Program PWSCF v.5.1.1 starts on 3Jun2016 at 17:28:15 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./KNbO3.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 30 18 5 896 404 67 Max 31 19 6 903 417 72 Sum 1473 877 261 43179 19685 3295 bravais-lattice index = 14 lattice parameter (alat) = 7.5513 a.u. unit-cell volume = 437.8187 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.551345 celldm(2)= 1.000000 celldm(3)= 1.016767 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.016767 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.983510 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 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 PseudoPot. # 2 for Nb read from file: /users/gautes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for 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 atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Nb 13.00 92.90640 Nb( 1.00) K 9.00 39.09830 K( 1.00) 8 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -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 90 deg rotation - cart. axis [0,0,-1] cryst. s( 3) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 90 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 5) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 6) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 6) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 7) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s( 8) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_4v (4mm) there are 7 classes and 2 irreducible representations the character table: E -E 2C4 -2C4 C2 2s_v 2s_d -C2 -2s_v -2s_d G_6 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 G_7 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C4 3 4 2s_v-2s_v 5 -5 6 -6 2s_d-2s_d 7 -7 -8 8 -E -1 -2C4 -3 -4 Cartesian axes number of k points= 398 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0025126 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0025126 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0025126 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0025126 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0025126 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0025126 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0025126 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0025126 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0025126 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0025126 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0025126 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0025126 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0025126 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0025126 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0025126 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0025126 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0025126 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0025126 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0025126 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0025126 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0025126 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0025126 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0025126 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0025126 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0025126 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0025126 k( 28) = ( 0.0000000 0.3375000 -0.0000000), wk = 0.0025126 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0025126 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0025126 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0025126 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0025126 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0025126 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0025126 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0025126 k( 36) = ( 0.0000000 0.4375000 -0.0000000), wk = 0.0025126 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0025126 k( 38) = ( 0.0000000 0.4625000 -0.0000000), wk = 0.0025126 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0025126 k( 40) = ( 0.0000000 0.4875000 -0.0000000), wk = 0.0025126 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0025126 k( 44) = ( 0.0250000 0.5000000 -0.0000000), wk = 0.0025126 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0025126 