.1098 -12.1098 -8.8744 -8.8744 -8.8208 -8.8208 0.8851 0.8851 1.1363 1.1363 1.2939 1.2939 1.7392 1.7392 1.7513 1.7513 1.8125 1.8125 1.9850 1.9850 2.6482 2.6482 3.5135 3.5135 3.6840 3.6840 3.7537 3.7537 4.3936 4.3936 k = 0.1728 0.2994-0.0000 ( 13293 PWs) bands (ev): -28.8432 -28.8432 -28.8333 -28.8333 -28.8059 -28.8059 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7111 -12.7111 -12.6056 -12.6056 -12.6003 -12.6003 -12.5951 -12.5951 -12.5866 -12.5866 -12.5115 -12.5115 -12.4171 -12.4171 -12.3556 -12.3556 -12.3451 -12.3451 -12.2958 -12.2958 -12.2442 -12.2442 -12.2171 -12.2171 -12.1970 -12.1970 -12.1937 -12.1937 -12.1535 -12.1535 -12.1337 -12.1337 -12.1257 -12.1257 -12.1098 -12.1098 -8.8746 -8.8746 -8.8208 -8.8208 0.8829 0.8829 1.1325 1.1325 1.3106 1.3106 1.7398 1.7398 1.7514 1.7514 1.7655 1.7655 1.9857 1.9857 2.6889 2.6889 3.5470 3.5470 3.6590 3.6590 3.7380 3.7380 4.4409 4.4409 k = 0.1605 0.2780-0.0000 ( 13295 PWs) bands (ev): -28.8433 -28.8433 -28.8333 -28.8333 -28.8059 -28.8059 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7114 -12.7114 -12.6057 -12.6057 -12.6006 -12.6006 -12.5952 -12.5952 -12.5866 -12.5866 -12.5111 -12.5111 -12.4173 -12.4173 -12.3560 -12.3560 -12.3455 -12.3455 -12.2958 -12.2958 -12.2439 -12.2439 -12.2170 -12.2170 -12.1969 -12.1969 -12.1936 -12.1936 -12.1537 -12.1537 -12.1329 -12.1329 -12.1255 -12.1255 -12.1097 -12.1097 -8.8749 -8.8749 -8.8209 -8.8209 0.8819 0.8819 1.1285 1.1285 1.3259 1.3259 1.7202 1.7202 1.7406 1.7406 1.7522 1.7522 1.9865 1.9865 2.7331 2.7331 3.5665 3.5665 3.6350 3.6350 3.7323 3.7323 4.4905 4.4905 k = 0.1481 0.2566-0.0000 ( 13301 PWs) bands (ev): -28.8433 -28.8433 -28.8333 -28.8333 -28.8059 -28.8059 -28.8057 -28.8057 -28.8014 -28.8014 -28.8013 -28.8013 -12.7118 -12.7118 -12.6058 -12.6058 -12.6008 -12.6008 -12.5953 -12.5953 -12.5865 -12.5865 -12.5108 -12.5108 -12.4174 -12.4174 -12.3565 -12.3565 -12.3458 -12.3458 -12.2958 -12.2958 -12.2435 -12.2435 -12.2168 -12.2168 -12.1968 -12.1968 -12.1936 -12.1936 -12.1539 -12.1539 -12.1322 -12.1322 -12.1252 -12.1252 -12.1096 -12.1096 -8.8751 -8.8751 -8.8209 -8.8209 0.8820 0.8820 1.1244 1.1244 1.3398 1.3398 1.6780 1.6780 1.7413 1.7413 1.7524 1.7524 1.9873 1.9873 2.7808 2.7808 3.5718 3.5718 3.6122 3.6122 3.7364 3.7364 4.5261 4.5261 k = 0.1358 0.2352-0.0000 ( 13309 PWs) bands (ev): -28.8434 -28.8434 -28.8334 -28.8334 -28.8058 -28.8058 -28.8057 -28.8057 -28.8013 -28.8013 -28.8013 -28.8013 -12.7121 -12.7121 -12.6060 -12.6060 -12.6010 -12.6010 -12.5954 -12.5954 -12.5865 -12.5865 -12.5104 -12.5104 -12.4176 -12.4176 -12.3569 -12.3569 -12.3462 -12.3462 -12.2959 -12.2959 -12.2431 -12.2431 -12.2167 -12.2167 -12.1967 -12.1967 -12.1936 -12.1936 -12.1541 -12.1541 -12.1314 -12.1314 -12.1250 -12.1250 -12.1096 -12.1096 -8.8753 -8.8753 -8.8209 -8.8209 0.8832 0.8832 1.1203 1.1203 1.3523 1.3523 1.6383 1.6383 1.7420 1.7420 1.7527 1.7527 1.9881 1.9881 2.8318 2.8318 3.5670 3.5670 3.5907 3.5907 3.7460 3.7460 4.4585 4.4585 k = 0.1235 0.2138-0.0000 ( 13317 PWs) bands (ev): -28.8435 -28.8435 -28.8334 -28.8334 -28.8058 -28.8058 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7124 -12.7124 -12.6061 -12.6061 -12.6012 -12.6012 -12.5954 -12.5954 -12.5865 -12.5865 -12.5101 -12.5101 -12.4178 -12.4178 -12.3574 -12.3574 -12.3465 -12.3465 -12.2959 -12.2959 -12.2427 -12.2427 -12.2165 -12.2165 -12.1966 -12.1966 -12.1935 -12.1935 -12.1543 -12.1543 -12.1306 -12.1306 -12.1247 -12.1247 -12.1095 -12.1095 -8.8756 -8.8756 -8.8209 -8.8209 0.8852 0.8852 1.1162 1.1162 1.3633 1.3633 1.6012 1.6012 1.7427 1.7427 1.7530 1.7530 1.9889 1.9889 2.8859 2.8859 3.5572 3.5572 3.5707 3.5707 3.7564 3.7564 4.3891 4.3891 k = 0.1111 0.1925-0.0000 ( 13321 PWs) bands (ev): -28.8435 -28.8435 -28.8334 -28.8334 -28.8058 -28.8058 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7127 -12.7127 -12.6062 -12.6062 -12.6013 -12.6013 -12.5955 -12.5955 -12.5866 -12.5866 -12.5097 -12.5097 -12.4179 -12.4179 -12.3578 -12.3578 -12.3469 -12.3469 -12.2960 -12.2960 -12.2423 -12.2423 -12.2164 -12.2164 -12.1966 -12.1966 -12.1935 -12.1935 -12.1545 -12.1545 -12.1299 -12.1299 -12.1245 -12.1245 -12.1094 -12.1094 -8.8758 -8.8758 -8.8210 -8.8210 0.8879 0.8879 1.1123 1.1123 1.3730 1.3730 1.5670 1.5670 1.7434 1.7434 1.7533 1.7533 1.9896 1.9896 2.9430 2.9430 3.5456 3.5456 3.5522 3.5522 3.7648 3.7648 4.3185 4.3185 k = 0.0988 0.1711-0.0000 ( 13303 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8057 -28.8057 -28.8056 -28.8056 -28.8013 -28.8013 -28.8013 -28.8013 -12.7130 -12.7130 -12.6063 -12.6063 -12.6014 -12.6014 -12.5955 -12.5955 -12.5866 -12.5866 -12.5094 -12.5094 -12.4181 -12.4181 -12.3582 -12.3582 -12.3472 -12.3472 -12.2960 -12.2960 -12.2420 -12.2420 -12.2162 -12.2162 -12.1965 -12.1965 -12.1934 -12.1934 -12.1547 -12.1547 -12.1292 -12.1292 -12.1242 -12.1242 -12.1093 -12.1093 -8.8760 -8.8760 -8.8210 -8.8210 0.8912 0.8912 1.1085 1.1085 1.3814 1.3814 1.5358 1.5358 1.7440 1.7440 1.7536 1.7536 1.9904 1.9904 3.0027 3.0027 3.5336 3.5336 3.5358 3.5358 3.7703 3.7703 4.2467 4.2467 k = 0.0864 0.1497-0.0000 ( 13307 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8057 -28.8057 -28.8056 -28.8056 -28.8013 -28.8013 -28.8012 -28.8012 -12.7133 -12.7133 -12.6064 -12.6064 -12.6015 -12.6015 -12.5955 -12.5955 -12.5867 -12.5867 -12.5091 -12.5091 -12.4182 -12.4182 -12.3586 -12.3586 -12.3475 -12.3475 -12.2960 -12.2960 -12.2417 -12.2417 -12.2161 -12.2161 -12.1965 -12.1965 -12.1933 -12.1933 -12.1548 -12.1548 -12.1286 -12.1286 -12.1240 -12.1240 -12.1093 -12.1093 -8.8762 -8.8762 -8.8210 -8.8210 0.8948 0.8948 1.1050 1.1050 1.3885 1.3885 1.5076 1.5076 1.7446 1.7446 1.7539 1.7539 1.9911 1.9911 3.0647 3.0647 3.5198 3.5198 3.5239 3.5239 3.7730 3.7730 4.1741 4.1741 k = 0.0741 0.1283-0.0000 ( 13309 PWs) bands (ev): -28.8436 -28.8436 -28.8335 -28.8335 -28.8056 -28.8056 -28.8056 -28.8056 -28.8013 -28.8013 -28.8012 -28.8012 -12.7135 -12.7135 -12.6065 -12.6065 -12.6016 -12.6016 -12.5956 -12.5956 -12.5867 -12.5867 -12.5089 -12.5089 -12.4183 -12.4183 -12.3589 -12.3589 -12.3478 -12.3478 -12.2960 -12.2960 -12.2414 -12.2414 -12.2160 -12.2160 -12.1965 -12.1965 -12.1932 -12.1932 -12.1550 -12.1550 -12.1280 -12.1280 -12.1238 -12.1238 -12.1092 -12.1092 -8.8764 -8.8764 -8.8210 -8.8210 0.8986 0.8986 1.1018 1.1018 1.3946 1.3946 1.4826 1.4826 1.7451 1.7451 1.7542 1.7542 1.9917 1.9917 3.1285 3.1285 3.5066 3.5066 3.5145 3.5145 3.7735 3.7735 4.1012 4.1012 k = 0.0617 0.1069-0.0000 ( 13305 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8056 -28.8056 -28.8056 -28.8056 -28.8012 -28.8012 -28.8012 -28.8012 -12.7137 -12.7137 -12.6066 -12.6066 -12.6017 -12.6017 -12.5956 -12.5956 -12.5868 -12.5868 -12.5087 -12.5087 -12.4185 -12.4185 -12.3592 -12.3592 -12.3480 -12.3480 -12.2960 -12.2960 -12.2411 -12.2411 -12.2159 -12.2159 -12.1965 -12.1965 -12.1931 -12.1931 -12.1551 -12.1551 -12.1275 -12.1275 -12.1236 -12.1236 -12.1091 -12.1091 -8.8765 -8.8765 -8.8210 -8.8210 0.9023 0.9023 1.0990 1.0990 1.3995 1.3995 1.4611 1.4611 1.7456 1.7456 1.7545 1.7545 1.9923 1.9923 3.1933 3.1933 3.4952 3.4952 3.5065 3.5065 3.7724 3.7724 4.0287 4.0287 k = 0.0494 0.0855-0.0000 ( 13285 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8056 -28.8056 -28.8056 -28.8056 -28.8012 -28.8012 -28.8012 -28.8012 -12.7139 -12.7139 -12.6067 -12.6067 -12.6017 -12.6017 -12.5956 -12.5956 -12.5868 -12.5868 -12.5085 -12.5085 -12.4185 -12.4185 -12.3595 -12.3595 -12.3482 -12.3482 -12.2961 -12.2961 -12.2409 -12.2409 -12.2158 -12.2158 -12.1966 -12.1966 -12.1930 -12.1930 -12.1552 -12.1552 -12.1271 -12.1271 -12.1235 -12.1235 -12.1091 -12.1091 -8.8767 -8.8767 -8.8210 -8.8210 0.9058 0.9058 1.0966 1.0966 1.4034 1.4034 1.4432 1.4432 1.7459 1.7459 1.7548 1.7548 1.9927 1.9927 3.2581 3.2581 3.4858 3.4858 3.5000 3.5000 3.7704 3.7704 3.9575 3.9575 k = 0.0370 0.0642-0.0000 ( 13285 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8056 -28.8056 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7140 -12.7140 -12.6067 -12.6067 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5083 -12.5083 -12.4186 -12.4186 -12.3597 -12.3597 -12.3484 -12.3484 -12.2961 -12.2961 -12.2407 -12.2407 -12.2157 -12.2157 -12.1966 -12.1966 -12.1930 -12.1930 -12.1553 -12.1553 -12.1268 -12.1268 -12.1233 -12.1233 -12.1090 -12.1090 -8.8768 -8.8768 -8.8211 -8.8211 0.9088 0.9088 1.0947 1.0947 1.4064 1.4064 1.4290 1.4290 1.7462 1.7462 1.7550 1.7550 1.9931 1.9931 3.3210 3.3210 3.4785 3.4785 3.4951 3.4951 3.7681 3.7681 3.8898 3.8898 k = 0.0247 0.0428-0.0000 ( 13277 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7141 -12.7141 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5082 -12.5082 -12.4187 -12.4187 -12.3598 -12.3598 -12.3485 -12.3485 -12.2961 -12.2961 -12.2406 -12.2406 -12.2157 -12.2157 -12.1966 -12.1966 -12.1929 -12.1929 -12.1554 -12.1554 -12.1266 -12.1266 -12.1232 -12.1232 -12.1090 -12.1090 -8.8768 -8.8768 -8.8211 -8.8211 0.9111 0.9111 1.0933 1.0933 1.4084 1.4084 1.4189 1.4189 1.7464 1.7464 1.7552 1.7552 1.9934 1.9934 3.3782 3.3782 3.4732 3.4732 3.4916 3.4916 3.7659 3.7659 3.8293 3.8293 k = 0.0123 0.0214-0.0000 ( 13263 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7142 -12.7142 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5081 -12.5081 -12.4187 -12.4187 -12.3599 -12.3599 -12.3486 -12.3486 -12.2961 -12.2961 -12.2405 -12.2405 -12.2156 -12.2156 -12.1966 -12.1966 -12.1929 -12.1929 -12.1554 -12.1554 -12.1264 -12.1264 -12.1232 -12.1232 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9125 0.9125 1.0925 1.0925 1.4091 1.4091 1.4132 1.4132 1.7465 1.7465 1.7553 1.7553 1.9935 1.9935 3.4220 3.4220 3.4700 3.4700 3.4896 3.4896 3.7633 3.7633 3.7846 3.7846 k = 0.0000 0.0000 0.0000 ( 13243 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7142 -12.7142 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5081 -12.5081 -12.4187 -12.4187 -12.3599 -12.3599 -12.3486 -12.3486 -12.2961 -12.2961 -12.2405 -12.2405 -12.2156 -12.2156 -12.1966 -12.1966 -12.1928 -12.1928 -12.1554 -12.1554 -12.1264 -12.1264 -12.1231 -12.1231 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9130 0.9130 1.0922 1.0922 1.4087 1.4087 1.4120 1.4120 1.7466 1.7466 1.7553 1.7553 1.9936 1.9936 3.4394 3.4394 3.4689 3.4689 3.4890 3.4890 3.7587 3.7587 3.7706 3.7706 k = 0.0000 0.0000 0.0000 ( 13243 PWs) bands (ev): -28.8437 -28.8437 -28.8335 -28.8335 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7142 -12.7142 -12.6068 -12.6068 -12.6018 -12.6018 -12.5956 -12.5956 -12.5869 -12.5869 -12.5081 -12.5081 -12.4187 -12.4187 -12.3599 -12.3599 -12.3486 -12.3486 -12.2961 -12.2961 -12.2405 -12.2405 -12.2156 -12.2156 -12.1966 -12.1966 -12.1928 -12.1928 -12.1554 -12.1554 -12.1264 -12.1264 -12.1231 -12.1231 -12.1090 -12.1090 -8.8769 -8.8769 -8.8211 -8.8211 0.9130 0.9130 1.0922 1.0922 1.4087 1.4087 1.4120 1.4120 1.7466 1.7466 1.7553 1.7553 1.9936 1.9936 3.4394 3.4394 3.4689 3.4689 3.4890 3.4890 3.7587 3.7587 3.7706 3.7706 k = 0.0000 0.0000 0.0245 ( 13267 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7141 -12.7141 -12.6068 -12.6068 -12.6018 -12.6018 -12.5969 -12.5969 -12.5857 -12.5857 -12.5082 -12.5082 -12.4185 -12.4185 -12.3600 -12.3600 -12.3486 -12.3486 -12.2962 -12.2962 -12.2404 -12.2404 -12.2156 -12.2156 -12.1965 -12.1965 -12.1929 -12.1929 -12.1555 -12.1555 -12.1264 -12.1264 -12.1233 -12.1233 -12.1090 -12.1090 -8.8768 -8.8768 -8.8211 -8.8211 0.9140 0.9140 1.0926 1.0926 1.4091 1.4091 1.4124 1.4124 1.7460 1.7460 1.7548 1.7548 1.9930 1.9930 3.3793 3.3793 3.4409 3.4409 3.5805 3.5805 3.7599 3.7599 3.7718 3.7718 k = 0.0000 0.0000 0.0489 ( 13261 PWs) bands (ev): -28.8437 -28.8437 -28.8336 -28.8336 -28.8055 -28.8055 -28.8055 -28.8055 -28.8012 -28.8012 -28.8012 -28.8012 -12.7138 -12.7138 -12.6068 -12.6068 -12.6019 -12.6019 -12.5998 -12.5998 -12.5830 -12.5830 -12.5084 -12.5084 -12.4180 -12.4180 -12.3600 -12.3600 -12.3485 -12.3485 -12.2964 -12.2964 -12.2401 -12.2401 -12.2155 -12.2155 -12.1961 -12.1961 -12.1930 -12.1930 -12.1558 -12.1558 -12.1263 -12.1263 -12.1238 -12.1238 -12.1091 -12.1091 -8.8765 -8.8765 -8.8213 -8.8213 0.9168 0.9168 1.0939 1.0939 1.4104 1.4104 1.4137 1.4137 1.7444 1.7444 1.7532 1.7532 1.9914 1.9914 3.2829 3.2829 3.4445 3.4445 3.6833 3.6833 3.7636 3.7636 3.7756 3.7756 k = 0.0000 0.0000 0.0734 ( 13285 PWs) bands (ev): -28.8436 -28.8436 -28.8337 -28.8337 -28.8055 -28.8055 -28.8055 -28.8055 -28.8013 -28.8013 -28.8013 -28.8013 -12.7132 -12.7132 -12.6069 -12.6069 -12.6031 -12.6031 -12.6020 -12.6020 -12.5800 -12.5800 -12.5087 -12.5087 -12.4172 -12.4172 -12.3601 -12.3601 -12.3484 -12.3484 -12.2968 -12.2968 -12.2397 -12.2397 -12.2155 -12.2155 -12.1955 -12.1955 -12.1933 -12.1933 -12.1562 -12.1562 -12.1263 -12.1263 -12.1246 -12.1246 -12.1093 -12.1093 -8.8760 -8.8760 -8.8216 -8.8216 0.9214 0.9214 1.0959 1.0959 1.4125 1.4125 1.4159 1.4159 1.7418 1.7418 1.7505 1.7505 1.9886 1.9886 3.1885 3.1885 3.4506 3.4506 3.7698 3.7698 3.7818 3.7818 3.7884 3.7884 k = 0.0000 0.0000 0.0978 ( 13285 PWs) bands (ev): -28.8435 -28.8435 -28.8338 -28.8338 -28.8054 -28.8054 -28.8054 -28.8054 -28.8013 -28.8013 -28.8013 -28.8013 -12.7124 -12.7124 -12.6069 -12.6069 -12.6067 -12.6067 -12.6021 -12.6021 -12.5768 -12.5768 -12.5091 -12.5091 -12.4160 -12.4160 -12.3603 -12.3603 -12.3482 -12.3482 -12.2974 -12.2974 -12.2391 -12.2391 -12.2153 -12.2153 -12.1947 -12.1947 -12.1936 -12.1936 -12.1568 -12.1568 -12.1261 -12.1261 -12.1257 -12.1257 -12.1095 -12.1095 -8.8754 -8.8754 -8.8220 -8.8220 0.9278 0.9278 1.0988 1.0988 1.4155 1.4155 1.4190 1.4190 1.7380 1.7380 1.7467 1.7467 1.9849 1.9849 3.0966 3.0966 3.4592 3.4592 3.7785 3.7785 3.7904 3.7904 3.8953 3.8953 k = 0.0000 0.0000 0.1223 ( 13273 PWs) bands (ev): -28.8434 -28.8434 -28.8339 -28.8339 -28.8054 -28.8054 -28.8054 -28.8054 -28.8014 -28.8014 -28.8014 -28.8014 -12.7114 -12.7114 -12.6104 -12.6104 -12.6070 -12.6070 -12.6022 -12.6022 -12.5737 -12.5737 -12.5097 -12.5097 -12.4145 -12.4145 -12.3605 -12.3605 -12.3480 -12.3480 -12.2981 -12.2981 -12.2383 -12.2383 -12.2151 -12.2151 -12.1940 -12.1940 -12.1937 -12.1937 -12.1576 -12.1576 -12.1270 -12.1270 -12.1260 -12.1260 -12.1098 -12.1098 -8.8745 -8.8745 -8.8226 -8.8226 0.9360 0.9360 1.1025 1.1025 1.4194 1.4194 1.4229 1.4229 1.7333 1.7333 1.7419 1.7419 1.9804 1.9804 3.0070 3.0070 3.4702 3.4702 3.7895 3.7895 3.8014 3.8014 4.0041 4.0041 k = 0.0000 0.0000 0.1467 ( 13285 PWs) bands (ev): -28.8432 -28.8432 -28.8341 -28.8341 -28.8053 -28.8053 -28.8053 -28.8053 -28.8014 -28.8014 -28.8014 -28.8014 -12.7103 -12.7103 -12.6141 -12.6141 -12.6071 -12.6071 -12.6025 -12.6025 -12.5706 -12.5706 -12.5104 -12.5104 -12.4127 -12.4127 -12.3607 -12.3607 -12.3478 -12.3478 -12.2990 -12.2990 -12.2374 -12.2374 -12.2148 -12.2148 -12.1945 -12.1945 -12.1925 -12.1925 -12.1586 -12.1586 -12.1286 -12.1286 -12.1258 -12.1258 -12.1101 -12.1101 -8.8735 -8.8735 -8.8232 -8.8232 0.9458 0.9458 1.1068 1.1068 1.4240 1.4240 1.4276 1.4276 1.7276 1.7276 1.7362 1.7362 1.9752 1.9752 2.9201 2.9201 3.4837 3.4837 3.8029 3.8029 3.8148 3.8148 4.1145 4.1145 k = 0.0000 0.0000 0.1712 ( 13290 PWs) bands (ev): -28.8431 -28.8431 -28.8342 -28.8342 -28.8052 -28.8052 -28.8052 -28.8052 -28.8015 -28.8015 -28.8015 -28.8015 -12.7088 -12.7088 -12.6179 -12.6179 -12.6072 -12.6072 -12.6027 -12.6027 -12.5675 -12.5675 -12.5112 -12.5112 -12.4107 -12.4107 -12.3610 -12.3610 -12.3474 -12.3474 -12.3000 -12.3000 -12.2363 -12.2363 -12.2144 -12.2144 -12.1950 -12.1950 -12.1911 -12.1911 -12.1598 -12.1598 -12.1305 -12.1305 -12.1256 -12.1256 -12.1105 -12.1105 -8.8723 -8.8723 -8.8240 -8.8240 0.9572 0.9572 1.1117 1.1117 1.4295 1.4295 1.4332 1.4332 1.7210 1.7210 1.7295 1.7295 1.9694 1.9694 2.8358 2.8358 3.4996 3.4996 3.8186 3.8186 3.8305 3.8305 4.2266 4.2266 k = 0.0000 0.0000 0.1956 ( 13308 PWs) bands (ev): -28.8429 -28.8429 -28.8345 -28.8345 -28.8052 -28.8052 -28.8052 -28.8052 -28.8016 -28.8016 -28.8016 -28.8016 -12.7073 -12.7073 -12.6218 -12.6218 -12.6073 -12.6073 -12.6029 -12.6029 -12.5645 -12.5645 -12.5121 -12.5121 -12.4083 -12.4083 -12.3613 -12.3613 -12.3470 -12.3470 -12.3012 -12.3012 -12.2351 -12.2351 -12.2139 -12.2139 -12.1957 -12.1957 -12.1896 -12.1896 -12.1612 -12.1612 -12.1325 -12.1325 -12.1253 -12.1253 -12.1109 -12.1109 -8.8709 -8.8709 -8.8248 -8.8248 0.9700 0.9700 1.1171 1.1171 1.4357 1.4357 1.4395 1.4395 1.7136 1.7136 1.7219 1.7219 1.9634 1.9634 2.7543 2.7543 3.5180 3.5180 3.8365 3.8365 3.8484 3.8484 4.3401 4.3401 k = 0.0000 0.0000 0.2201 ( 13332 PWs) bands (ev): -28.8427 -28.8427 -28.8347 -28.8347 -28.8051 -28.8051 -28.8051 -28.8051 -28.8017 -28.8017 -28.8017 -28.8017 -12.7055 -12.7055 -12.6256 -12.6256 -12.6074 -12.6074 -12.6032 -12.6032 -12.5616 -12.5616 -12.5132 -12.5132 -12.4058 -12.4058 -12.3617 -12.3617 -12.3466 -12.3466 -12.3026 -12.3026 -12.2337 -12.2337 -12.2132 -12.2132 -12.1965 -12.1965 -12.1880 -12.1880 -12.1628 -12.1628 -12.1347 -12.1347 -12.1250 -12.1250 -12.1114 -12.1114 -8.8694 -8.8694 -8.8258 -8.8258 0.9841 0.9841 1.1229 1.1229 1.4426 1.4426 1.4466 1.4466 1.7053 1.7053 1.7136 1.7136 1.9572 1.9572 2.6758 2.6758 3.5388 3.5388 3.8566 3.8566 3.8684 3.8684 4.4551 4.4551 k = 0.0000 0.0000 0.2446 ( 13326 PWs) bands (ev): -28.8424 -28.8424 -28.8349 -28.8349 -28.8050 -28.8050 -28.8050 -28.8050 -28.8018 -28.8018 -28.8018 -28.8018 -12.7035 -12.7035 -12.6295 -12.6295 -12.6074 -12.6074 -12.6035 -12.6035 -12.5588 -12.5588 -12.5143 -12.5143 -12.4031 -12.4031 -12.3622 -12.3622 -12.3460 -12.3460 -12.3042 -12.3042 -12.2322 -12.2322 -12.2124 -12.2124 -12.1974 -12.1974 -12.1862 -12.1862 -12.1646 -12.1646 -12.1369 -12.1369 -12.1247 -12.1247 -12.1120 -12.1120 -8.8678 -8.8678 -8.8269 -8.8269 0.9993 0.9993 1.1290 1.1290 1.4503 1.4503 1.4544 1.4544 1.6963 1.6963 1.7045 1.7045 1.9514 1.9514 2.6003 2.6003 3.5620 3.5620 3.8788 3.8788 3.8906 3.8906 4.5712 4.5712 k = 0.0000 0.0000 0.2690 ( 13308 PWs) bands (ev): -28.8421 -28.8421 -28.8352 -28.8352 -28.8049 -28.8049 -28.8049 -28.8049 -28.8019 -28.8019 -28.8019 -28.8019 -12.7013 -12.7013 -12.6334 -12.6334 -12.6075 -12.6075 -12.6038 -12.6038 -12.5560 -12.5560 -12.5155 -12.5155 -12.4002 -12.4002 -12.3627 -12.3627 -12.3453 -12.3453 -12.3059 -12.3059 -12.2307 -12.2307 -12.2115 -12.2115 -12.1983 -12.1983 -12.1844 -12.1844 -12.1665 -12.1665 -12.1393 -12.1393 -12.1244 -12.1244 -12.1125 -12.1125 -8.8661 -8.8661 -8.8282 -8.8282 1.0154 1.0154 1.1352 1.1352 1.4586 1.4586 1.4629 1.4629 1.6867 1.6867 1.6947 1.6947 1.9462 1.9462 2.5279 2.5279 3.5877 3.5877 3.9030 3.9030 3.9148 3.9148 4.5947 4.5947 k = 0.0000 0.0000 0.2935 ( 13302 PWs) bands (ev): -28.8418 -28.8418 -28.8355 -28.8355 -28.8047 -28.8047 -28.8047 -28.8047 -28.8020 -28.8020 -28.8020 -28.8020 -12.6989 -12.6989 -12.6373 -12.6373 -12.6075 -12.6075 -12.6042 -12.6042 -12.5533 -12.5533 -12.5168 -12.5168 -12.3972 -12.3972 -12.3632 -12.3632 -12.3445 -12.3445 -12.3077 -12.3077 -12.2290 -12.2290 -12.2104 -12.2104 -12.1994 -12.1994 -12.1824 -12.1824 -12.1687 -12.1687 -12.1417 -12.1417 -12.1240 -12.1240 -12.1131 -12.1131 -8.8642 -8.8642 -8.8295 -8.8295 1.0321 1.0321 1.1414 1.1414 1.4676 1.4676 1.4721 1.4721 1.6764 1.6764 1.6843 1.6843 1.9419 1.9419 2.4590 2.4590 3.6158 3.6158 3.9292 3.9292 3.9409 3.9409 4.5231 4.5231 k = 0.0000 0.0000 0.3179 ( 13326 PWs) bands (ev): -28.8416 -28.8416 -28.8358 -28.8358 -28.8046 -28.8046 -28.8046 -28.8046 -28.8022 -28.8022 -28.8022 -28.8022 -12.6964 -12.6964 -12.6412 -12.6412 -12.6076 -12.6076 -12.6045 -12.6045 -12.5507 -12.5507 -12.5183 -12.5183 -12.3941 -12.3941 -12.3639 -12.3639 -12.3435 -12.3435 -12.3098 -12.3098 -12.2273 -12.2273 -12.2091 -12.2091 -12.2005 -12.2005 -12.1804 -12.1804 -12.1712 -12.1712 -12.1441 -12.1441 -12.1236 -12.1236 -12.1138 -12.1138 -8.8623 -8.8623 -8.8309 -8.8309 1.0491 1.0491 1.1473 1.1473 1.4772 1.4772 1.4818 1.4818 1.6656 1.6656 1.6733 1.6733 1.9390 1.9390 2.3936 2.3936 3.6462 3.6462 3.9572 3.9572 3.9688 3.9688 4.4536 4.4536 k = 0.0000 0.0000 0.3424 ( 13314 PWs) bands (ev): -28.8412 -28.8412 -28.8361 -28.8361 -28.8045 -28.8045 -28.8045 -28.8045 -28.8023 -28.8023 -28.8023 -28.8023 -12.6938 -12.6938 -12.6451 -12.6451 -12.6076 -12.6076 -12.6048 -12.6048 -12.5481 -12.5481 -12.5197 -12.5197 -12.3911 -12.3911 -12.3646 -12.3646 -12.3424 -12.3424 -12.3120 -12.3120 -12.2255 -12.2255 -12.2077 -12.2077 -12.2018 -12.2018 -12.1783 -12.1783 -12.1737 -12.1737 -12.1465 -12.1465 -12.1231 -12.1231 -12.1144 -12.1144 -8.8603 -8.8603 -8.8325 -8.8325 1.0661 1.0661 1.1527 1.1527 1.4872 1.4872 1.4921 1.4921 1.6544 1.6544 1.6619 1.6619 1.9380 1.9380 2.3319 2.3319 3.6791 3.6791 3.9870 3.9870 3.9986 3.9986 4.3862 4.3862 k = 0.0000 0.0000 0.3668 ( 13302 PWs) bands (ev): -28.8409 -28.8409 -28.8364 -28.8364 -28.8043 -28.8043 -28.8043 -28.8043 -28.8025 -28.8025 -28.8025 -28.8025 -12.6909 -12.6909 -12.6490 -12.6490 -12.6076 -12.6076 -12.6051 -12.6051 -12.5456 -12.5456 -12.5213 -12.5213 -12.3881 -12.3881 -12.3654 -12.3654 -12.3411 -12.3411 -12.3143 -12.3143 -12.2237 -12.2237 -12.2061 -12.2061 -12.2031 -12.2031 -12.1763 -12.1763 -12.1762 -12.1762 -12.1488 -12.1488 -12.1226 -12.1226 -12.1151 -12.1151 -8.8582 -8.8582 -8.8341 -8.8341 1.0828 1.0828 1.1574 1.1574 1.4978 1.4978 1.5029 1.5029 1.6427 1.6427 1.6501 1.6501 1.9393 1.9393 2.2742 2.2742 3.7144 3.7144 4.0185 4.0185 4.0300 4.0300 4.3209 4.3209 k = 0.0000 0.0000 0.3913 ( 13302 PWs) bands (ev): -28.8405 -28.8405 -28.8368 -28.8368 -28.8042 -28.8042 -28.8042 -28.8042 -28.8026 -28.8026 -28.8026 -28.8026 -12.6880 -12.6880 -12.6529 -12.6529 -12.6075 -12.6075 -12.6055 -12.6055 -12.5432 -12.5432 -12.5230 -12.5230 -12.3851 -12.3851 -12.3663 -12.3663 -12.3396 -12.3396 -12.3167 -12.3167 -12.2218 -12.2218 -12.2045 -12.2045 -12.2043 -12.2043 -12.1791 -12.1791 -12.1740 -12.1740 -12.1512 -12.1512 -12.1221 -12.1221 -12.1157 -12.1157 -8.8561 -8.8561 -8.8358 -8.8358 1.0987 1.0987 1.1610 1.1610 1.5089 1.5089 1.5141 1.5141 1.6308 1.6308 1.6380 1.6380 1.9434 1.9434 2.2206 2.2206 3.7521 3.7521 4.0517 4.0517 4.0630 4.0630 4.2578 4.2578 k = 0.0000 0.0000 0.4157 ( 13314 PWs) bands (ev): -28.8402 -28.8402 -28.8371 -28.8371 -28.8040 -28.8040 -28.8040 -28.8040 -28.8028 -28.8028 -28.8028 -28.8028 -12.6849 -12.6849 -12.6567 -12.6567 -12.6074 -12.6074 -12.6058 -12.6058 -12.5409 -12.5409 -12.5247 -12.5247 -12.3824 -12.3824 -12.3674 -12.3674 -12.3379 -12.3379 -12.3192 -12.3192 -12.2199 -12.2199 -12.2060 -12.2060 -12.2023 -12.2023 -12.1819 -12.1819 -12.1718 -12.1718 -12.1536 -12.1536 -12.1215 -12.1215 -12.1164 -12.1164 -8.8540 -8.8540 -8.8376 -8.8376 1.1136 1.1136 1.1635 1.1635 1.5203 1.5203 1.5257 1.5257 1.6186 1.6186 1.6256 1.6256 1.9508 1.9508 2.1715 2.1715 3.7922 3.7922 4.0864 4.0864 4.0976 4.0976 4.1969 4.1969 k = 0.0000 0.0000 0.4402 ( 13338 PWs) bands (ev): -28.8398 -28.8398 -28.8375 -28.8375 -28.8039 -28.8039 -28.8039 -28.8039 -28.8029 -28.8029 -28.8029 -28.8029 -12.6817 -12.6817 -12.6605 -12.6605 -12.6073 -12.6073 -12.6061 -12.6061 -12.5387 -12.5387 -12.5265 -12.5265 -12.3798 -12.3798 -12.3686 -12.3686 -12.3361 -12.3361 -12.3217 -12.3217 -12.2181 -12.2181 -12.2075 -12.2075 -12.2003 -12.2003 -12.1848 -12.1848 -12.1696 -12.1696 -12.1559 -12.1559 -12.1210 -12.1210 -12.1171 -12.1171 -8.8519 -8.8519 -8.8395 -8.8395 1.1269 1.1269 1.1643 1.1643 1.5320 1.5320 1.5377 1.5377 1.6062 1.6062 1.6130 1.6130 1.9620 1.9620 2.1269 2.1269 3.8346 3.8346 4.1226 4.1226 4.1336 4.1336 4.1383 4.1383 k = 0.0000 0.0000 0.4647 ( 13356 PWs) bands (ev): -28.8394 -28.8394 -28.8379 -28.8379 -28.8037 -28.8037 -28.8037 -28.8037 -28.8031 -28.8031 -28.8031 -28.8031 -12.6784 -12.6784 -12.6642 -12.6642 -12.6072 -12.6072 -12.6064 -12.6064 -12.5365 -12.5365 -12.5284 -12.5284 -12.3774 -12.3774 -12.3700 -12.3700 -12.3340 -12.3340 -12.3243 -12.3243 -12.2162 -12.2162 -12.2092 -12.2092 -12.1980 -12.1980 -12.1876 -12.1876 -12.1674 -12.1674 -12.1582 -12.1582 -12.1204 -12.1204 -12.1178 -12.1178 -8.8497 -8.8497 -8.8414 -8.8414 1.1384 1.1384 1.1634 1.1634 1.5440 1.5440 1.5499 1.5499 1.5937 1.5937 1.6004 1.6004 1.9775 1.9775 2.0871 2.0871 3.8794 3.8794 4.0819 4.0819 4.1602 4.1602 4.1711 4.1711 k = 0.0000 0.0000 0.4891 ( 13362 PWs) bands (ev): -28.8390 -28.8390 -28.8383 -28.8383 -28.8036 -28.8036 -28.8036 -28.8036 -28.8033 -28.8033 -28.8033 -28.8033 -12.6749 -12.6749 -12.6679 -12.6679 -12.6070 -12.6070 -12.6066 -12.6066 -12.5344 -12.5344 -12.5303 -12.5303 -12.3752 -12.3752 -12.3715 -12.3715 -12.3317 -12.3317 -12.3269 -12.3269 -12.2144 -12.2144 -12.2109 -12.2109 -12.1956 -12.1956 -12.1904 -12.1904 -12.1651 -12.1651 -12.1605 -12.1605 -12.1198 -12.1198 -12.1185 -12.1185 -8.8476 -8.8476 -8.8434 -8.8434 1.1479 1.1479 1.1604 1.1604 1.5563 1.5563 1.5623 1.5623 1.5812 1.5812 