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0025126 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0025126 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0025126 k( 49) = ( 0.0875000 0.5000000 -0.0000000), wk = 0.0025126 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0025126 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0025126 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0025126 k( 53) = ( 0.1375000 0.5000000 -0.0000000), wk = 0.0025126 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0025126 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0025126 k( 56) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0025126 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0025126 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0025126 k( 59) = ( 0.2125000 0.5000000 -0.0000000), wk = 0.0025126 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0025126 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0025126 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0025126 k( 63) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0025126 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0025126 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0025126 k( 66) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0025126 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0025126 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0025126 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0025126 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0025126 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0025126 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0025126 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0025126 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0025126 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0025126 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0025126 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0025126 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0025126 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0025126 k( 80) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0025126 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0025126 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0025126 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0025126 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0025126 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0025126 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0025126 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0025126 k( 90) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0025126 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0025126 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0025126 k( 93) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0025126 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0025126 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0025126 k( 96) = ( 0.3839286 0.3839286 -0.0000000), wk = 0.0025126 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0025126 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0025126 k( 99) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0025126 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0025126 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0025126 k( 102) = ( 0.3303571 0.3303571 -0.0000000), wk = 0.0025126 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0025126 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0025126 k( 105) = ( 0.3035714 0.3035714 -0.0000000), wk = 0.0025126 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0025126 k( 107) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0025126 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0025126 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0025126 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0025126 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0025126 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0025126 k( 113) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0025126 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0025126 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0025126 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0025126 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0025126 