1.5877 1.5877 1.9975 1.9975 2.0523 2.0523 3.9266 3.9266 4.0278 4.0278 4.1991 4.1991 4.2098 4.2098 k = 0.0000 0.0000 0.5136 ( 13386 PWs) bands (ev): -28.8387 -28.8387 -28.8387 -28.8387 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6715 -12.6715 -12.6714 -12.6714 -12.6069 -12.6069 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3733 -12.3733 -12.3732 -12.3732 -12.3294 -12.3294 -12.3294 -12.3294 -12.2126 -12.2126 -12.2126 -12.2126 -12.1931 -12.1931 -12.1930 -12.1930 -12.1628 -12.1628 -12.1628 -12.1628 -12.1191 -12.1191 -12.1191 -12.1191 -8.8458 -8.8458 -8.8452 -8.8452 1.1551 1.1551 1.1554 1.1554 1.5684 1.5684 1.5689 1.5689 1.5747 1.5747 1.5752 1.5752 2.0222 2.0222 2.0225 2.0225 3.9760 3.9760 3.9760 3.9760 4.2393 4.2393 4.2393 4.2393 k = 0.0000 0.0000 0.5136 ( 13386 PWs) bands (ev): -28.8387 -28.8387 -28.8387 -28.8387 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6715 -12.6715 -12.6714 -12.6714 -12.6069 -12.6069 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3733 -12.3733 -12.3732 -12.3732 -12.3294 -12.3294 -12.3294 -12.3294 -12.2126 -12.2126 -12.2126 -12.2126 -12.1931 -12.1931 -12.1930 -12.1930 -12.1628 -12.1628 -12.1628 -12.1628 -12.1191 -12.1191 -12.1191 -12.1191 -8.8458 -8.8458 -8.8452 -8.8452 1.1551 1.1551 1.1554 1.1554 1.5684 1.5684 1.5689 1.5689 1.5747 1.5747 1.5752 1.5752 2.0222 2.0222 2.0225 2.0225 3.9760 3.9760 3.9760 3.9760 4.2393 4.2393 4.2393 4.2393 k = 0.0208 0.0120 0.5136 ( 13378 PWs) bands (ev): -28.8387 -28.8387 -28.8387 -28.8387 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6715 -12.6715 -12.6714 -12.6714 -12.6068 -12.6068 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3732 -12.3732 -12.3732 -12.3732 -12.3293 -12.3293 -12.3293 -12.3293 -12.2127 -12.2127 -12.2127 -12.2127 -12.1930 -12.1930 -12.1930 -12.1930 -12.1628 -12.1628 -12.1628 -12.1628 -12.1192 -12.1192 -12.1192 -12.1192 -8.8458 -8.8458 -8.8452 -8.8452 1.1557 1.1557 1.1559 1.1559 1.5682 1.5682 1.5688 1.5688 1.5745 1.5745 1.5750 1.5750 2.0233 2.0233 2.0236 2.0236 3.9584 3.9584 3.9584 3.9584 4.2425 4.2425 4.2425 4.2425 k = 0.0417 0.0241 0.5136 ( 13350 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6068 -12.6068 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3732 -12.3732 -12.3731 -12.3731 -12.3292 -12.3292 -12.3292 -12.3292 -12.2127 -12.2127 -12.2127 -12.2127 -12.1930 -12.1930 -12.1930 -12.1930 -12.1629 -12.1629 -12.1629 -12.1629 -12.1192 -12.1192 -12.1192 -12.1192 -8.8458 -8.8458 -8.8452 -8.8452 1.1573 1.1573 1.1576 1.1576 1.5677 1.5677 1.5682 1.5682 1.5739 1.5739 1.5744 1.5744 2.0265 2.0265 2.0268 2.0268 3.9150 3.9150 3.9151 3.9151 4.2412 4.2412 4.2413 4.2413 k = 0.0625 0.0361 0.5136 ( 13322 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6067 -12.6067 -12.6067 -12.6067 -12.5324 -12.5324 -12.5324 -12.5324 -12.3730 -12.3730 -12.3730 -12.3730 -12.3291 -12.3291 -12.3291 -12.3291 -12.2128 -12.2128 -12.2128 -12.2128 -12.1930 -12.1930 -12.1929 -12.1929 -12.1629 -12.1629 -12.1629 -12.1629 -12.1194 -12.1194 -12.1193 -12.1193 -8.8458 -8.8458 -8.8452 -8.8452 1.1601 1.1601 1.1603 1.1603 1.5667 1.5667 1.5673 1.5673 1.5729 1.5729 1.5735 1.5735 2.0319 2.0319 2.0322 2.0322 3.8592 3.8592 3.8592 3.8592 4.2378 4.2378 4.2380 4.2380 k = 0.0833 0.0481 0.5136 ( 13306 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6066 -12.6066 -12.6066 -12.6066 -12.5325 -12.5325 -12.5325 -12.5325 -12.3729 -12.3729 -12.3729 -12.3729 -12.3289 -12.3289 -12.3289 -12.3289 -12.2129 -12.2129 -12.2129 -12.2129 -12.1929 -12.1929 -12.1929 -12.1929 -12.1630 -12.1630 -12.1630 -12.1630 -12.1195 -12.1195 -12.1195 -12.1195 -8.8458 -8.8458 -8.8451 -8.8451 1.1638 1.1638 1.1641 1.1641 1.5653 1.5653 1.5660 1.5660 1.5715 1.5715 1.5722 1.5722 2.0394 2.0394 2.0397 2.0397 3.7979 3.7979 3.7979 3.7979 4.2329 4.2329 4.2332 4.2332 k = 0.1042 0.0601 0.5136 ( 13302 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6065 -12.6065 -12.6065 -12.6065 -12.5326 -12.5326 -12.5326 -12.5326 -12.3727 -12.3727 -12.3727 -12.3727 -12.3286 -12.3286 -12.3286 -12.3286 -12.2131 -12.2131 -12.2131 -12.2131 -12.1928 -12.1928 -12.1928 -12.1928 -12.1631 -12.1631 -12.1631 -12.1631 -12.1197 -12.1197 -12.1197 -12.1197 -8.8458 -8.8458 -8.8451 -8.8451 1.1686 1.1686 1.1688 1.1688 1.5635 1.5635 1.5644 1.5644 1.5697 1.5697 1.5706 1.5706 2.0491 2.0491 2.0493 2.0493 3.7342 3.7342 3.7342 3.7342 4.2269 4.2269 4.2271 4.2271 k = 0.1250 0.0722 0.5136 ( 13296 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6713 -12.6713 -12.6064 -12.6064 -12.6064 -12.6064 -12.5328 -12.5328 -12.5328 -12.5328 -12.3725 -12.3725 -12.3725 -12.3725 -12.3284 -12.3284 -12.3283 -12.3283 -12.2133 -12.2133 -12.2133 -12.2133 -12.1927 -12.1927 -12.1927 -12.1927 -12.1633 -12.1633 -12.1632 -12.1632 -12.1200 -12.1200 -12.1200 -12.1200 -8.8458 -8.8458 -8.8451 -8.8451 1.1744 1.1744 1.1746 1.1746 1.5612 1.5612 1.5625 1.5625 1.5674 1.5674 1.5687 1.5687 2.0609 2.0609 2.0611 2.0611 3.6695 3.6695 3.6696 3.6696 4.2197 4.2197 4.2200 4.2200 k = 0.1458 0.0842 0.5136 ( 13322 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6713 -12.6713 -12.6063 -12.6063 -12.6062 -12.6062 -12.5330 -12.5330 -12.5330 -12.5330 -12.3723 -12.3723 -12.3723 -12.3723 -12.3280 -12.3280 -12.3280 -12.3280 -12.2135 -12.2135 -12.2135 -12.2135 -12.1927 -12.1927 -12.1926 -12.1926 -12.1634 -12.1634 -12.1634 -12.1634 -12.1203 -12.1203 -12.1203 -12.1203 -8.8458 -8.8458 -8.8451 -8.8451 1.1810 1.1810 1.1812 1.1812 1.5584 1.5584 1.5603 1.5603 1.5647 1.5647 1.5666 1.5666 2.0749 2.0749 2.0751 2.0751 3.6047 3.6047 3.6047 3.6047 4.2117 4.2117 4.2120 4.2120 k = 0.1667 0.0962 0.5136 ( 13340 PWs) bands (ev): -28.8385 -28.8385 -28.8385 -28.8385 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6713 -12.6713 -12.6061 -12.6061 -12.6061 -12.6061 -12.5332 -12.5332 -12.5332 -12.5332 -12.3721 -12.3721 -12.3720 -12.3720 -12.3277 -12.3277 -12.3277 -12.3277 -12.2138 -12.2138 -12.2137 -12.2137 -12.1926 -12.1926 -12.1925 -12.1925 -12.1636 -12.1636 -12.1636 -12.1636 -12.1207 -12.1207 -12.1206 -12.1206 -8.8458 -8.8458 -8.8451 -8.8451 1.1885 1.1885 1.1887 1.1887 1.5551 1.5551 1.5577 1.5577 1.5617 1.5617 1.5642 1.5642 2.0911 2.0911 2.0912 2.0912 3.5401 3.5401 3.5402 3.5402 4.2029 4.2029 4.2032 4.2032 k = 0.1875 0.1083 0.5136 ( 13330 PWs) bands (ev): -28.8385 -28.8385 -28.8385 -28.8385 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6713 -12.6713 -12.6059 -12.6059 -12.6059 -12.6059 -12.5334 -12.5334 -12.5334 -12.5334 -12.3718 -12.3718 -12.3718 -12.3718 -12.3273 -12.3273 -12.3273 -12.3273 -12.2141 -12.2141 -12.2140 -12.2140 -12.1925 -12.1925 -12.1924 -12.1924 -12.1638 -12.1638 -12.1638 -12.1638 -12.1210 -12.1210 -12.1210 -12.1210 -8.8457 -8.8457 -8.8451 -8.8451 1.1968 1.1968 1.1969 1.1969 1.5514 1.5514 1.5546 1.5546 1.5586 1.5586 1.5617 1.5617 2.1094 2.1094 2.1095 2.1095 3.4760 3.4760 3.4761 3.4761 4.1936 4.1936 4.1938 4.1938 k = 0.2083 0.1203 0.5136 ( 13326 PWs) bands (ev): -28.8385 -28.8385 -28.8385 -28.8385 -28.8036 -28.8036 -28.8036 -28.8036 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6712 -12.6712 -12.6058 -12.6058 -12.6057 -12.6057 -12.5337 -12.5337 -12.5336 -12.5336 -12.3715 -12.3715 -12.3715 -12.3715 -12.3269 -12.3269 -12.3269 -12.3269 -12.2144 -12.2144 -12.2143 -12.2143 -12.1923 -12.1923 -12.1923 -12.1923 -12.1640 -12.1640 -12.1639 -12.1639 -12.1214 -12.1214 -12.1213 -12.1213 -8.8457 -8.8457 -8.8450 -8.8450 1.2057 1.2057 1.2059 1.2059 1.5472 1.5472 1.5508 1.5508 1.5556 1.5556 1.5591 1.5591 2.1298 2.1298 2.1299 2.1299 3.4127 3.4127 3.4129 3.4129 4.1838 4.1838 4.1841 4.1841 k = 0.2292 0.1323 0.5136 ( 13334 PWs) bands (ev): -28.8384 -28.8384 -28.8384 -28.8384 -28.8036 -28.8036 -28.8036 -28.8036 -28.8035 -28.8035 -28.8035 -28.8035 -12.6712 -12.6712 -12.6712 -12.6712 -12.6056 -12.6056 -12.6055 -12.6055 -12.5339 -12.5339 -12.5338 -12.5338 -12.3712 -12.3712 -12.3712 -12.3712 -12.3264 -12.3264 -12.3264 -12.3264 -12.2147 -12.2147 -12.2145 -12.2145 -12.1922 -12.1922 -12.1922 -12.1922 -12.1643 -12.1643 -12.1641 -12.1641 -12.1218 -12.1218 -12.1217 -12.1217 -8.8457 -8.8457 -8.8450 -8.8450 1.2152 1.2152 1.2154 1.2154 1.5426 1.5426 1.5463 1.5463 1.5528 1.5528 1.5564 1.5564 2.1524 2.1524 2.1525 2.1525 3.3503 3.3503 3.3504 3.3504 4.1738 4.1738 4.1741 4.1741 k = 0.2500 0.1443 0.5136 ( 13336 PWs) bands (ev): -28.8384 -28.8384 -28.8384 -28.8384 -28.8036 -28.8036 -28.8036 -28.8036 -28.8035 -28.8035 -28.8035 -28.8035 -12.6712 -12.6712 -12.6712 -12.6712 -12.6054 -12.6054 -12.6053 -12.6053 -12.5342 -12.5342 -12.5341 -12.5341 -12.3709 -12.3709 -12.3709 -12.3709 -12.3260 -12.3260 -12.3260 -12.3260 -12.2151 -12.2151 -12.2148 -12.2148 -12.1921 -12.1921 -12.1920 -12.1920 -12.1645 -12.1645 -12.1643 -12.1643 -12.1221 -12.1221 -12.1221 -12.1221 -8.8457 -8.8457 -8.8450 -8.8450 1.2251 1.2251 1.2254 1.2254 1.5375 1.5375 1.5412 1.5412 1.5501 1.5501 1.5536 1.5536 2.1771 2.1771 2.1772 2.1772 3.2887 3.2887 3.2889 3.2889 4.1638 4.1638 4.1640 4.1640 k = 0.2708 0.1564 0.5136 ( 13332 PWs) bands (ev): -28.8384 -28.8384 -28.8384 -28.8384 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6712 -12.6712 -12.6711 -12.6711 -12.6052 -12.6052 -12.6051 -12.6051 -12.5345 -12.5345 -12.5343 -12.5343 -12.3706 -12.3706 -12.3706 -12.3706 -12.3255 -12.3255 -12.3255 -12.3255 -12.2154 -12.2154 -12.2151 -12.2151 -12.1920 -12.1920 -12.1919 -12.1919 -12.1647 -12.1647 -12.1645 -12.1645 -12.1225 -12.1225 -12.1225 -12.1225 -8.8456 -8.8456 -8.8450 -8.8450 1.2355 1.2355 1.2358 1.2358 1.5321 1.5321 1.5356 1.5356 1.5475 1.5475 1.5508 1.5508 2.2039 2.2039 2.2040 2.2040 3.2282 3.2282 3.2285 3.2285 4.1539 4.1539 4.1541 4.1541 k = 0.2917 0.1684 0.5136 ( 13332 PWs) bands (ev): -28.8383 -28.8383 -28.8383 -28.8383 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6711 -12.6711 -12.6711 -12.6711 -12.6050 -12.6050 -12.6049 -12.6049 -12.5347 -12.5347 -12.5346 -12.5346 -12.3703 -12.3703 -12.3703 -12.3703 -12.3251 -12.3251 -12.3251 -12.3251 -12.2157 -12.2157 -12.2154 -12.2154 -12.1919 -12.1919 -12.1918 -12.1918 -12.1649 -12.1649 -12.1647 -12.1647 -12.1229 -12.1229 -12.1229 -12.1229 -8.8456 -8.8456 -8.8449 -8.8449 1.2461 1.2461 1.2464 1.2464 1.5262 1.5262 1.5296 1.5296 1.5450 1.5450 1.5481 1.5481 2.2326 2.2326 2.2328 2.2328 3.1688 3.1688 3.1691 3.1691 4.1442 4.1442 4.1443 4.1443 k = 0.3125 0.1804 0.5136 ( 13310 PWs) bands (ev): -28.8383 -28.8383 -28.8383 -28.8383 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6710 -12.6710 -12.6710 -12.6710 -12.6048 -12.6048 -12.6047 -12.6047 -12.5350 -12.5350 -12.5348 -12.5348 -12.3700 -12.3700 -12.3700 -12.3700 -12.3246 -12.3246 -12.3246 -12.3246 -12.2160 -12.2160 -12.2157 -12.2157 -12.1918 -12.1918 -12.1917 -12.1917 -12.1651 -12.1651 -12.1649 -12.1649 -12.1232 -12.1232 -12.1232 -12.1232 -8.8456 -8.8456 -8.8449 -8.8449 1.2568 1.2568 1.2571 1.2571 1.5201 1.5201 1.5233 1.5233 1.5427 1.5427 1.5455 1.5455 2.2633 2.2633 2.2635 2.2635 3.1104 3.1104 3.1108 3.1108 4.1349 4.1349 4.1350 4.1350 k = 0.3333 0.1925 0.5136 ( 13306 PWs) bands (ev): -28.8382 -28.8382 -28.8382 -28.8382 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6710 -12.6710 -12.6709 -12.6709 -12.6046 -12.6046 -12.6045 -12.6045 -12.5352 -12.5352 -12.5351 -12.5351 -12.3697 -12.3697 -12.3697 -12.3697 -12.3242 -12.3242 -12.3242 -12.3242 -12.2163 -12.2163 -12.2160 -12.2160 -12.1917 -12.1917 -12.1916 -12.1916 -12.1653 -12.1653 -12.1651 -12.1651 -12.1236 -12.1236 -12.1235 -12.1235 -8.8456 -8.8456 -8.8449 -8.8449 1.2674 1.2674 1.2678 1.2678 1.5138 1.5138 1.5167 1.5167 1.5404 1.5404 1.5430 1.5430 2.2959 2.2959 2.2962 2.2962 3.0533 3.0533 3.0537 3.0537 4.1261 4.1261 4.1262 4.1262 k = 0.3542 0.2045 0.5136 ( 13294 PWs) bands (ev): -28.8382 -28.8382 -28.8382 -28.8382 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6709 -12.6709 -12.6709 -12.6709 -12.6045 -12.6045 -12.6043 -12.6043 -12.5354 -12.5354 -12.5353 -12.5353 -12.3695 -12.3695 -12.3695 -12.3695 -12.3238 -12.3238 -12.3238 -12.3238 -12.2166 -12.2166 -12.2163 -12.2163 -12.1916 -12.1916 -12.1915 -12.1915 -12.1655 -12.1655 -12.1653 -12.1653 -12.1239 -12.1239 -12.1238 -12.1238 -8.8456 -8.8456 -8.8449 -8.8449 1.2778 1.2778 1.2783 1.2783 1.5074 1.5074 1.5100 1.5100 1.5384 1.5384 1.5406 1.5406 2.3303 2.3303 2.3306 2.3306 2.9974 2.9974 2.9978 2.9978 4.1180 4.1180 4.1181 4.1181 k = 0.3750 0.2165 0.5136 ( 13286 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6709 -12.6709 -12.6708 -12.6708 -12.6043 -12.6043 -12.6042 -12.6042 -12.5356 -12.5356 -12.5355 -12.5355 -12.3693 -12.3693 -12.3692 -12.3692 -12.3235 -12.3235 -12.3235 -12.3235 -12.2168 -12.2168 -12.2165 -12.2165 -12.1915 -12.1915 -12.1914 -12.1914 -12.1656 -12.1656 -12.1655 -12.1655 -12.1242 -12.1242 -12.1241 -12.1241 -8.8455 -8.8455 -8.8449 -8.8449 1.2878 1.2878 1.2883 1.2883 1.5010 1.5010 1.5034 1.5034 1.5366 1.5366 1.5385 1.5385 2.3664 2.3664 2.3667 2.3667 2.9428 2.9428 2.9432 2.9432 4.1106 4.1106 4.1107 4.1107 k = 0.3958 0.2285 0.5136 ( 13276 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6708 -12.6708 -12.6708 -12.6708 -12.6042 -12.6042 -12.6041 -12.6041 -12.5358 -12.5358 -12.5357 -12.5357 -12.3691 -12.3691 -12.3690 -12.3690 -12.3232 -12.3232 -12.3232 -12.3232 -12.2170 -12.2170 -12.2168 -12.2168 -12.1914 -12.1914 -12.1913 -12.1913 -12.1658 -12.1658 -12.1656 -12.1656 -12.1244 -12.1244 -12.1243 -12.1243 -8.8455 -8.8455 -8.8449 -8.8449 1.2971 1.2971 1.2976 1.2976 1.4949 1.4949 1.4970 1.4970 1.5350 1.5350 1.5367 1.5367 2.4039 2.4039 2.4042 2.4042 2.8897 2.8897 2.8901 2.8901 4.1042 4.1042 4.1043 4.1043 k = 0.4167 0.2406 0.5136 ( 13270 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6708 -12.6708 -12.6708 -12.6708 -12.6040 -12.6040 -12.6039 -12.6039 -12.5359 -12.5359 -12.5359 -12.5359 -12.3689 -12.3689 -12.3689 -12.3689 -12.3229 -12.3229 -12.3229 -12.3229 -12.2172 -12.2172 -12.2170 -12.2170 -12.1913 -12.1913 -12.1912 -12.1912 -12.1659 -12.1659 -12.1657 -12.1657 -12.1246 -12.1246 -12.1245 -12.1245 -8.8455 -8.8455 -8.8448 -8.8448 1.3055 1.3055 1.3060 1.3060 1.4893 1.4893 1.4910 1.4910 1.5337 1.5337 1.5351 1.5351 2.4426 2.4426 2.4430 2.4430 2.8383 2.8383 2.8388 2.8388 4.0988 4.0988 4.0988 4.0988 k = 0.4375 0.2526 0.5136 ( 13270 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6708 -12.6708 -12.6707 -12.6707 -12.6039 -12.6039 -12.6039 -12.6039 -12.5361 -12.5361 -12.5360 -12.5360 -12.3688 -12.3688 -12.3687 -12.3687 -12.3227 -12.3227 -12.3227 -12.3227 -12.2173 -12.2173 -12.2172 -12.2172 -12.1913 -12.1913 -12.1912 -12.1912 -12.1660 -12.1660 -12.1659 -12.1659 -12.1247 -12.1247 -12.1247 -12.1247 -8.8455 -8.8455 -8.8448 -8.8448 1.3125 1.3125 1.3130 1.3130 1.4844 1.4844 1.4858 1.4858 1.5327 1.5327 1.5338 1.5338 2.4819 2.4819 2.4823 2.4823 2.7892 2.7892 2.7896 2.7896 4.0945 4.0945 4.0945 4.0945 k = 0.4583 0.2646 0.5136 ( 13284 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6708 -12.6708 -12.6707 -12.6707 -12.6039 -12.6039 -12.6038 -12.6038 -12.5362 -12.5362 -12.5361 -12.5361 -12.3687 -12.3687 -12.3687 -12.3687 -12.3225 -12.3225 -12.3225 -12.3225 -12.2174 -12.2174 -12.2173 -12.2173 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1659 -12.1659 -12.1249 -12.1249 -12.1248 -12.1248 -8.8455 -8.8455 -8.8448 -8.8448 1.3180 1.3180 1.3184 1.3184 1.4806 1.4806 1.4817 1.4817 1.5320 1.5320 1.5328 1.5328 2.5205 2.5205 2.5209 2.5209 2.7437 2.7437 2.7441 2.7441 4.0913 4.0913 4.0914 4.0914 k = 0.4792 0.2766 0.5136 ( 13278 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5362 -12.5362 -12.5362 -12.5362 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1660 -12.1660 -12.1249 -12.1249 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3214 1.3214 1.3218 1.3218 1.4783 1.4783 1.4790 1.4790 1.5316 1.5316 1.5322 1.5322 2.5543 2.5543 2.5546 2.5546 2.7058 2.7058 2.7061 2.7061 4.0894 4.0894 4.0895 4.0895 k = 0.5000 0.2887 0.5136 ( 13276 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5362 -12.5362 -12.5362 -12.5362 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1660 -12.1660 -12.1249 -12.1249 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3226 1.3226 1.3230 1.3230 1.4775 1.4775 1.4780 1.4780 1.5314 1.5314 1.5320 1.5320 2.5703 2.5703 2.5705 2.5705 2.6886 2.6886 2.6886 2.6886 4.0888 4.0888 4.0888 4.0888 k = 0.5000 0.2887 0.5136 ( 13276 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5362 -12.5362 -12.5362 -12.5362 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1660 -12.1660 -12.1249 -12.1249 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3226 1.3226 1.3230 1.3230 1.4775 1.4775 1.4780 1.4780 1.5314 1.5314 1.5320 1.5320 2.5703 2.5703 2.5705 2.5705 2.6886 2.6886 2.6886 2.6886 4.0888 4.0888 4.0888 4.0888 k = 0.4881 0.3093 0.5136 ( 13272 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5362 -12.5362 -12.5362 -12.5362 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1660 -12.1660 -12.1250 -12.1250 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3231 1.3231 1.3235 1.3235 1.4772 1.4772 1.4777 1.4777 1.5312 1.5312 1.5317 1.5317 2.5709 2.5709 2.5711 2.5711 2.6896 2.6896 2.6896 2.6896 4.0793 4.0793 4.0793 4.0793 k = 0.4762 0.3299 0.5136 ( 13300 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5363 -12.5363 -12.5363 -12.5363 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2175 -12.2175 -12.2175 -12.2175 -12.1912 -12.1912 -12.1912 -12.1912 -12.1661 -12.1661 -12.1660 -12.1660 -12.1250 -12.1250 -12.1250 -12.1250 -8.8455 -8.8455 -8.8448 -8.8448 1.3246 1.3246 1.3250 1.3250 1.4763 1.4763 1.4767 1.4767 1.5304 1.5304 1.5308 1.5308 2.5727 2.5727 2.5729 2.5729 2.6925 2.6925 2.6925 2.6925 4.0527 4.0527 4.0527 4.0527 k = 0.4643 0.3505 0.5136 ( 13294 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5363 -12.5363 -12.5363 -12.5363 -12.3685 -12.3685 -12.3685 -12.3685 -12.3223 -12.3223 -12.3223 -12.3223 -12.2175 -12.2175 -12.2175 -12.2175 -12.1912 -12.1912 -12.1912 -12.1912 -12.1661 -12.1661 -12.1661 -12.1661 -12.1250 -12.1250 -12.1250 -12.1250 -8.8455 -8.8455 -8.8448 -8.8448 1.3270 1.3270 1.3274 1.3274 1.4747 1.4747 1.4751 1.4751 1.5291 1.5291 1.5295 1.5295 2.5757 2.5757 2.5759 2.5759 2.6972 2.6972 2.6973 2.6973 4.0131 4.0131 4.0132 4.0132 k = 0.4524 0.3712 0.5136 ( 13290 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6706 -12.6706 -12.6037 -12.6037 -12.6037 -12.6037 -12.5364 -12.5364 -12.5364 -12.5364 -12.3685 -12.3685 -12.3685 -12.3685 -12.3223 -12.3223 -12.3223 -12.3223 -12.2175 -12.2175 -12.2175 -12.2175 -12.1912 -12.1912 -12.1911 -12.1911 -12.1661 -12.1661 -12.1661 -12.1661 -12.1251 -12.1251 -12.1251 -12.1251 -8.8455 -8.8455 -8.8448 -8.8448 1.3305 1.3305 1.3309 1.3309 1.4724 1.4724 1.4728 1.4728 1.5274 1.5274 1.5278 1.5278 2.5799 2.5799 2.5802 2.5802 2.7034 2.7034 2.7035 2.7035 3.9654 3.9654 3.9654 3.9654 k = 0.4405 0.3918 0.5136 ( 13290 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6706 -12.6706 -12.6706 -12.6706 -12.6037 -12.6037 -12.6037 -12.6037 -12.5364 -12.5364 -12.5364 -12.5364 -12.3685 -12.3685 -12.3684 -12.3684 -12.3222 -12.3222 -12.3222 -12.3222 -12.2176 -12.2176 -12.2176 -12.2176 -12.1911 -12.1911 -12.1911 -12.1911 -12.1661 -12.1661 -12.1661 -12.1661 -12.1251 -12.1251 -12.1251 -12.1251 -8.8455 -8.8455 -8.8448 -8.8448 1.3348 1.3348 1.3352 1.3352 1.4694 1.4694 1.4697 1.4697 1.5255 1.5255 1.5258 1.5258 2.5855 2.5855 2.5857 2.5857 2.7108 2.7108 2.7108 2.7108 3.9134 3.9134 3.9134 3.9134 k = 0.4286 0.4124 0.5136 ( 13294 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6706 -12.6706 -12.6706 -12.6706 -12.6037 -12.6037 -12.6037 -12.6037 -12.5365 -12.5365 -12.5365 -12.5365 -12.3684 -12.3684 -12.3684 -12.3684 -12.3221 -12.3221 -12.3221 -12.3221 -12.2176 -12.2176 -12.2176 -12.2176 -12.1911 -12.1911 -12.1911 -12.1911 -12.1661 -12.1661 -12.1661 -12.1661 -12.1252 -12.1252 -12.1252 -12.1252 -8.8455 -8.8455 -8.8448 -8.8448 1.3400 1.3400 1.3404 1.3404 1.4656 1.4656 1.4659 1.4659 1.5234 1.5234 1.5237 1.5237 2.5923 2.5923 2.5925 2.5925 2.7186 2.7186 2.7187 2.7187 3.8601 3.8601 3.8601 3.8601 k = 0.4167 0.4330 0.5136 ( 13296 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6705 -12.6705 -12.6705 -12.6705 -12.6037 -12.6037 -12.6037 -12.6037 -12.5366 -12.5366 -12.5366 -12.5366 -12.3683 -12.3683 -12.3683 -12.3683 -12.3221 -12.3221 -12.3220 -12.3220 -12.2177 -12.2177 -12.2176 -12.2176 -12.1911 -12.1911 -12.1911 -12.1911 -12.1662 -12.1662 -12.1662 -12.1662 -12.1253 -12.1253 -12.1253 -12.1253 -8.8455 -8.8455 -8.8448 -8.8448 1.3461 1.3461 1.3465 1.3465 1.4610 1.4610 1.4612 1.4612 1.5213 1.5213 1.5216 1.5216 2.6005 2.6005 2.6007 2.6007 2.7263 2.7263 2.7264 2.7264 3.8079 3.8079 3.8079 3.8079 k = 0.4048 0.4536 0.5136 ( 13308 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6705 -12.6705 -12.6705 -12.6705 -12.6036 -12.6036 -12.6036 -12.6036 -12.5367 -12.5367 -12.5367 -12.5367 -12.3683 -12.3683 -12.3683 -12.3683 -12.3220 -12.3220 -12.3220 -12.3220 -12.2177 -12.2177 -12.2177 -12.2177 -12.1911 -12.1911 -12.1911 -12.1911 -12.1662 -12.1662 -12.1662 -12.1662 -12.1254 -12.1254 -12.1254 -12.1254 -8.8455 -8.8455 -8.8448 -8.8448 1.3529 1.3529 1.3533 1.3533 1.4554 1.4554 1.4557 1.4557 1.5193 1.5193 1.5196 1.5196 2.6101 2.6101 2.6103 2.6103 2.7331 2.7331 2.7332 2.7332 3.7587 3.7587 3.7587 3.7587 k = 0.3929 0.4743 0.5136 ( 13302 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6705 -12.6705 -12.6704 -12.6704 -12.6036 -12.6036 -12.6036 -12.6036 -12.5368 -12.5368 -12.5368 -12.5368 -12.3682 -12.3682 -12.3682 -12.3682 -12.3219 -12.3219 -12.3219 -12.3219 -12.2178 -12.2178 -12.2177 -12.2177 -12.1911 -12.1911 -12.1911 -12.1911 -12.1662 -12.1662 -12.1662 -12.1662 -12.1255 -12.1255 -12.1255 -12.1255 -8.8455 -8.8455 -8.8448 -8.8448 1.3604 1.3604 1.3608 1.3608 1.4490 1.4490 1.4493 1.4493 1.5175 1.5175 1.5178 1.5178 2.6211 2.6211 2.6213 2.6213 2.7380 2.7380 2.7381 2.7381 3.7141 3.7141 3.7141 3.7141 k = 0.3810 0.4949 0.5136 ( 13320 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6704 -12.6704 -12.6036 -12.6036 -12.6036 -12.6036 -12.5369 -12.5369 -12.5369 -12.5369 -12.3682 -12.3682 -12.3682 -12.3682 -12.3218 -12.3218 -12.3218 -12.3218 -12.2178 -12.2178 -12.2178 -12.2178 -12.1911 -12.1911 -12.1911 -12.1911 -12.1663 -12.1663 -12.1663 -12.1663 -12.1256 -12.1256 -12.1256 -12.1256 -8.8455 -8.8455 -8.8448 -8.8448 1.3686 1.3686 1.3690 1.3690 1.4418 1.4418 1.4422 1.4422 1.5159 1.5159 1.5163 1.5163 2.6337 2.6337 2.6339 2.6339 2.7399 2.7399 2.7400 2.7400 3.6755 3.6755 3.6756 3.6756 k = 0.3690 0.5155 0.5136 ( 13328 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6704 -12.6704 -12.6036 -12.6036 -12.6035 -12.6035 -12.5369 -12.5369 -12.5369 -12.5369 -12.3681 -12.3681 -12.3681 -12.3681 -12.3218 -12.3218 -12.3217 -12.3217 -12.2179 -12.2179 -12.2179 -12.2179 -12.1911 -12.1911 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1256 -12.1256 -12.1256 -12.1256 -8.8455 -8.8455 -8.8448 -8.8448 1.3773 1.3773 1.3777 1.3777 1.4339 1.4339 1.4343 1.4343 1.5147 1.5147 1.5152 1.5152 2.6479 2.6479 2.6481 2.6481 2.7379 2.7379 2.7380 2.7380 3.6444 3.6444 3.6444 3.6444 k = 0.3571 0.5361 0.5136 ( 13332 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3681 -12.3681 -12.3217 -12.3217 -12.3217 -12.3217 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8455 -8.8455 -8.8448 -8.8448 1.3864 1.3864 1.3868 1.3868 1.4253 1.4253 1.4257 1.4257 1.5138 1.5138 1.5143 1.5143 2.6638 2.6638 2.6640 2.6640 2.7311 2.7311 2.7313 2.7313 3.6216 3.6216 3.6217 3.6217 k = 0.3452 0.5567 0.5136 ( 13320 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3681 -12.3681 -12.3217 -12.3217 -12.3216 -12.3216 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8454 -8.8454 -8.8448 -8.8448 1.3958 1.3958 1.3963 1.3963 1.4163 1.4163 1.4167 1.4167 1.5133 1.5133 1.5138 1.5138 2.6815 2.6815 2.6816 2.6816 2.7190 2.7190 2.7191 2.7191 3.6079 3.6079 3.6079 3.6079 k = 0.3333 0.5774 0.5136 ( 13308 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -12.6703 -12.6703 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3680 -12.3680 -12.3216 -12.3216 -12.3216 -12.3216 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8454 -8.8454 -8.8448 -8.8448 1.4034 1.4034 1.4038 1.4038 1.4088 1.4088 1.4093 1.4093 1.5131 1.5131 1.5136 1.5136 2.6992 2.6992 2.6994 2.6994 2.7030 2.7030 2.7031 2.7031 3.6034 3.6034 3.6034 3.6034 k = 0.3333 0.5774 0.5136 ( 13308 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -12.6703 -12.6703 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3680 -12.3680 -12.3216 -12.3216 -12.3216 -12.3216 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8454 -8.8454 -8.8448 -8.8448 1.4034 1.4034 1.4038 1.4038 