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0025126 k( 119) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0025126 k( 120) = ( 0.1696429 0.1696429 -0.0000000), wk = 0.0025126 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0025126 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0025126 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0025126 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0025126 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0025126 k( 126) = ( 0.1160714 0.1160714 -0.0000000), wk = 0.0025126 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0025126 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0025126 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0025126 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0025126 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0025126 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0025126 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0025126 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0025126 k( 135) = ( 0.0357143 0.0357143 -0.0000000), wk = 0.0025126 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0025126 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0025126 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0025126 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 141) = ( 0.0000000 0.0000000 0.0126091), wk = 0.0025126 k( 142) = ( 0.0000000 0.0000000 0.0252182), wk = 0.0025126 k( 143) = ( 0.0000000 0.0000000 0.0378273), wk = 0.0025126 k( 144) = ( 0.0000000 0.0000000 0.0504364), wk = 0.0025126 k( 145) = ( 0.0000000 0.0000000 0.0630455), wk = 0.0025126 k( 146) = ( 0.0000000 0.0000000 0.0756546), wk = 0.0025126 k( 147) = ( 0.0000000 0.0000000 0.0882637), wk = 0.0025126 k( 148) = ( 0.0000000 0.0000000 0.1008728), wk = 0.0025126 k( 149) = ( 0.0000000 0.0000000 0.1134819), wk = 0.0025126 k( 150) = ( 0.0000000 0.0000000 0.1260910), wk = 0.0025126 k( 151) = ( 0.0000000 0.0000000 0.1387001), wk = 0.0025126 k( 152) = ( 0.0000000 0.0000000 0.1513092), wk = 0.0025126 k( 153) = ( 0.0000000 0.0000000 0.1639183), wk = 0.0025126 k( 154) = ( 0.0000000 0.0000000 0.1765274), wk = 0.0025126 k( 155) = ( 0.0000000 0.0000000 0.1891365), wk = 0.0025126 k( 156) = ( 0.0000000 0.0000000 0.2017456), wk = 0.0025126 k( 157) = ( 0.0000000 0.0000000 0.2143547), wk = 0.0025126 k( 158) = ( 0.0000000 0.0000000 0.2269638), wk = 0.0025126 k( 159) = ( 0.0000000 0.0000000 0.2395729), wk = 0.0025126 k( 160) = ( 0.0000000 0.0000000 0.2521820), wk = 0.0025126 k( 161) = ( 0.0000000 0.0000000 0.2647911), wk = 0.0025126 k( 162) = ( 0.0000000 0.0000000 0.2774002), wk = 0.0025126 k( 163) = ( 0.0000000 0.0000000 0.2900093), wk = 0.0025126 k( 164) = ( 0.0000000 0.0000000 0.3026184), wk = 0.0025126 k( 165) = ( 0.0000000 0.0000000 0.3152275), wk = 0.0025126 k( 166) = ( 0.0000000 0.0000000 0.3278366), wk = 0.0025126 k( 167) = ( 0.0000000 0.0000000 0.3404457), wk = 0.0025126 k( 168) = ( 0.0000000 0.0000000 0.3530548), wk = 0.0025126 k( 169) = ( 0.0000000 0.0000000 0.3656639), wk = 0.0025126 k( 170) = ( 0.0000000 0.0000000 0.3782730), wk = 0.0025126 k( 171) = ( 0.0000000 0.0000000 0.3908821), wk = 0.0025126 k( 172) = ( 0.0000000 0.0000000 0.4034912), wk = 0.0025126 k( 173) = ( 0.0000000 0.0000000 0.4161003), wk = 0.0025126 k( 174) = ( 0.0000000 0.0000000 0.4287094), wk = 0.0025126 k( 175) = ( 0.0000000 0.0000000 0.4413185), wk = 0.0025126 k( 176) = ( 0.0000000 0.0000000 0.4539276), wk = 0.0025126 k( 177) = ( 0.0000000 0.0000000 0.4665367), wk = 0.0025126 k( 178) = ( 0.0000000 0.0000000 0.4791458), wk = 0.0025126 k( 179) = ( 0.0000000 0.0000000 0.4917549), wk = 0.0025126 k( 180) = ( 0.0000000 0.0000000 0.4917549), wk = 0.0025126 k( 181) = ( 0.0000000 0.0125000 0.4917549), wk = 0.0025126 k( 182) = ( 0.0000000 0.0250000 0.4917549), wk = 0.0025126 k( 183) = ( 0.0000000 0.0375000 0.4917549), wk = 0.0025126 k( 184) = ( 0.0000000 0.0500000 0.4917549), wk = 0.0025126 k( 185) = ( 0.0000000 0.0625000 0.4917549), wk = 0.0025126 k( 186) = ( 0.0000000 0.0750000 0.4917549), wk = 0.0025126 k( 187) = ( 0.0000000 0.0875000 0.4917549), wk = 0.0025126 k( 188) = ( 0.0000000 0.1000000 0.4917549), wk = 0.0025126 k( 189) = ( 0.0000000 0.1125000 0.4917549), wk = 0.0025126 k( 190) = ( 0.0000000 0.1250000 0.4917549), wk = 0.0025126 k( 191) = ( 0.0000000 0.1375000 0.4917549), wk = 0.0025126 k( 192) = ( 0.0000000 0.1500000 0.4917549), wk = 0.0025126 k( 193) = ( 0.0000000 0.1625000 0.4917549), wk = 0.0025126 k( 194) = ( 0.0000000 0.1750000 0.4917549), wk = 0.0025126 k( 195) = ( 0.0000000 0.1875000 0.4917549), wk = 0.0025126 k( 196) = ( 0.0000000 0.2000000 0.4917549), wk = 0.0025126 k( 197) = ( 0.0000000 0.2125000 0.4917549), wk = 0.0025126 k( 198) = ( 0.0000000 0.2250000 0.4917549), wk = 0.0025126 k( 199) = ( 0.0000000 0.2375000 0.4917549), wk = 0.0025126 k( 200) = ( 0.0000000 0.2500000 0.4917549), wk = 0.0025126 k( 201) = ( 0.0000000 0.2625000 0.4917549), wk = 0.0025126 k( 202) = ( 0.0000000 0.2750000 0.4917549), wk = 0.0025126 k( 203) = ( 0.0000000 0.2875000 0.4917549), wk = 0.0025126 k( 204) = ( 0.0000000 0.3000000 0.4917549), wk = 0.0025126 k( 205) = ( 0.0000000 0.3125000 0.4917549), wk = 0.0025126 k( 206) = ( 0.0000000 0.3250000 0.4917549), wk = 0.0025126 k( 207) = ( 0.0000000 0.3375000 0.4917549), wk = 0.0025126 k( 208) = ( 0.0000000 0.3500000 0.4917549), wk = 0.0025126 k( 209) = ( 0.0000000 0.3625000 0.4917549), wk = 0.0025126 k( 210) = ( 0.0000000 0.3750000 0.4917549), wk = 0.0025126 k( 211) = ( 0.0000000 0.3875000 0.4917549), wk = 0.0025126 k( 212) = ( 0.0000000 0.4000000 0.4917549), wk = 0.0025126 k( 213) = ( 0.0000000 0.4125000 0.4917549), wk = 0.0025126 k( 214) = ( 0.0000000 0.4250000 0.4917549), wk = 0.0025126 k( 215) = ( 0.0000000 0.4375000 0.4917549), wk = 0.0025126 k( 216) = ( 0.0000000 0.4500000 0.4917549), wk = 0.0025126 k( 217) = ( 0.0000000 0.4625000 0.4917549), wk = 0.0025126 k( 218) = ( 0.0000000 0.4750000 0.4917549), wk = 0.0025126 k( 219) = ( 0.0000000 0.4875000 0.4917549), wk = 0.0025126 k( 220) = ( 0.0000000 0.5000000 0.4917549), wk = 0.0025126 k( 221) = ( 0.0000000 0.5000000 0.4917549), wk = 0.0025126 k( 222) = ( 0.0125000 0.5000000 0.4917549), wk = 0.0025126 k( 223) = ( 0.0250000 0.5000000 0.4917549), wk = 0.0025126 k( 224) = ( 0.0375000 0.5000000 0.4917549), wk = 0.0025126 k( 225) = ( 0.0500000 0.5000000 0.4917549), wk = 0.0025126 k( 226) = ( 0.0625000 0.5000000 0.4917549), wk = 0.0025126 k( 227) = ( 0.0750000 0.5000000 0.4917549), wk = 0.0025126 k( 228) = ( 0.0875000 0.5000000 0.4917549), wk = 0.0025126 k( 229) = ( 0.1000000 0.5000000 0.4917549), wk = 0.0025126 k( 230) = ( 0.1125000 0.5000000 0.4917549), wk = 0.0025126 k( 231) = ( 0.1250000 0.5000000 0.4917549), wk = 0.0025126 k( 232) = ( 0.1375000 0.5000000 0.4917549), wk = 0.0025126 k( 233) = ( 0.1500000 0.5000000 0.4917549), wk = 0.0025126 k( 234) = ( 0.1625000 0.5000000 0.4917549), wk = 0.0025126 k( 235) = ( 0.1750000 0.5000000 0.4917549), wk = 0.0025126 k( 236) = ( 0.1875000 0.5000000 0.4917549), wk = 0.0025126 k( 237) = ( 0.2000000 0.5000000 0.4917549), wk = 0.0025126 k( 238) = ( 0.2125000 0.5000000 0.4917549), wk = 0.0025126 k( 239) = ( 0.2250000 0.5000000 0.4917549), wk = 0.0025126 k( 240) = ( 0.2375000 0.5000000 0.4917549), wk = 0.0025126 k( 241) = ( 0.2500000 0.5000000 0.4917549), wk = 0.0025126 k( 242) = ( 0.2625000 0.5000000 0.4917549), wk = 0.0025126 k( 243) = ( 0.2750000 0.5000000 0.4917549), wk = 0.0025126 k( 244) = ( 0.2875000 0.5000000 0.4917549), wk = 0.0025126 k( 245) = ( 0.3000000 0.5000000 0.4917549), wk = 0.0025126 k( 246) = ( 0.3125000 0.5000000 0.4917549), wk = 0.0025126 k( 247) = ( 0.3250000 0.5000000 0.4917549), wk = 0.0025126 k( 248) = ( 0.3375000 0.5000000 0.4917549), wk = 0.0025126 k( 249) = ( 0.3500000 0.5000000 0.4917549), wk = 0.0025126 k( 250) = ( 0.3625000 0.5000000 0.4917549), wk = 0.0025126 k( 251) = ( 0.3750000 0.5000000 0.4917549), wk = 0.0025126 k( 252) = ( 0.3875000 0.5000000 0.4917549), wk = 0.0025126 k( 253) = ( 0.4000000 0.5000000 0.4917549), wk = 0.0025126 k( 254) = ( 0.4125000 0.5000000 0.4917549), wk = 0.0025126 k( 255) = ( 0.4250000 0.5000000 0.4917549), wk = 0.0025126 k( 256) = ( 0.4375000 0.5000000 0.4917549), wk = 0.0025126 k( 257) = ( 0.4500000 0.5000000 0.4917549), wk = 0.0025126 k( 258) = ( 0.4625000 0.5000000 0.4917549), wk = 0.0025126 k( 259) = ( 0.4750000 0.5000000 0.4917549), wk = 0.0025126 k( 260) = ( 0.4875000 0.5000000 0.4917549), wk = 0.0025126 k( 261) = ( 0.5000000 0.5000000 0.4917549), wk = 0.0025126 k( 262) = ( 0.5000000 0.5000000 0.4917549), wk = 0.0025126 k( 263) = ( 0.4910714 0.4910714 0.4917549), wk = 0.0025126 k( 264) = ( 0.4821429 0.4821429 0.4917549), wk = 0.0025126 k( 265) = ( 0.4732143 0.4732143 0.4917549), wk = 0.0025126 k( 266) = ( 0.4642857 0.4642857 