1.4088 1.4088 1.4093 1.4093 1.5131 1.5131 1.5136 1.5136 2.6992 2.6992 2.6994 2.6994 2.7030 2.7030 2.7031 2.7031 3.6034 3.6034 3.6034 3.6034 k = 0.3210 0.5560 0.5136 ( 13302 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -12.6703 -12.6703 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3681 -12.3681 -12.3217 -12.3217 -12.3216 -12.3216 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8454 -8.8454 -8.8448 -8.8448 1.3951 1.3951 1.3956 1.3956 1.4169 1.4169 1.4174 1.4174 1.5133 1.5133 1.5138 1.5138 2.6770 2.6770 2.6772 2.6772 2.7235 2.7235 2.7236 2.7236 3.6081 3.6081 3.6081 3.6081 k = 0.3086 0.5346 0.5136 ( 13314 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3681 -12.3681 -12.3217 -12.3217 -12.3217 -12.3217 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8455 -8.8455 -8.8448 -8.8448 1.3843 1.3843 1.3847 1.3847 1.4274 1.4274 1.4278 1.4278 1.5138 1.5138 1.5144 1.5144 2.6481 2.6481 2.6482 2.6482 2.7479 2.7479 2.7481 2.7481 3.6214 3.6214 3.6215 3.6215 k = 0.2963 0.5132 0.5136 ( 13318 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6704 -12.6704 -12.6036 -12.6036 -12.6036 -12.6036 -12.5369 -12.5369 -12.5369 -12.5369 -12.3682 -12.3682 -12.3682 -12.3682 -12.3218 -12.3218 -12.3218 -12.3218 -12.2178 -12.2178 -12.2178 -12.2178 -12.1911 -12.1911 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1256 -12.1256 -12.1256 -12.1256 -8.8455 -8.8455 -8.8448 -8.8448 1.3729 1.3729 1.3733 1.3733 1.4379 1.4379 1.4384 1.4384 1.5148 1.5148 1.5153 1.5153 2.6151 2.6151 2.6152 2.6152 2.7747 2.7747 2.7748 2.7748 3.6424 3.6424 3.6424 3.6424 k = 0.2840 0.4918 0.5136 ( 13318 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8037 -28.8037 -28.8037 -28.8037 -12.6704 -12.6704 -12.6704 -12.6704 -12.6036 -12.6036 -12.6036 -12.6036 -12.5368 -12.5368 -12.5368 -12.5368 -12.3683 -12.3683 -12.3682 -12.3682 -12.3219 -12.3219 -12.3219 -12.3219 -12.2177 -12.2177 -12.2177 -12.2177 -12.1911 -12.1911 -12.1911 -12.1911 -12.1662 -12.1662 -12.1662 -12.1662 -12.1255 -12.1255 -12.1255 -12.1255 -8.8455 -8.8455 -8.8448 -8.8448 1.3612 1.3612 1.3616 1.3616 1.4484 1.4484 1.4489 1.4489 1.5161 1.5161 1.5165 1.5165 2.5791 2.5791 2.5792 2.5792 2.8037 2.8037 2.8038 2.8038 3.6697 3.6697 3.6697 3.6697 k = 0.2716 0.4704 0.5136 ( 13302 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6705 -12.6705 -12.6704 -12.6704 -12.6037 -12.6037 -12.6037 -12.6037 -12.5366 -12.5366 -12.5366 -12.5366 -12.3684 -12.3684 -12.3683 -12.3683 -12.3221 -12.3221 -12.3221 -12.3221 -12.2176 -12.2176 -12.2176 -12.2176 -12.1911 -12.1911 -12.1911 -12.1911 -12.1661 -12.1661 -12.1661 -12.1661 -12.1253 -12.1253 -12.1253 -12.1253 -8.8455 -8.8455 -8.8448 -8.8448 1.3493 1.3493 1.3496 1.3496 1.4588 1.4588 1.4593 1.4593 1.5177 1.5177 1.5182 1.5182 2.5411 2.5411 2.5412 2.5412 2.8352 2.8352 2.8353 2.8353 3.7021 3.7021 3.7021 3.7021 k = 0.2593 0.4491 0.5136 ( 13280 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6705 -12.6705 -12.6705 -12.6705 -12.6038 -12.6038 -12.6038 -12.6038 -12.5365 -12.5365 -12.5365 -12.5365 -12.3685 -12.3685 -12.3685 -12.3685 -12.3223 -12.3223 -12.3223 -12.3223 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1911 -12.1911 -12.1660 -12.1660 -12.1660 -12.1660 -12.1251 -12.1251 -12.1251 -12.1251 -8.8455 -8.8455 -8.8448 -8.8448 1.3372 1.3372 1.3374 1.3374 1.4689 1.4689 1.4694 1.4694 1.5197 1.5197 1.5201 1.5201 2.5019 2.5019 2.5021 2.5021 2.8691 2.8691 2.8692 2.8692 3.7384 3.7384 3.7384 3.7384 k = 0.2469 0.4277 0.5136 ( 13284 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6706 -12.6706 -12.6706 -12.6706 -12.6039 -12.6039 -12.6039 -12.6039 -12.5363 -12.5363 -12.5363 -12.5363 -12.3686 -12.3686 -12.3686 -12.3686 -12.3226 -12.3226 -12.3225 -12.3225 -12.2173 -12.2173 -12.2173 -12.2173 -12.1912 -12.1912 -12.1912 -12.1912 -12.1659 -12.1659 -12.1659 -12.1659 -12.1249 -12.1249 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3249 1.3249 1.3251 1.3251 1.4787 1.4787 1.4792 1.4792 1.5220 1.5220 1.5223 1.5223 2.4625 2.4625 2.4626 2.4626 2.9055 2.9055 2.9057 2.9057 3.7775 3.7775 3.7775 3.7775 k = 0.2346 0.4063 0.5136 ( 13286 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8036 -28.8036 -28.8036 -28.8036 -12.6707 -12.6707 -12.6706 -12.6706 -12.6040 -12.6040 -12.6040 -12.6040 -12.5361 -12.5361 -12.5361 -12.5361 -12.3688 -12.3688 -12.3688 -12.3688 -12.3229 -12.3229 -12.3228 -12.3228 -12.2171 -12.2171 -12.2171 -12.2171 -12.1913 -12.1913 -12.1913 -12.1913 -12.1658 -12.1658 -12.1658 -12.1658 -12.1247 -12.1247 -12.1247 -12.1247 -8.8455 -8.8455 -8.8448 -8.8448 1.3125 1.3125 1.3127 1.3127 1.4881 1.4881 1.4886 1.4886 1.5246 1.5246 1.5249 1.5249 2.4232 2.4232 2.4233 2.4233 2.9445 2.9445 2.9446 2.9446 3.8184 3.8184 3.8185 3.8185 k = 0.2222 0.3849 0.5136 ( 13300 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8037 -28.8037 -28.8037 -28.8037 -28.8036 -28.8036 -28.8036 -28.8036 -12.6707 -12.6707 -12.6707 -12.6707 -12.6042 -12.6042 -12.6042 -12.6042 -12.5359 -12.5359 -12.5359 -12.5359 -12.3691 -12.3691 -12.3691 -12.3691 -12.3232 -12.3232 -12.3232 -12.3232 -12.2168 -12.2168 -12.2168 -12.2168 -12.1914 -12.1914 -12.1914 -12.1914 -12.1657 -12.1657 -12.1656 -12.1656 -12.1244 -12.1244 -12.1244 -12.1244 -8.8455 -8.8455 -8.8449 -8.8449 1.3002 1.3002 1.3003 1.3003 1.4970 1.4970 1.4975 1.4975 1.5274 1.5274 1.5276 1.5276 2.3847 2.3847 2.3848 2.3848 2.9860 2.9860 2.9861 2.9861 3.8603 3.8603 3.8603 3.8603 k = 0.2099 0.3635 0.5136 ( 13304 PWs) bands (ev): -28.8382 -28.8382 -28.8382 -28.8382 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6708 -12.6708 -12.6708 -12.6708 -12.6043 -12.6043 -12.6043 -12.6043 -12.5356 -12.5356 -12.5356 -12.5356 -12.3693 -12.3693 -12.3693 -12.3693 -12.3236 -12.3236 -12.3236 -12.3236 -12.2166 -12.2166 -12.2166 -12.2166 -12.1915 -12.1915 -12.1915 -12.1915 -12.1655 -12.1655 -12.1655 -12.1655 -12.1241 -12.1241 -12.1241 -12.1241 -8.8455 -8.8455 -8.8449 -8.8449 1.2878 1.2878 1.2879 1.2879 1.5055 1.5055 1.5060 1.5060 1.5304 1.5304 1.5306 1.5306 2.3473 2.3473 2.3474 2.3474 3.0301 3.0301 3.0302 3.0302 3.9022 3.9022 3.9023 3.9023 k = 0.1975 0.3421 0.5136 ( 13304 PWs) bands (ev): -28.8382 -28.8382 -28.8382 -28.8382 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6709 -12.6709 -12.6709 -12.6709 -12.6045 -12.6045 -12.6045 -12.6045 -12.5353 -12.5353 -12.5353 -12.5353 -12.3696 -12.3696 -12.3696 -12.3696 -12.3240 -12.3240 -12.3240 -12.3240 -12.2163 -12.2163 -12.2163 -12.2163 -12.1916 -12.1916 -12.1916 -12.1916 -12.1653 -12.1653 -12.1653 -12.1653 -12.1238 -12.1238 -12.1238 -12.1238 -8.8456 -8.8456 -8.8449 -8.8449 1.2756 1.2756 1.2757 1.2757 1.5134 1.5134 1.5139 1.5139 1.5337 1.5337 1.5338 1.5338 2.3113 2.3113 2.3114 2.3114 3.0766 3.0766 3.0767 3.0767 3.9434 3.9434 3.9435 3.9435 k = 0.1852 0.3208 0.5136 ( 13292 PWs) bands (ev): -28.8382 -28.8382 -28.8382 -28.8382 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6710 -12.6710 -12.6709 -12.6709 -12.6047 -12.6047 -12.6047 -12.6047 -12.5351 -12.5351 -12.5351 -12.5351 -12.3698 -12.3698 -12.3698 -12.3698 -12.3244 -12.3244 -12.3244 -12.3244 -12.2160 -12.2160 -12.2160 -12.2160 -12.1917 -12.1917 -12.1917 -12.1917 -12.1651 -12.1651 -12.1651 -12.1651 -12.1234 -12.1234 -12.1234 -12.1234 -8.8456 -8.8456 -8.8449 -8.8449 1.2635 1.2635 1.2636 1.2636 1.5208 1.5208 1.5213 1.5213 1.5371 1.5371 1.5372 1.5372 2.2770 2.2770 2.2771 2.2771 3.1257 3.1257 3.1258 3.1258 3.9833 3.9833 3.9833 3.9833 k = 0.1728 0.2994 0.5136 ( 13296 PWs) bands (ev): -28.8383 -28.8383 -28.8383 -28.8383 -28.8037 -28.8037 -28.8037 -28.8037 -28.8035 -28.8035 -28.8035 -28.8035 -12.6710 -12.6710 -12.6710 -12.6710 -12.6049 -12.6049 -12.6049 -12.6049 -12.5348 -12.5348 -12.5348 -12.5348 -12.3701 -12.3701 -12.3701 -12.3701 -12.3249 -12.3249 -12.3249 -12.3249 -12.2157 -12.2157 -12.2157 -12.2157 -12.1918 -12.1918 -12.1918 -12.1918 -12.1649 -12.1649 -12.1649 -12.1649 -12.1230 -12.1230 -12.1230 -12.1230 -8.8456 -8.8456 -8.8449 -8.8449 1.2517 1.2517 1.2517 1.2517 1.5276 1.5276 1.5281 1.5281 1.5406 1.5406 1.5407 1.5407 2.2446 2.2446 2.2447 2.2447 3.1772 3.1772 3.1772 3.1772 4.0211 4.0211 4.0211 4.0211 k = 0.1605 0.2780 0.5136 ( 13292 PWs) bands (ev): -28.8383 -28.8383 -28.8383 -28.8383 -28.8036 -28.8036 -28.8036 -28.8036 -28.8035 -28.8035 -28.8035 -28.8035 -12.6711 -12.6711 -12.6711 -12.6711 -12.6051 -12.6051 -12.6051 -12.6051 -12.5345 -12.5345 -12.5345 -12.5345 -12.3704 -12.3704 -12.3704 -12.3704 -12.3253 -12.3253 -12.3253 -12.3253 -12.2154 -12.2154 -12.2154 -12.2154 -12.1919 -12.1919 -12.1919 -12.1919 -12.1647 -12.1647 -12.1647 -12.1647 -12.1226 -12.1226 -12.1226 -12.1226 -8.8456 -8.8456 -8.8450 -8.8450 1.2402 1.2402 1.2402 1.2402 1.5337 1.5337 1.5342 1.5342 1.5443 1.5443 1.5443 1.5443 2.2142 2.2142 2.2142 2.2142 3.2310 3.2310 3.2310 3.2310 4.0563 4.0563 4.0564 4.0564 k = 0.1481 0.2566 0.5136 ( 13284 PWs) bands (ev): -28.8383 -28.8383 -28.8383 -28.8383 -28.8036 -28.8036 -28.8036 -28.8036 -28.8035 -28.8035 -28.8035 -28.8035 -12.6711 -12.6711 -12.6711 -12.6711 -12.6053 -12.6053 -12.6053 -12.6053 -12.5342 -12.5342 -12.5342 -12.5342 -12.3708 -12.3708 -12.3707 -12.3707 -12.3258 -12.3258 -12.3258 -12.3258 -12.2150 -12.2150 -12.2150 -12.2150 -12.1920 -12.1920 -12.1920 -12.1920 -12.1645 -12.1645 -12.1645 -12.1645 -12.1222 -12.1222 -12.1222 -12.1222 -8.8457 -8.8457 -8.8450 -8.8450 1.2291 1.2291 1.2292 1.2292 1.5393 1.5393 1.5397 1.5397 1.5479 1.5479 1.5481 1.5481 2.1859 2.1859 2.1859 2.1859 3.2870 3.2870 3.2870 3.2870 4.0886 4.0886 4.0887 4.0887 k = 0.1358 0.2352 0.5136 ( 13292 PWs) bands (ev): -28.8384 -28.8384 -28.8384 -28.8384 -28.8036 -28.8036 -28.8036 -28.8036 -28.8035 -28.8035 -28.8035 -28.8035 -12.6712 -12.6712 -12.6712 -12.6712 -12.6055 -12.6055 -12.6055 -12.6055 -12.5340 -12.5340 -12.5340 -12.5340 -12.3711 -12.3711 -12.3711 -12.3711 -12.3263 -12.3263 -12.3263 -12.3263 -12.2147 -12.2147 -12.2147 -12.2147 -12.1922 -12.1922 -12.1921 -12.1921 -12.1642 -12.1642 -12.1642 -12.1642 -12.1218 -12.1218 -12.1218 -12.1218 -8.8457 -8.8457 -8.8450 -8.8450 1.2184 1.2184 1.2185 1.2185 1.5442 1.5442 1.5446 1.5446 1.5516 1.5516 1.5518 1.5518 2.1597 2.1597 2.1598 2.1598 3.3451 3.3451 3.3452 3.3452 4.1176 4.1176 4.1177 4.1177 k = 0.1235 0.2138 0.5136 ( 13296 PWs) bands (ev): -28.8384 -28.8384 -28.8384 -28.8384 -28.8036 -28.8036 -28.8036 -28.8036 -28.8034 -28.8034 -28.8034 -28.8034 -12.6712 -12.6712 -12.6712 -12.6712 -12.6057 -12.6057 -12.6057 -12.6057 -12.5337 -12.5337 -12.5337 -12.5337 -12.3714 -12.3714 -12.3714 -12.3714 -12.3267 -12.3267 -12.3267 -12.3267 -12.2144 -12.2144 -12.2144 -12.2144 -12.1923 -12.1923 -12.1923 -12.1923 -12.1640 -12.1640 -12.1640 -12.1640 -12.1215 -12.1215 -12.1215 -12.1215 -8.8457 -8.8457 -8.8450 -8.8450 1.2084 1.2084 1.2085 1.2085 1.5485 1.5485 1.5490 1.5490 1.5552 1.5552 1.5555 1.5555 2.1358 2.1358 2.1359 2.1359 3.4052 3.4052 3.4052 3.4052 4.1433 4.1433 4.1433 4.1433 k = 0.1111 0.1925 0.5136 ( 13304 PWs) bands (ev): -28.8385 -28.8385 -28.8385 -28.8385 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6713 -12.6713 -12.6058 -12.6058 -12.6058 -12.6058 -12.5335 -12.5335 -12.5335 -12.5335 -12.3717 -12.3717 -12.3717 -12.3717 -12.3272 -12.3272 -12.3272 -12.3272 -12.2141 -12.2141 -12.2141 -12.2141 -12.1924 -12.1924 -12.1924 -12.1924 -12.1638 -12.1638 -12.1638 -12.1638 -12.1211 -12.1211 -12.1211 -12.1211 -8.8457 -8.8457 -8.8451 -8.8451 1.1989 1.1989 1.1991 1.1991 1.5524 1.5524 1.5528 1.5528 1.5587 1.5587 1.5590 1.5590 2.1142 2.1142 2.1143 2.1143 3.4670 3.4670 3.4671 3.4671 4.1655 4.1655 4.1655 4.1655 k = 0.0988 0.1711 0.5136 ( 13316 PWs) bands (ev): -28.8385 -28.8385 -28.8385 -28.8385 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6713 -12.6713 -12.6060 -12.6060 -12.6060 -12.6060 -12.5332 -12.5332 -12.5332 -12.5332 -12.3720 -12.3720 -12.3720 -12.3720 -12.3276 -12.3276 -12.3276 -12.3276 -12.2138 -12.2138 -12.2138 -12.2138 -12.1925 -12.1925 -12.1925 -12.1925 -12.1636 -12.1636 -12.1636 -12.1636 -12.1207 -12.1207 -12.1207 -12.1207 -8.8457 -8.8457 -8.8451 -8.8451 1.1902 1.1902 1.1904 1.1904 1.5557 1.5557 1.5561 1.5561 1.5619 1.5619 1.5623 1.5623 2.0948 2.0948 2.0950 2.0950 3.5304 3.5304 3.5304 3.5304 4.1844 4.1844 4.1844 4.1844 k = 0.0864 0.1497 0.5136 ( 13316 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6713 -12.6713 -12.6713 -12.6713 -12.6062 -12.6062 -12.6062 -12.6062 -12.5330 -12.5330 -12.5330 -12.5330 -12.3723 -12.3723 -12.3722 -12.3722 -12.3280 -12.3280 -12.3280 -12.3280 -12.2136 -12.2136 -12.2136 -12.2136 -12.1926 -12.1926 -12.1926 -12.1926 -12.1635 -12.1635 -12.1635 -12.1635 -12.1204 -12.1204 -12.1204 -12.1204 -8.8458 -8.8458 -8.8451 -8.8451 1.1824 1.1824 1.1826 1.1826 1.5587 1.5587 1.5591 1.5591 1.5648 1.5648 1.5652 1.5652 2.0778 2.0778 2.0779 2.0779 3.5950 3.5950 3.5951 3.5951 4.2002 4.2002 4.2002 4.2002 k = 0.0741 0.1283 0.5136 ( 13296 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6713 -12.6713 -12.6063 -12.6063 -12.6063 -12.6063 -12.5328 -12.5328 -12.5328 -12.5328 -12.3725 -12.3725 -12.3725 -12.3725 -12.3283 -12.3283 -12.3283 -12.3283 -12.2133 -12.2133 -12.2133 -12.2133 -12.1927 -12.1927 -12.1927 -12.1927 -12.1633 -12.1633 -12.1633 -12.1633 -12.1200 -12.1200 -12.1200 -12.1200 -8.8458 -8.8458 -8.8451 -8.8451 1.1754 1.1754 1.1756 1.1756 1.5613 1.5613 1.5617 1.5617 1.5674 1.5674 1.5679 1.5679 2.0630 2.0630 2.0632 2.0632 3.6605 3.6605 3.6605 3.6605 4.2131 4.2131 4.2131 4.2131 k = 0.0617 0.1069 0.5136 ( 13294 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6713 -12.6713 -12.6065 -12.6065 -12.6065 -12.6065 -12.5327 -12.5327 -12.5327 -12.5327 -12.3727 -12.3727 -12.3727 -12.3727 -12.3286 -12.3286 -12.3286 -12.3286 -12.2131 -12.2131 -12.2131 -12.2131 -12.1928 -12.1928 -12.1928 -12.1928 -12.1631 -12.1631 -12.1631 -12.1631 -12.1198 -12.1198 -12.1198 -12.1198 -8.8458 -8.8458 -8.8451 -8.8451 1.1693 1.1693 1.1696 1.1696 1.5634 1.5634 1.5639 1.5639 1.5696 1.5696 1.5701 1.5701 2.0505 2.0505 2.0508 2.0508 3.7263 3.7263 3.7263 3.7263 4.2234 4.2234 4.2234 4.2234 k = 0.0494 0.0855 0.5136 ( 13316 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6066 -12.6066 -12.6066 -12.6066 -12.5325 -12.5325 -12.5325 -12.5325 -12.3729 -12.3729 -12.3729 -12.3729 -12.3289 -12.3289 -12.3289 -12.3289 -12.2129 -12.2129 -12.2129 -12.2129 -12.1929 -12.1929 -12.1929 -12.1929 -12.1630 -12.1630 -12.1630 -12.1630 -12.1195 -12.1195 -12.1195 -12.1195 -8.8458 -8.8458 -8.8451 -8.8451 1.1643 1.1643 1.1645 1.1645 1.5652 1.5652 1.5657 1.5657 1.5714 1.5714 1.5719 1.5719 2.0404 2.0404 2.0406 2.0406 3.7915 3.7915 3.7915 3.7915 4.2313 4.2313 4.2314 4.2314 k = 0.0370 0.0642 0.5136 ( 13324 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6067 -12.6067 -12.6067 -12.6067 -12.5324 -12.5324 -12.5324 -12.5324 -12.3730 -12.3730 -12.3730 -12.3730 -12.3291 -12.3291 -12.3291 -12.3291 -12.2128 -12.2128 -12.2128 -12.2128 -12.1930 -12.1930 -12.1929 -12.1929 -12.1629 -12.1629 -12.1629 -12.1629 -12.1194 -12.1194 -12.1194 -12.1194 -8.8458 -8.8458 -8.8452 -8.8452 1.1603 1.1603 1.1606 1.1606 1.5666 1.5666 1.5671 1.5671 1.5729 1.5729 1.5734 1.5734 2.0324 2.0324 2.0327 2.0327 3.8546 3.8546 3.8546 3.8546 4.2372 4.2372 4.2372 4.2372 k = 0.0247 0.0428 0.5136 ( 13350 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6714 -12.6714 -12.6714 -12.6714 -12.6068 -12.6068 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3732 -12.3732 -12.3731 -12.3731 -12.3292 -12.3292 -12.3292 -12.3292 -12.2127 -12.2127 -12.2127 -12.2127 -12.1930 -12.1930 -12.1930 -12.1930 -12.1629 -12.1629 -12.1629 -12.1629 -12.1192 -12.1192 -12.1192 -12.1192 -8.8458 -8.8458 -8.8452 -8.8452 1.1575 1.1575 1.1577 1.1577 1.5676 1.5676 1.5682 1.5682 1.5739 1.5739 1.5744 1.5744 2.0268 2.0268 2.0271 2.0271 3.9123 3.9123 3.9124 3.9124 4.2410 4.2410 4.2411 4.2411 k = 0.0123 0.0214 0.5136 ( 13366 PWs) bands (ev): -28.8386 -28.8386 -28.8386 -28.8386 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -28.8034 -12.6715 -12.6715 -12.6714 -12.6714 -12.6068 -12.6068 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3732 -12.3732 -12.3732 -12.3732 -12.3293 -12.3293 -12.3293 -12.3293 -12.2127 -12.2127 -12.2127 -12.2127 -12.1930 -12.1930 -12.1930 -12.1930 -12.1628 -12.1628 -12.1628 -12.1628 -12.1192 -12.1192 -12.1192 -12.1192 -8.8458 -8.8458 -8.8452 -8.8452 1.1557 1.1557 1.1560 1.1560 1.5682 1.5682 1.5688 1.5688 1.5745 1.5745 1.5750 1.5750 2.0234 2.0234 2.0237 2.0237 3.9575 3.9575 3.9576 3.9576 4.2425 4.2425 4.2425 4.2425 k = 0.0000 0.0000 0.5136 ( 13386 PWs) bands (ev): -28.8387 -28.8387 -28.8387 -28.8387 -28.8035 -28.8035 -28.8035 -28.8035 -28.8034 -28.8034 -28.8034 -28.8034 -12.6715 -12.6715 -12.6714 -12.6714 -12.6069 -12.6069 -12.6068 -12.6068 -12.5323 -12.5323 -12.5323 -12.5323 -12.3733 -12.3733 -12.3732 -12.3732 -12.3294 -12.3294 -12.3294 -12.3294 -12.2126 -12.2126 -12.2126 -12.2126 -12.1931 -12.1931 -12.1930 -12.1930 -12.1628 -12.1628 -12.1628 -12.1628 -12.1191 -12.1191 -12.1191 -12.1191 -8.8458 -8.8458 -8.8452 -8.8452 1.1551 1.1551 1.1554 1.1554 1.5684 1.5684 1.5689 1.5689 1.5747 1.5747 1.5752 1.5752 2.0222 2.0222 2.0225 2.0225 3.9760 3.9760 3.9760 3.9760 4.2393 4.2393 4.2393 4.2393 k = 0.5000 0.2887 0.5136 ( 13276 PWs) bands (ev): -28.8381 -28.8381 -28.8381 -28.8381 -28.8038 -28.8038 -28.8038 -28.8038 -28.8035 -28.8035 -28.8035 -28.8035 -12.6707 -12.6707 -12.6707 -12.6707 -12.6038 -12.6038 -12.6038 -12.6038 -12.5362 -12.5362 -12.5362 -12.5362 -12.3686 -12.3686 -12.3686 -12.3686 -12.3224 -12.3224 -12.3224 -12.3224 -12.2174 -12.2174 -12.2174 -12.2174 -12.1912 -12.1912 -12.1912 -12.1912 -12.1660 -12.1660 -12.1660 -12.1660 -12.1249 -12.1249 -12.1249 -12.1249 -8.8455 -8.8455 -8.8448 -8.8448 1.3226 1.3226 1.3230 1.3230 1.4775 1.4775 1.4780 1.4780 1.5314 1.5314 1.5320 1.5320 2.5703 2.5703 2.5705 2.5705 2.6886 2.6886 2.6886 2.6886 4.0888 4.0888 4.0888 4.0888 k = 0.5000 0.2887 0.4891 ( 13286 PWs) bands (ev): -28.8384 -28.8384 -28.8377 -28.8377 -28.8040 -28.8040 -28.8037 -28.8037 -28.8037 -28.8037 -28.8034 -28.8034 -12.6740 -12.6740 -12.6673 -12.6673 -12.6040 -12.6040 -12.6035 -12.6035 -12.5381 -12.5381 -12.5344 -12.5344 -12.3707 -12.3707 -12.3667 -12.3667 -12.3246 -12.3246 -12.3202 -12.3202 -12.2193 -12.2193 -12.2156 -12.2156 -12.1937 -12.1937 -12.1885 -12.1885 -12.1682 -12.1682 -12.1638 -12.1638 -12.1259 -12.1259 -12.1240 -12.1240 -8.8472 -8.8472 -8.8432 -8.8432 1.2880 1.2880 1.3574 1.3574 1.4545 1.4545 1.4995 1.4995 1.5137 1.5137 1.5518 1.5518 2.5452 2.5452 2.5983 2.5983 2.6358 2.6358 2.7433 2.7433 4.0608 4.0608 4.1170 4.1170 k = 0.5000 0.2887 0.4647 ( 13280 PWs) bands (ev): -28.8388 -28.8388 -28.8373 -28.8373 -28.8042 -28.8042 -28.8038 -28.8038 -28.8035 -28.8035 -28.8032 -28.8032 -12.6772 -12.6772 -12.6639 -12.6639 -12.6042 -12.6042 -12.6033 -12.6033 -12.5400 -12.5400 -12.5326 -12.5326 -12.3729 -12.3729 -12.3650 -12.3650 -12.3267 -12.3267 -12.3180 -12.3180 -12.2212 -12.2212 -12.2139 -12.2139 -12.1962 -12.1962 -12.1857 -12.1857 -12.1704 -12.1704 -12.1616 -12.1616 -12.1268 -12.1268 -12.1230 -12.1230 -8.8491 -8.8491 -8.8413 -8.8413 1.2534 1.2534 1.3916 1.3916 1.4306 1.4306 1.4956 1.4956 1.5210 1.5210 1.5736 1.5736 2.5226 2.5226 2.5851 2.5851 2.6292 2.6292 2.8000 2.8000 4.0335 4.0335 4.1447 4.1447 k = 0.5000 0.2887 0.4402 ( 13288 PWs) bands (ev): -28.8391 -28.8391 -28.8370 -28.8370 -28.8044 -28.8044 -28.8040 -28.8040 -28.8033 -28.8033 -28.8030 -28.8030 -12.6802 -12.6802 -12.6603 -12.6603 -12.6044 -12.6044 -12.6030 -12.6030 -12.5420 -12.5420 -12.5308 -12.5308 -12.3754 -12.3754 -12.3635 -12.3635 -12.3287 -12.3287 -12.3158 -12.3158 -12.2231 -12.2231 -12.2122 -12.2122 -12.1985 -12.1985 -12.1829 -12.1829 -12.1725 -12.1725 -12.1593 -12.1593 -12.1277 -12.1277 -12.1220 -12.1220 -8.8511 -8.8511 -8.8394 -8.8394 1.2191 1.2191 1.4062 1.4062 1.4253 1.4253 1.4798 1.4798 1.5401 1.5401 1.5969 1.5969 2.5022 2.5022 2.5363 2.5363 2.6632 2.6632 2.8586 2.8586 4.0073 4.0073 4.1707 4.1707 k = 0.5000 0.2887 0.4157 ( 13282 PWs) bands (ev): -28.8395 -28.8395 -28.8366 -28.8366 -28.8045 -28.8045 -28.8042 -28.8042 -28.8031 -28.8031 -28.8029 -28.8029 -12.6832 -12.6832 -12.6567 -12.6567 -12.6045 -12.6045 -12.6027 -12.6027 -12.5441 -12.5441 -12.5292 -12.5292 -12.3781 -12.3781 -12.3621 -12.3621 -12.3305 -12.3305 -12.3136 -12.3136 -12.2250 -12.2250 -12.2106 -12.2106 -12.2006 -12.2006 -12.1801 -12.1801 -12.1746 -12.1746 -12.1571 -12.1571 -12.1285 -12.1285 -12.1210 -12.1210 -8.8531 -8.8531 -8.8376 -8.8376 1.1855 1.1855 1.3821 1.3821 1.4577 1.4577 1.4647 1.4647 1.5581 1.5581 1.6214 1.6214 2.4832 2.4832 2.4902 2.4902 2.7007 2.7007 2.9192 2.9192 3.9824 3.9824 4.1935 4.1935 k = 0.5000 0.2887 0.3913 ( 13286 PWs) bands (ev): -28.8398 -28.8398 -28.8363 -28.8363 -28.8047 -28.8047 -28.8044 -28.8044 -28.8030 -28.8030 -28.8027 -28.8027 -12.6860 -12.6860 -12.6530 -12.6530 -12.6047 -12.6047 -12.6023 -12.6023 -12.5462 -12.5462 -12.5275 -12.5275 -12.3810 -12.3810 -12.3609 -12.3609 -12.3322 -12.3322 -12.3116 -12.3116 -12.2269 -12.2269 -12.2092 -12.2092 -12.2026 -12.2026 -12.1773 -12.1773 -12.1766 -12.1766 -12.1549 -12.1549 -12.1293 -12.1293 -12.1200 -12.1200 -8.8550 -8.8550 -8.8358 -8.8358 1.1527 1.1527 1.3583 1.3583 1.4504 1.4504 1.4891 1.4891 1.5751 1.5751 1.6465 1.6465 2.4442 2.4442 2.4681 2.4681 2.7417 2.7417 2.9816 2.9816 3.9590 3.9590 4.2113 4.2113 k = 0.5000 0.2887 0.3668 ( 13280 PWs) bands (ev): -28.8402 -28.8402 -28.8359 -28.8359 -28.8049 -28.8049 -28.8045 -28.8045 -28.8028 -28.8028 -28.8026 -28.8026 -12.6887 -12.6887 -12.6493 -12.6493 -12.6047 -12.6047 -12.6020 -12.6020 -12.5483 -12.5483 -12.5260 -12.5260 -12.3839 -12.3839 -12.3599 -12.3599 -12.3338 -12.3338 -12.3096 -12.3096 -12.2288 -12.2288 -12.2078 -12.2078 -12.2044 -12.2044 -12.1786 -12.1786 -12.1744 -12.1744 -12.1526 -12.1526 -12.1300 -12.1300 -12.1190 -12.1190 -8.8569 -8.8569 -8.8341 -8.8341 1.1210 1.1210 1.3352 1.3352 1.4368 1.4368 1.5190 1.5190 1.5915 1.5915 1.6718 1.6718 2.4014 2.4014 2.4534 2.4534 2.7865 2.7865 3.0459 3.0459 3.9372 3.9372 4.2222 4.2222 k = 0.5000 0.2887 0.3424 ( 13274 PWs) bands (ev): -28.8405 -28.8405 -28.8356 -28.8356 -28.8050 -28.8050 -28.8046 -28.8046 -28.8026 -28.8026 -28.8024 -28.8024 -12.6913 -12.6913 -12.6455 -12.6455 -12.6048 -12.6048 -12.6017 -12.6017 -12.5505 -12.5505 -12.5245 -12.5245 -12.3870 -12.3870 -12.3589 -12.3589 -12.3352 -12.3352 -12.3078 -12.3078 -12.2307 -12.2307 -12.2073 -12.2073 -12.2053 -12.2053 -12.1805 -12.1805 -12.1717 -12.1717 -12.1504 -12.1504 -12.1307 -12.1307 -12.1180 -12.1180 -8.8588 -8.8588 -8.8325 -8.8325 1.0906 1.0906 1.3130 1.3130 1.4238 1.4238 1.5472 1.5472 1.6074 1.6074 1.6969 1.6969 2.3605 2.3605 2.4404 2.4404 2.8351 2.8351 3.1120 3.1120 3.9170 3.9170 4.2249 4.2249 k = 0.5000 0.2887 0.3179 ( 13268 PWs) bands (ev): -28.8408 -28.8408 -28.8353 -28.8353 -28.8052 -28.8052 -28.8048 -28.8048 -28.8025 -28.8025 -28.8022 -28.8022 -12.6937 -12.6937 -12.6416 -12.6416 -12.6048 -12.6048 -12.6013 -12.6013 -12.5528 -12.5528 -12.5231 -12.5231 -12.3901 -12.3901 -12.3580 -12.3580 -12.3365 -12.3365 -12.3061 -12.3061 -12.2325 -12.2325 -12.2083 -12.2083 -12.2046 -12.2046 -12.1823 -12.1823 -12.1691 -12.1691 -12.1483 -12.1483 -12.1313 -12.1313 -12.1171 -12.1171 -8.8606 -8.8606 -8.8309 -8.8309 1.0617 1.0617 1.2917 1.2917 1.4116 1.4116 1.5736 1.5736 1.6228 1.6228 1.7217 1.7217 2.3214 2.3214 2.4288 2.4288 2.8877 2.8877 3.1798 3.1798 3.8986 3.8986 4.2199 4.2199 k = 0.5000 0.2887 0.2935 ( 13282 PWs) bands (ev): -28.8411 -28.8411 -28.8350 -28.8350 -28.8053 -28.8053 -28.8049 -28.8049 -28.8023 -28.8023 -28.8021 -28.8021 -12.6959 -12.6959 -12.6378 -12.6378 -12.6048 -12.6048 -12.6010 -12.6010 -12.5552 -12.5552 -12.5217 -12.5217 -12.3933 -12.3933 -12.3573 -12.3573 -12.3377 -12.3377 -12.3045 -12.3045 -12.2343 -12.2343 -12.2096 -12.2096 -12.2036 -12.2036 -12.1840 -12.1840 -12.1666 -12.1666 -12.1462 -12.1462 -12.1318 -12.1318 -12.1162 -12.1162 -8.8623 -8.8623 -8.8295 -8.8295 1.0343 1.0343 1.2715 1.2715 1.4001 1.4001 1.5981 1.5981 1.6377 1.6377 1.7459 1.7459 2.2843 2.2843 2.4185 2.4185 2.9442 2.9442 3.2492 3.2492 3.8819 3.8819 4.2084 4.2084 k = 0.5000 0.2887 0.2690 ( 13286 PWs) bands (ev): -28.8414 -28.8414 -28.8347 -28.8347 -28.8055 -28.8055 -28.8051 -28.8051 -28.8022 -28.8022 -28.8020 -28.8020 -12.6980 -12.6980 -12.6339 -12.6339 -12.6048 -12.6048 -12.6007 -12.6007 -12.5576 -12.5576 -12.5205 -12.5205 -12.3964 -12.3964 -12.3566 -12.3566 -12.3387 -12.3387 -12.3030 -12.3030 -12.2360 -12.2360 -12.2109 -12.2109 -12.2026 -12.2026 -12.1856 -12.1856 -12.1643 -12.1643 -12.1442 -12.1442 -12.1321 -12.1321 -12.1153 -12.1153 -8.8640 -8.8640 -8.8281 -8.8281 1.0087 1.0087 1.2526 1.2526 1.3894 1.3894 1.6205 1.6205 1.6522 1.6522 1.7693 1.7693 2.2490 2.2490 2.4094 2.4094 3.0047 3.0047 3.3200 3.3200 3.8671 3.8671 4.1928 4.1928 k = 0.5000 0.2887 0.2446 ( 13286 PWs) bands (ev): -28.8417 -28.8417 -28.8345 -28.8345 -28.8056 -28.8056 -28.8052 -28.8052 -28.8021 -28.8021 -28.8019 -28.8019 -12.7000 -12.7000 -12.6300 -12.6300 -12.6048 -12.6048 -12.6004 -12.6004 -12.5602 -12.5602 -12.5193 -12.5193 -12.3994 -12.3994 -12.3560 -12.3560 -12.3396 -12.3396 -12.3017 -12.3017 -12.2376 -12.2376 -12.2121 -12.2121 -12.2016 -12.2016 -12.1870 -12.1870 -12.1622 -12.1622 -12.1423 -12.1423 -12.1323 -12.1323 -12.1145 -12.1145 -8.8655 -8.8655 -8.8269 -8.8269 0.9849 0.9849 1.2349 1.2349 1.3795 1.3795 1.6408 1.6408 1.6663 1.6663 1.7919 1.7919 2.2156 2.2156 2.4015 2.4015 3.0691 3.0691 3.3921 3.3921 3.8543 3.8543 4.1747 4.1747 k = 0.5000 0.2887 0.2201 ( 13298 PWs) bands (ev): -28.8419 -28.8419 -28.8342 -28.8342 -28.8057 -28.8057 -28.8053 -28.8053 -28.8020 -28.8020 -28.8018 -28.8018 -12.7017 -12.7017 -12.6261 -12.6261 -12.6047 -12.6047 -12.6001 -12.6001 -12.5628 -12.5628 -12.5182 -12.5182 -12.4023 -12.4023 -12.3554 -12.3554 -12.3403 -12.3403 -12.3005 -12.3005 -12.2391 -12.2391 -12.2132 -12.2132 -12.2008 -12.2008 -12.1883 -12.1883 -12.1603 -12.1603 -12.1408 -12.1408 -12.1323 -12.1323 -12.1137 -12.1137 -8.8669 -8.8669 -8.8257 -8.8257 0.9631 0.9631 1.2187 1.2187 1.3704 1.3704 1.6591 1.6591 1.6799 1.6799 1.8135 1.8135 2.1840 2.1840 2.3945 2.3945 3.1374 3.1374 3.4648 3.4648 3.8440 3.8440 4.1558 4.1558 k = 0.5000 0.2887 0.1956 ( 13302 PWs) bands (ev): -28.8421 -28.8421 -28.8340 -28.8340 -28.8058 -28.8058 -28.8054 -28.8054 -28.8019 -28.8019 -28.8017 -28.8017 -12.7033 -12.7033 -12.6222 -12.6222 -12.6046 -12.6046 -12.5998 -12.5998 -12.5655 -12.5655 -12.5172 -12.5172 -12.4050 -12.4050 -12.3550 -12.3550 -12.3410 -12.3410 -12.2995 -12.2995 -12.2405 -12.2405 -12.2141 -12.2141 -12.2001 -12.2001 -12.1895 -12.1895 -12.1586 -12.1586 -12.1396 -12.1396 -12.1319 -12.1319 -12.1131 -12.1131 -8.8682 -8.8682 -8.8247 -8.8247 0.9434 0.9434 1.2040 1.2040 1.3621 1.3621 1.6752 1.6752 1.6928 1.6928 1.8341 1.8341 2.1542 2.1542 2.3884 2.3884 3.2093 3.2093 3.5375 3.5375 3.8367 3.8367 4.1371 4.1371 k = 0.5000 0.2887 0.1712 ( 13288 PWs) bands (ev): -28.8423 -28.8423 -28.8338 -28.8338 -28.8059 -28.8059 -28.8054 -28.8054 -28.8018 -28.8018 -28.8016 -28.8016 -12.7047 -12.7047 -12.6184 -12.6184 -12.6045 -12.6045 -12.5995 -12.5995 -12.5682 -12.5682 -12.5164 -12.5164 -12.4075 -12.4075 -12.3546 -12.3546 -12.3416 -12.3416 -12.2986 -12.2986 -12.2417 -12.2417 -12.2149 -12.2149 -12.1996 -12.1996 -12.1904 -12.1904 -12.1571 -12.1571 -12.1388 -12.1388 -12.1312 -12.1312 -12.1124 -12.1124 -8.8694 -8.8694 -8.8238 -8.8238 0.9258 0.9258 1.1909 1.1909 1.3548 1.3548 1.6893 1.6893 1.7050 1.7050 1.8537 1.8537 2.1262 2.1262 2.3832 2.3832 3.2848 3.2848 3.6080 3.6080 3.8341 3.8341 4.1195 4.1195 k = 0.5000 0.2887 0.1467 ( 13312 PWs) bands (ev): -28.8425 -28.8425 -28.8336 -28.8336 -28.8060 -28.8060 -28.8056 -28.8056 -28.8017 -28.8017 -28.8015 -28.8015 -12.7060 -12.7060 -12.6147 -12.6147 -12.6043 -12.6043 -12.5993 -12.5993 -12.5711 -12.5711 -12.5156 -12.5156 -12.4098 -12.4098 -12.3542 -12.3542 -12.3421 -12.3421 -12.2978 -12.2978 -12.2429 -12.2429 -12.2157 -12.2157 -12.1992 -12.1992 -12.1912 -12.1912 -12.1559 -12.1559 -12.1384 -12.1384 -12.1303 -12.1303 -12.1119 -12.1119 -8.8705 -8.8705 -8.8230 -8.8230 0.9104 0.9104 1.1794 1.1794 1.3483 1.3483 1.7014 1.7014 1.7162 1.7162 1.8722 1.8722 2.1000 2.1000 2.3788 2.3788 3.3637 3.3637 3.6718 3.6718 3.8408 3.8408 4.1034 4.1034 k = 0.5000 0.2887 0.1223 ( 13304 PWs) bands (ev): -28.8427 -28.8427 -28.8335 -28.8335 -28.8061 -28.8061 -28.8056 -28.8056 -28.8016 -28.8016 -28.8014 -28.8014 -12.7070 -12.7070 -12.6111 -12.6111 -12.6040 -12.6040 -12.5991 -12.5991 -12.5741 -12.5741 -12.5149 -12.5149 -12.4117 -12.4117 -12.3539 -12.3539 -12.3425 -12.3425 -12.2972 -12.2972 -12.2438 -12.2438 -12.2163 -12.2163 -12.1989 -12.1989 -12.1918 -12.1918 -12.1548 -12.1548 -12.1382 -12.1382 -12.1293 -12.1293 -12.1114 -12.1114 -8.8714 -8.8714 -8.8223 -8.8223 0.8973 0.8973 1.1695 1.1695 1.3428 1.3428 1.7116 1.7116 1.7263 1.7263 1.8899 1.8899 2.0754 2.0754 2.3752 2.3752 3.4457 3.4457 3.7190 3.7190 3.8660 3.8660 4.0893 4.0893 k = 0.5000 0.2887 0.0978 ( 13306 PWs) bands (ev): -28.8428 -28.8428 -28.8334 -28.8334 -28.8061 -28.8061 -28.8057 -28.8057 -28.8016 -28.8016 -28.8014 -28.8014 -12.7079 -12.7079 -12.6082 -12.6082 -12.6032 -12.6032 -12.5989 -12.5989 -12.5772 -12.5772 -12.5144 -12.5144 -12.4133 -12.4133 -12.3537 -12.3537 -12.3428 -12.3428 -12.2966 -12.2966 -12.2446 -12.2446 -12.2168 -12.2168 -12.1987 -12.1987 -12.1923 -12.1923 -12.1539 -12.1539 -12.1382 -12.1382 -12.1283 -12.1283 -12.1110 -12.1110 -8.8721 -8.8721 -8.8217 -8.8217 0.8866 0.8866 1.1615 1.1615 1.3383 1.3383 1.7200 1.7200 1.7350 1.7350 1.9069 1.9069 2.0524 2.0524 2.3722 2.3722 3.5306 3.5306 3.7429 3.7429 3.9157 3.9157 4.0774 4.0774 k = 0.5000 0.2887 0.0734 ( 13306 PWs) bands (ev): -28.8429 -28.8429 -28.8333 -28.8333 -28.8062 -28.8062 -28.8057 -28.8057 -28.8015 -28.8015 -28.8013 -28.8013 -12.7086 -12.7086 -12.6064 -12.6064 -12.6014 -12.6014 -12.5987 -12.5987 -12.5803 -12.5803 -12.5139 -12.5139 -12.4146 -12.4146 -12.3535 -12.3535 -12.3430 -12.3430 -12.2962 -12.2962 -12.2453 -12.2453 -12.2172 -12.2172 -12.1986 -12.1986 -12.1926 -12.1926 -12.1533 -12.1533 -12.1381 -12.1381 -12.1275 -12.1275 -12.1107 -12.1107 -8.8727 -8.8727 -8.8213 -8.8213 0.8781 0.8781 1.1551 1.1551 1.3348 1.3348 1.7264 1.7264 1.7421 1.7421 1.9233 1.9233 2.0311 2.0311 2.3700 2.3700 3.6181 3.6181 3.7518 3.7518 3.9800 3.9800 4.0680 4.0680 k = 0.5000 0.2887 0.0489 ( 13300 PWs) bands (ev): -28.8429 -28.8429 -28.8332 -28.8332 -28.8062 -28.8062 -28.8057 -28.8057 -28.8015 -28.8015 -28.8013 -28.8013 -12.7091 -12.7091 -12.6057 -12.6057 -12.5994 -12.5994 -12.5978 -12.5978 -12.5833 -12.5833 -12.5136 -12.5136 -12.4155 -12.4155 -12.3534 -12.3534 -12.3432 -12.3432 -12.2959 -12.2959 -12.2457 -12.2457 -12.2175 -12.2175 -12.1986 -12.1986 -12.1927 -12.1927 -12.1528 -12.1528 -12.1382 -12.1382 -12.1269 -12.1269 -12.1105 -12.1105 -8.8731 -8.8731 -8.8210 -8.8210 0.8721 0.8721 1.1506 1.1506 1.3322 1.3322 1.7310 1.7310 1.7474 1.7474 1.9394 1.9394 2.0113 2.0113 2.3684 2.3684 3.7073 3.7073 3.7549 3.7549 4.0465 4.0465 4.0612 4.0612 k = 0.5000 0.2887 0.0245 ( 13292 PWs) bands (ev): -28.8430 -28.8430 -28.8332 -28.8332 -28.8062 -28.8062 -28.8057 -28.8057 -28.8015 -28.8015 -28.8013 -28.8013 -12.7093 -12.7093 -12.6054 -12.6054 -12.5989 -12.5989 -12.5953 -12.5953 -12.5862 -12.5862 -12.5134 -12.5134 -12.4161 -12.4161 -12.3533 -12.3533 -12.3433 -12.3433 -12.2958 -12.2958 -12.2460 -12.2460 -12.2176 -12.2176 -12.1986 -12.1986 -12.1928 -12.1928 -12.1525 -12.1525 -12.1382 -12.1382 -12.1265 -12.1265 -12.1103 -12.1103 -8.8734 -8.8734 -8.8208 -8.8208 0.8685 0.8685 1.1478 1.1478 1.3307 1.3307 1.7338 1.7338 1.7507 1.7507 1.9551 1.9551 1.9933 1.9933 2.3674 2.3674 3.7557 3.7557 3.7961 3.7961 4.0090 4.0090 4.0571 4.0571 k = 0.5000 0.2887-0.0000 ( 13298 PWs) bands (ev): -28.8430 -28.8430 -28.8331 -28.8331 -28.8062 -28.8062 -28.8058 -28.8058 -28.8015 -28.8015 -28.8013 -28.8013 -12.7095 -12.7095 -12.6054 -12.6054 -12.5989 -12.5989 -12.5937 -12.5937 -12.5877 -12.5877 -12.5134 -12.5134 -12.4163 -12.4163 -12.3533 -12.3533 -12.3433 -12.3433 -12.2957 -12.2957 -12.2461 -12.2461 -12.2177 -12.2177 -12.1986 -12.1986 -12.1928 -12.1928 -12.1524 -12.1524 -12.1382 -12.1382 -12.1264 -12.1264 -12.1103 -12.1103 -8.8734 -8.8734 -8.8207 -8.8207 0.8672 0.8672 1.1469 1.1469 1.3302 1.3302 1.7347 1.7347 1.7518 1.7518 1.9659 1.9659 1.9818 1.9818 2.3671 2.3671 3.7559 3.7559 3.8570 3.8570 3.9462 3.9462 4.0557 4.0557 k = 0.3333 0.5774-0.0000 ( 13308 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8061 -28.8061 -28.8014 -28.8014 -28.8014 -28.8014 -12.7086 -12.7086 -12.6042 -12.6042 -12.5984 -12.5984 -12.5942 -12.5942 -12.5882 -12.5882 -12.5144 -12.5144 -12.4163 -12.4163 -12.3525 -12.3525 -12.3427 -12.3427 -12.2952 -12.2952 -12.2471 -12.2471 -12.2180 -12.2180 -12.1964 -12.1964 -12.1951 -12.1951 -12.1520 -12.1520 -12.1382 -12.1382 -12.1283 -12.1283 -12.1101 -12.1101 -8.8730 -8.8730 -8.8207 -8.8207 1.0286 1.0286 1.0318 1.0318 1.1584 1.1584 1.7382 1.7382 1.7468 1.7468 1.9798 1.9798 2.3960 2.3960 2.4000 2.4000 2.9062 2.9062 3.9944 3.9944 3.9949 3.9949 4.1851 4.1851 k = 0.3333 0.5774 0.0245 ( 13290 PWs) bands (ev): -28.8429 -28.8429 -28.8331 -28.8331 -28.8061 -28.8061 -28.8061 -28.8061 -28.8014 -28.8014 -28.8014 -28.8014 -12.7085 -12.7085 -12.6042 -12.6042 -12.5984 -12.5984 -12.5959 -12.5959 -12.5866 -12.5866 -12.5145 -12.5145 -12.4161 -12.4161 -12.3525 -12.3525 -12.3427 -12.3427 -12.2953 -12.2953 -12.2470 -12.2470 -12.2179 -12.2179 -12.1964 -12.1964 -12.1951 -12.1951 -12.1521 -12.1521 -12.1381 -12.1381 -12.1284 -12.1284 -12.1101 -12.1101 -8.8729 -8.8729 -8.8207 -8.8207 1.0297 1.0297 1.0328 1.0328 1.1593 1.1593 1.7374 1.7374 1.7460 1.7460 1.9781 1.9781 2.3966 2.3966 2.4006 2.4006 2.9083 2.9083 3.9568 3.9568 3.9577 3.9577 4.2244 4.2244 k = 0.3333 0.5774 0.0489 ( 13293 PWs) bands (ev): -28.8428 -28.8428 -28.8331 -28.8331 -28.8060 -28.8060 -28.8060 -28.8060 -28.8014 -28.8014 -28.8014 -28.8014 -12.7082 -12.7082 -12.6043 -12.6043 -12.5991 -12.5991 -12.5985 -12.5985 -12.5836 -12.5836 -12.5146 -12.5146 -12.4155 -12.4155 -12.3526 -12.3526 -12.3426 -12.3426 -12.2955 -12.2955 -12.2467 -12.2467 -12.2177 -12.2177 -12.1966 -12.1966 -12.1948 -12.1948 -12.1524 -12.1524 -12.1380 -12.1380 -12.1289 -12.1289 -12.1103 -12.1103 -8.8727 -8.8727 -8.8209 -8.8209 1.0328 1.0328 1.0359 1.0359 1.1620 1.1620 1.7350 1.7350 1.7435 1.7435 1.9730 1.9730 2.3984 2.3984 2.4024 2.4024 2.9145 2.9145 3.8827 3.8827 3.8841 3.8841 4.3035 4.3035 k = 0.3333 0.5774 0.0734 ( 13260 PWs) bands (ev): -28.8428 -28.8428 -28.8332 -28.8332 -28.8060 -28.8060 -28.8060 -28.8060 -28.8014 -28.8014 -28.8014 -28.8014 -12.7077 -12.7077 -12.6043 -12.6043 -12.6026 -12.6026 -12.5986 -12.5986 -12.5805 -12.5805 -12.5150 -12.5150 -12.4145 -12.4145 -12.3527 -12.3527 -12.3424 -12.3424 -12.2957 -12.2957 -12.2462 -12.2462 -12.2174 -12.2174 -12.1968 -12.1968 -12.1945 -12.1945 -12.1529 -12.1529 -12.1379 -12.1379 -12.1296 -12.1296 -12.1105 -12.1105 -8.8723 -8.8723 -8.8212 -8.8212 1.0379 1.0379 1.0411 1.0411 1.1666 1.1666 1.7309 1.7309 1.7394 1.7394 1.9647 1.9647 2.4014 2.4014 2.4054 2.4054 2.9246 2.9246 3.8008 3.8008 3.8023 3.8023 4.3939 4.3939 k = 0.3333 0.5774 0.0978 ( 13266 PWs) bands (ev): -28.8427 -28.8427 -28.8333 -28.8333 -28.8060 -28.8060 -28.8060 -28.8060 -28.8015 -28.8015 -28.8015 -28.8015 -12.7071 -12.7071 -12.6063 -12.6063 -12.6043 -12.6043 -12.5987 -12.5987 -12.5774 -12.5774 -12.5154 -12.5154 -12.4132 -12.4132 -12.3529 -12.3529 -12.3421 -12.3421 -12.2961 -12.2961 -12.2456 -12.2456 -12.2170 -12.2170 -12.1972 -12.1972 -12.1939 -12.1939 -12.1535 -12.1535 -12.1377 -12.1377 -12.1306 -12.1306 -12.1108 -12.1108 -8.8717 -8.8717 -8.8217 -8.8217 1.0451 1.0451 1.0483 1.0483 1.1730 1.1730 1.7252 1.7252 1.7337 1.7337 1.9532 1.9532 2.4055 2.4055 2.4096 2.4096 2.9387 2.9387 3.7177 3.7177 3.7194 3.7194 4.4885 4.4885 k = 0.3333 0.5774 0.1223 ( 13263 PWs) bands (ev): -28.8426 -28.8426 -28.8334 -28.8334 -28.8059 -28.8059 -28.8059 -28.8059 -28.8015 -28.8015 -28.8015 -28.8015 -12.7062 -12.7062 -12.6101 -12.6101 -12.6044 -12.6044 -12.5989 -12.5989 -12.5744 -12.5744 -12.5159 -12.5159 -12.4116 -12.4116 -12.3531 -12.3531 -12.3418 -12.3418 -12.2967 -12.2967 -12.2448 -12.2448 -12.2164 -12.2164 -12.1976 -12.1976 -12.1933 -12.1933 -12.1544 -12.1544 -12.1374 -12.1374 -12.1319 -12.1319 -12.1112 -12.1112 -8.8710 -8.8710 -8.8223 -8.8223 1.0543 1.0543 1.0575 1.0575 1.1812 1.1812 1.7179 1.7179 1.7263 1.7263 1.9389 1.9389 2.4109 2.4109 2.4150 2.4150 2.9565 2.9565 3.6355 3.6355 3.6374 3.6374 4.4952 4.4952 k = 0.3333 0.5774 0.1467 ( 13266 PWs) bands (ev): -28.8424 -28.8424 -28.8335 -28.8335 -28.8058 -28.8058 -28.8058 -28.8058 -28.8016 -28.8016 -28.8016 -28.8016 -12.7052 -12.7052 -12.6139 -12.6139 -12.6044 -12.6044 -12.5991 -12.5991 -12.5714 -12.5714 -12.5166 -12.5166 -12.4096 -12.4096 -12.3534 -12.3534 -12.3414 -12.3414 -12.2973 -12.2973 -12.2438 -12.2438 -12.2158 -12.2158 -12.1982 -12.1982 -12.1925 -12.1925 -12.1555 -12.1555 -12.1371 -12.1371 -12.1334 -12.1334 -12.1117 -12.1117 -8.8701 -8.8701 -8.8229 -8.8229 1.0654 1.0654 1.0687 1.0687 1.1911 1.1911 1.7090 1.7090 1.7172 1.7172 1.9219 1.9219 2.4175 2.4175 2.4216 2.4216 2.9777 2.9777 3.5552 3.5552 3.5572 3.5572 4.4549 4.4549 k = 0.3333 0.5774 0.1712 ( 13278 PWs) bands (ev): -28.8423 -28.8423 -28.8337 -28.8337 -28.8058 -28.8058 -28.8058 -28.8058 -28.8017 -28.8017 -28.8017 -28.8017 -12.7040 -12.7040 -12.6178 -12.6178 -12.6045 -12.6045 -12.5993 -12.5993 -12.5686 -12.5686 -12.5174 -12.5174 -12.4073 -12.4073 -12.3538 -12.3538 -12.3409 -12.3409 -12.2981 -12.2981 -12.2427 -12.2427 -12.2150 -12.2150 -12.1989 -12.1989 -12.1915 -12.1915 -12.1568 -12.1568 -12.1367 -12.1367 -12.1351 -12.1351 -12.1123 -12.1123 -8.8691 -8.8691 -8.8238 -8.8238 1.0785 1.0785 1.0818 1.0818 1.2027 1.2027 1.6984 1.6984 1.7066 1.7066 1.9026 1.9026 2.4254 2.4254 2.4295 2.4295 3.0022 3.0022 3.4771 3.4771 3.4792 3.4792 4.4098 4.4098 k = 0.3333 0.5774 0.1956 ( 13260 PWs) bands (ev): -28.8420 -28.8420 -28.8339 -28.8339 -28.8057 -28.8057 -28.8056 -28.8056 -28.8018 -28.8018 -28.8018 -28.8018 -12.7026 -12.7026 -12.6217 -12.6217 -12.6045 -12.6045 -12.5995 -12.5995 -12.5658 -12.5658 -12.5182 -12.5182 -12.4048 -12.4048 -12.3542 -12.3542 -12.3404 -12.3404 -12.2989 -12.2989 -12.2414 -12.2414 -12.2141 -12.2141 -12.1996 -12.1996 -12.1904 -12.1904 -12.1583 -12.1583 -12.1369 -12.1369 -12.1362 -12.1362 -12.1130 -12.1130 -8.8679 -8.8679 -8.8247 -8.8247 1.0933 1.0933 1.0968 1.0968 1.2160 1.2160 1.6863 1.6863 1.6943 1.6943 1.8811 1.8811 2.4345 2.4345 2.4386 2.4386 3.0299 3.0299 3.4016 3.4016 3.4037 3.4037 4.3605 4.3605 k = 0.3333 0.5774 0.2201 ( 13269 PWs) bands (ev): -28.8418 -28.8418 -28.8341 -28.8341 -28.8055 -28.8055 -28.8055 -28.8055 -28.8019 -28.8019 -28.8019 -28.8019 -12.7010 -12.7010 -12.6257 -12.6257 -12.6045 -12.6045 -12.5998 -12.5998 -12.5631 -12.5631 -12.5192 -12.5192 -12.4021 -12.4021 -12.3547 -12.3547 -12.3397 -12.3397 -12.3000 -12.3000 -12.2400 -12.2400 -12.2131 -12.2131 -12.2005 -12.2005 -12.1892 -12.1892 -12.1600 -12.1600 -12.1390 -12.1390 -12.1357 -12.1357 -12.1137 -12.1137 -8.8666 -8.8666 -8.8257 -8.8257 1.1100 1.1100 1.1135 1.1135 1.2310 1.2310 1.6725 1.6725 1.6804 1.6804 1.8578 1.8578 2.4449 2.4449 2.4491 2.4491 3.0604 3.0604 3.3288 3.3288 3.3311 3.3311 4.3080 4.3080 k = 0.3333 0.5774 0.2446 ( 13254 PWs) bands (ev): -28.8416 -28.8416 -28.8343 -28.8343 -28.8054 -28.8054 -28.8054 -28.8054 -28.8020 -28.8020 -28.8020 -28.8020 -12.6992 -12.6992 -12.6296 -12.6296 -12.6046 -12.6046 -12.6001 -12.6001 -12.5605 -12.5605 -12.5203 -12.5203 -12.3991 -12.3991 -12.3552 -12.3552 -12.3389 -12.3389 -12.3011 -12.3011 -12.2385 -12.2385 -12.2120 -12.2120 -12.2014 -12.2014 -12.1878 -12.1878 -12.1619 -12.1619 -12.1411 -12.1411 -12.1351 -12.1351 -12.1145 -12.1145 -8.8652 -8.8652 -8.8269 -8.8269 1.1283 1.1283 1.1319 1.1319 1.2475 1.2475 1.6573 1.6573 1.6650 1.6650 1.8329 1.8329 2.4567 2.4567 2.4609 2.4609 3.0937 3.0937 3.2589 3.2589 3.2613 3.2613 4.2528 4.2528 k = 0.3333 0.5774 0.2690 ( 13278 PWs) bands (ev): -28.8413 -28.8413 -28.8346 -28.8346 -28.8053 -28.8053 -28.8053 -28.8053 -28.8021 -28.8021 -28.8021 -28.8021 -12.6973 -12.6973 -12.6335 -12.6335 -12.6046 -12.6046 -12.6004 -12.6004 -12.5581 -12.5581 -12.5215 -12.5215 -12.3961 -12.3961 -12.3558 -12.3558 -12.3380 -12.3380 -12.3024 -12.3024 -12.2368 -12.2368 -12.2108 -12.2108 -12.2025 -12.2025 -12.1863 -12.1863 -12.1640 -12.1640 -12.1433 -12.1433 -12.1345 -12.1345 -12.1154 -12.1154 -8.8637 -8.8637 -8.8281 -8.8281 1.1482 1.1482 1.1519 1.1519 1.2656 1.2656 1.6404 1.6404 1.6480 1.6480 1.8067 1.8067 2.4699 2.4699 2.4740 2.4740 3.1295 3.1295 3.1921 3.1921 3.1946 3.1946 4.1956 4.1956 k = 0.3333 0.5774 0.2935 ( 13302 PWs) bands (ev): -28.8411 -28.8411 -28.8349 -28.8349 -28.8052 -28.8052 -28.8052 -28.8052 -28.8023 -28.8023 -28.8023 -28.8023 -12.6953 -12.6953 -12.6374 -12.6374 -12.6046 -12.6046 -12.6007 -12.6007 -12.5557 -12.5557 -12.5227 -12.5227 -12.3930 -12.3930 -12.3566 -12.3566 -12.3370 -12.3370 -12.3038 -12.3038 -12.2351 -12.2351 -12.2094 -12.2094 -12.2037 -12.2037 -12.1847 -12.1847 -12.1663 -12.1663 -12.1456 -12.1456 -12.1338 -12.1338 -12.1163 -12.1163 -8.8621 -8.8621 -8.8295 -8.8295 1.1695 1.1695 1.1733 1.1733 1.2851 1.2851 1.6221 1.6221 1.6294 1.6294 1.7793 1.7793 2.4845 2.4845 2.4887 2.4887 3.1284 3.1284 3.1310 3.1310 3.1678 3.1678 4.1369 4.1369 k = 0.3333 0.5774 0.3179 ( 13290 PWs) bands (ev): -28.8407 -28.8407 -28.8352 -28.8352 -28.8050 -28.8050 -28.8050 -28.8050 -28.8024 -28.8024 -28.8024 -28.8024 -12.6930 -12.6930 -12.6413 -12.6413 -12.6046 -12.6046 -12.6010 -12.6010 -12.5534 -12.5534 -12.5240 -12.5240 -12.3898 -12.3898 -12.3573 -12.3573 -12.3358 -12.3358 -12.3054 -12.3054 -12.2333 -12.2333 -12.2079 -12.2079 -12.2049 -12.2049 -12.1830 -12.1830 -12.1688 -12.1688 -12.1478 -12.1478 -12.1331 -12.1331 -12.1173 -12.1173 -8.8604 -8.8604 -8.8309 -8.8309 1.1922 1.1922 1.1962 1.1962 1.3060 1.3060 1.6023 1.6023 1.6094 1.6094 1.7511 1.7511 2.5007 2.5007 2.5049 2.5049 3.0679 3.0679 3.0707 3.0707 3.2084 3.2084 4.0772 4.0772 k = 0.3333 0.5774 0.3424 ( 13293 PWs) bands (ev): -28.8404 -28.8404 -28.8355 -28.8355 -28.8049 -28.8049 -28.8049 -28.8049 -28.8026 -28.8026 -28.8026 -28.8026 -12.6907 -12.6907 -12.6452 -12.6452 -12.6045 -12.6045 -12.6014 -12.6014 -12.5511 -12.5511 -12.5254 -12.5254 -12.3866 -12.3866 -12.3582 -12.3582 -12.3345 -12.3345 -12.3071 -12.3071 -12.2314 -12.2314 -12.2063 -12.2063 -12.2063 -12.2063 -12.1812 -12.1812 -12.1714 -12.1714 -12.1502 -12.1502 -12.1323 -12.1323 -12.1183 -12.1183 -8.8586 -8.8586 -8.8325 -8.8325 1.2161 1.2161 1.2202 1.2202 1.3282 1.3282 1.5811 1.5811 1.5881 1.5881 1.7221 1.7221 2.5186 2.5186 2.5227 2.5227 3.0107 3.0107 3.0136 3.0136 3.2512 3.2512 4.0169 4.0169 k = 0.3333 0.5774 0.3668 ( 13287 PWs) bands (ev): -28.8401 -28.8401 -28.8358 -28.8358 -28.8047 -28.8047 -28.8047 -28.8047 -28.8027 -28.8027 -28.8027 -28.8027 -12.6882 -12.6882 -12.6489 -12.6489 -12.6045 -12.6045 -12.6017 -12.6017 -12.5489 -12.5489 -12.5269 -12.5269 -12.3835 -12.3835 -12.3592 -12.3592 -12.3331 -12.3331 -12.3089 -12.3089 -12.2295 -12.2295 -12.2077 -12.2077 -12.2045 -12.2045 -12.1793 -12.1793 -12.1740 -12.1740 -12.1525 -12.1525 -12.1315 -12.1315 -12.1193 -12.1193 -8.8568 -8.8568 -8.8341 -8.8341 1.2411 1.2411 1.2453 1.2453 1.3517 1.3517 1.5587 1.5587 1.5654 1.5654 1.6926 1.6926 2.5381 2.5381 2.5422 2.5422 2.9568 2.9568 2.9598 2.9598 3.2961 3.2961 3.9564 3.9564 k = 0.3333 0.5774 0.3913 ( 13293 PWs) bands (ev): -28.8398 -28.8398 -28.8362 -28.8362 -28.8046 -28.8046 -28.8046 -28.8046 -28.8029 -28.8029 -28.8029 -28.8029 -12.6855 -12.6855 -12.6527 -12.6527 -12.6044 -12.6044 -12.6020 -12.6020 -12.5468 -12.5468 -12.5285 -12.5285 -12.3805 -12.3805 -12.3603 -12.3603 -12.3315 -12.3315 -12.3109 -12.3109 -12.2276 -12.2276 -12.2092 -12.2092 -12.2026 -12.2026 -12.1780 -12.1780 -12.1762 -12.1762 -12.1548 -12.1548 -12.1306 -12.1306 -12.1203 -12.1203 -8.8549 -8.8549 -8.8358 -8.8358 1.2670 1.2670 1.2714 1.2714 1.3763 1.3763 1.5350 1.5350 1.5415 1.5415 1.6627 1.6627 2.5596 2.5596 2.5636 2.5636 2.9061 2.9061 2.9093 2.9093 3.3429 3.3429 3.8959 3.8959 k = 0.3333 0.5774 0.4157 ( 13305 PWs) bands (ev): -28.8394 -28.8394 -28.8365 -28.8365 -28.8044 -28.8044 -28.8044 -28.8044 -28.8030 -28.8030 -28.8030 -28.8030 -12.6827 -12.6827 -12.6564 -12.6564 -12.6043 -12.6043 -12.6024 -12.6024 -12.5447 -12.5447 -12.5301 -12.5301 -12.3777 -12.3777 -12.3615 -12.3615 -12.3298 -12.3298 -12.3129 -12.3129 -12.2256 -12.2256 -12.2108 -12.2108 -12.2006 -12.2006 -12.1800 -12.1800 -12.1750 -12.1750 -12.1572 -12.1572 -12.1297 -12.1297 -12.1214 -12.1214 -8.8530 -8.8530 -8.8376 -8.8376 1.2936 1.2936 1.2982 1.2982 1.4020 1.4020 1.5103 1.5103 1.5165 1.5165 1.6326 1.6326 2.5830 2.5830 2.5870 2.5870 2.8586 2.8586 2.8619 2.8619 3.3917 3.3917 3.8358 3.8358 k = 0.3333 0.5774 0.4402 ( 13302 PWs) bands (ev): -28.8391 -28.8391 -28.8369 -28.8369 -28.8043 -28.8043 -28.8042 -28.8042 -28.8032 -28.8032 -28.8032 -28.8032 -12.6798 -12.6798 -12.6600 -12.6600 -12.6041 -12.6041 -12.6027 -12.6027 -12.5427 -12.5427 -12.5317 -12.5317 -12.3750 -12.3750 -12.3629 -12.3629 -12.3279 -12.3279 -12.3150 -12.3150 -12.2237 -12.2237 -12.2125 -12.2125 -12.1984 -12.1984 -12.1828 -12.1828 -12.1729 -12.1729 -12.1595 -12.1595 -12.1288 -12.1288 -12.1225 -12.1225 -8.8510 -8.8510 -8.8394 -8.8394 1.3207 1.3207 1.3255 1.3255 1.4286 1.4286 1.4847 1.4847 1.4907 1.4907 1.6025 1.6025 2.6085 2.6085 2.6125 2.6125 2.8143 2.8143 2.8177 2.8177 3.4422 3.4422 3.7763 3.7763 k = 0.3333 0.5774 0.4647 ( 13302 PWs) bands (ev): -28.8387 -28.8387 -28.8373 -28.8373 -28.8041 -28.8041 -28.8041 -28.8041 -28.8034 -28.8034 -28.8034 -28.8034 -12.6767 -12.6767 -12.6635 -12.6635 -12.6039 -12.6039 -12.6030 -12.6030 -12.5408 -12.5408 -12.5334 -12.5334 -12.3725 -12.3725 -12.3644 -12.3644 -12.3259 -12.3259 -12.3172 -12.3172 -12.2217 -12.2217 -12.2143 -12.2143 -12.1960 -12.1960 -12.1856 -12.1856 -12.1708 -12.1708 -12.1618 -12.1618 -12.1278 -12.1278 -12.1236 -12.1236 -8.8490 -8.8490 -8.8413 -8.8413 1.3483 1.3483 1.3532 1.3532 1.4545 1.4545 1.4598 1.4598 1.4640 1.4640 1.5725 1.5725 2.6363 2.6363 2.6402 2.6402 2.7731 2.7731 2.7766 2.7766 3.4944 3.4944 3.7176 3.7176 k = 0.3333 0.5774 0.4891 ( 13320 PWs) bands (ev): -28.8384 -28.8384 -28.8376 -28.8376 -28.8039 -28.8039 -28.8039 -28.8039 -28.8036 -28.8036 -28.8036 -28.8036 -12.6736 -12.6736 -12.6670 -12.6670 -12.6037 -12.6037 -12.6032 -12.6032 -12.5389 -12.5389 -12.5352 -12.5352 -12.3702 -12.3702 -12.3662 -12.3662 -12.3238 -12.3238 -12.3194 -12.3194 -12.2198 -12.2198 -12.2161 -12.2161 -12.1936 -12.1936 -12.1883 -12.1883 -12.1686 -12.1686 -12.1641 -12.1641 -12.1268 -12.1268 -12.1247 -12.1247 -8.8471 -8.8471 -8.8432 -8.8432 1.3759 1.3759 1.3811 1.3811 1.4310 1.4310 1.4368 1.4368 1.4845 1.4845 1.5427 1.5427 2.6665 2.6665 2.6703 2.6703 2.7348 2.7348 2.7384 2.7384 3.5482 3.5482 3.6599 3.6599 k = 0.3333 0.5774 0.5136 ( 13308 PWs) bands (ev): -28.8380 -28.8380 -28.8380 -28.8380 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -28.8037 -12.6703 -12.6703 -12.6703 -12.6703 -12.6035 -12.6035 -12.6035 -12.6035 -12.5370 -12.5370 -12.5370 -12.5370 -12.3681 -12.3681 -12.3680 -12.3680 -12.3216 -12.3216 -12.3216 -12.3216 -12.2179 -12.2179 -12.2179 -12.2179 -12.1910 -12.1910 -12.1910 -12.1910 -12.1663 -12.1663 -12.1663 -12.1663 -12.1257 -12.1257 -12.1257 -12.1257 -8.8454 -8.8454 -8.8448 -8.8448 1.4034 1.4034 1.4038 1.4038 1.4088 1.4088 1.4093 1.4093 1.5131 1.5131 1.5136 1.5136 2.6992 2.6992 2.6994 2.6994 2.7030 2.7030 2.7031 2.7031 3.6034 3.6034 3.6034 3.6034 Writing output data file K3N.save init_run : 0.62s CPU 0.74s WALL ( 1 calls) electrons : 597.64s CPU 601.30s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.11s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 597.64s CPU 601.29s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.10s CPU 0.14s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.10s WALL ( 202 calls) cegterg : 535.76s CPU 538.64s WALL ( 271 calls) Called by sum_band: Called by *egterg: h_psi : 340.99s CPU 343.72s WALL ( 4487 calls) s_psi : 10.12s CPU 10.06s WALL ( 4487 calls) g_psi : 0.37s CPU 0.31s WALL ( 4014 calls) cdiaghg : 190.30s CPU 190.76s WALL ( 4216 calls) cegterg:over : 21.10s CPU 21.16s WALL ( 4014 calls) cegterg:upda : 11.20s CPU 11.40s WALL ( 4014 calls) cegterg:last : 7.31s CPU 7.24s WALL ( 675 calls) cdiaghg:chol : 6.65s CPU 6.68s WALL ( 4216 calls) cdiaghg:inve : 5.33s CPU 5.25s WALL ( 4216 calls) cdiaghg:para : 19.26s CPU 19.31s WALL ( 8432 calls) Called by h_psi: h_psi:vloc : 317.95s CPU 320.41s WALL ( 4487 calls) h_psi:vnl : 22.70s CPU 22.97s WALL ( 4487 calls) add_vuspsi : 10.31s CPU 10.47s WALL ( 4487 calls) General routines calbec : 12.37s CPU 12.48s WALL ( 4487 calls) fft : 0.07s CPU 0.07s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 309.77s CPU 311.90s WALL ( 680324 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.21s CPU 0.29s WALL ( 404 calls) Parallel routines fft_scatter : 259.14s CPU 260.60s WALL ( 680347 calls) PWSCF : 11m16.77s CPU 11m35.48s WALL This run was terminated on: 5:56:52 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=