0.4917549), wk = 0.0025126 k( 267) = ( 0.4553571 0.4553571 0.4917549), wk = 0.0025126 k( 268) = ( 0.4464286 0.4464286 0.4917549), wk = 0.0025126 k( 269) = ( 0.4375000 0.4375000 0.4917549), wk = 0.0025126 k( 270) = ( 0.4285714 0.4285714 0.4917549), wk = 0.0025126 k( 271) = ( 0.4196429 0.4196429 0.4917549), wk = 0.0025126 k( 272) = ( 0.4107143 0.4107143 0.4917549), wk = 0.0025126 k( 273) = ( 0.4017857 0.4017857 0.4917549), wk = 0.0025126 k( 274) = ( 0.3928571 0.3928571 0.4917549), wk = 0.0025126 k( 275) = ( 0.3839286 0.3839286 0.4917549), wk = 0.0025126 k( 276) = ( 0.3750000 0.3750000 0.4917549), wk = 0.0025126 k( 277) = ( 0.3660714 0.3660714 0.4917549), wk = 0.0025126 k( 278) = ( 0.3571429 0.3571429 0.4917549), wk = 0.0025126 k( 279) = ( 0.3482143 0.3482143 0.4917549), wk = 0.0025126 k( 280) = ( 0.3392857 0.3392857 0.4917549), wk = 0.0025126 k( 281) = ( 0.3303571 0.3303571 0.4917549), wk = 0.0025126 k( 282) = ( 0.3214286 0.3214286 0.4917549), wk = 0.0025126 k( 283) = ( 0.3125000 0.3125000 0.4917549), wk = 0.0025126 k( 284) = ( 0.3035714 0.3035714 0.4917549), wk = 0.0025126 k( 285) = ( 0.2946429 0.2946429 0.4917549), wk = 0.0025126 k( 286) = ( 0.2857143 0.2857143 0.4917549), wk = 0.0025126 k( 287) = ( 0.2767857 0.2767857 0.4917549), wk = 0.0025126 k( 288) = ( 0.2678571 0.2678571 0.4917549), wk = 0.0025126 k( 289) = ( 0.2589286 0.2589286 0.4917549), wk = 0.0025126 k( 290) = ( 0.2500000 0.2500000 0.4917549), wk = 0.0025126 k( 291) = ( 0.2410714 0.2410714 0.4917549), wk = 0.0025126 k( 292) = ( 0.2321429 0.2321429 0.4917549), wk = 0.0025126 k( 293) = ( 0.2232143 0.2232143 0.4917549), wk = 0.0025126 k( 294) = ( 0.2142857 0.2142857 0.4917549), wk = 0.0025126 k( 295) = ( 0.2053571 0.2053571 0.4917549), wk = 0.0025126 k( 296) = ( 0.1964286 0.1964286 0.4917549), wk = 0.0025126 k( 297) = ( 0.1875000 0.1875000 0.4917549), wk = 0.0025126 k( 298) = ( 0.1785714 0.1785714 0.4917549), wk = 0.0025126 k( 299) = ( 0.1696429 0.1696429 0.4917549), wk = 0.0025126 k( 300) = ( 0.1607143 0.1607143 0.4917549), wk = 0.0025126 k( 301) = ( 0.1517857 0.1517857 0.4917549), wk = 0.0025126 k( 302) = ( 0.1428571 0.1428571 0.4917549), wk = 0.0025126 k( 303) = ( 0.1339286 0.1339286 0.4917549), wk = 0.0025126 k( 304) = ( 0.1250000 0.1250000 0.4917549), wk = 0.0025126 k( 305) = ( 0.1160714 0.1160714 0.4917549), wk = 0.0025126 k( 306) = ( 0.1071429 0.1071429 0.4917549), wk = 0.0025126 k( 307) = ( 0.0982143 0.0982143 0.4917549), wk = 0.0025126 k( 308) = ( 0.0892857 0.0892857 0.4917549), wk = 0.0025126 k( 309) = ( 0.0803571 0.0803571 0.4917549), wk = 0.0025126 k( 310) = ( 0.0714286 0.0714286 0.4917549), wk = 0.0025126 k( 311) = ( 0.0625000 0.0625000 0.4917549), wk = 0.0025126 k( 312) = ( 0.0535714 0.0535714 0.4917549), wk = 0.0025126 k( 313) = ( 0.0446429 0.0446429 0.4917549), wk = 0.0025126 k( 314) = ( 0.0357143 0.0357143 0.4917549), wk = 0.0025126 k( 315) = ( 0.0267857 0.0267857 0.4917549), wk = 0.0025126 k( 316) = ( 0.0178571 0.0178571 0.4917549), wk = 0.0025126 k( 317) = ( 0.0089286 0.0089286 0.4917549), wk = 0.0025126 k( 318) = ( 0.0000000 0.0000000 0.4917549), wk = 0.0025126 k( 319) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 320) = ( 0.0000000 0.5000000 0.0126091), wk = 0.0025126 k( 321) = ( 0.0000000 0.5000000 0.0252182), wk = 0.0025126 k( 322) = ( 0.0000000 0.5000000 0.0378273), wk = 0.0025126 k( 323) = ( 0.0000000 0.5000000 0.0504364), wk = 0.0025126 k( 324) = ( 0.0000000 0.5000000 0.0630455), wk = 0.0025126 k( 325) = ( 0.0000000 0.5000000 0.0756546), wk = 0.0025126 k( 326) = ( 0.0000000 0.5000000 0.0882637), wk = 0.0025126 k( 327) = ( 0.0000000 0.5000000 0.1008728), wk = 0.0025126 k( 328) = ( 0.0000000 0.5000000 0.1134819), wk = 0.0025126 k( 329) = ( 0.0000000 0.5000000 0.1260910), wk = 0.0025126 k( 330) = ( 0.0000000 0.5000000 0.1387001), wk = 0.0025126 k( 331) = ( 0.0000000 0.5000000 0.1513092), wk = 0.0025126 k( 332) = ( 0.0000000 0.5000000 0.1639183), wk = 0.0025126 k( 333) = ( 0.0000000 0.5000000 0.1765274), wk = 0.0025126 k( 334) = ( 0.0000000 0.5000000 0.1891365), wk = 0.0025126 k( 335) = ( 0.0000000 0.5000000 0.2017456), wk = 0.0025126 k( 336) = ( 0.0000000 0.5000000 0.2143547), wk = 0.0025126 k( 337) = ( 0.0000000 0.5000000 0.2269638), wk = 0.0025126 k( 338) = ( 0.0000000 0.5000000 0.2395729), wk = 0.0025126 k( 339) = ( 0.0000000 0.5000000 0.2521820), wk = 0.0025126 k( 340) = ( 0.0000000 0.5000000 0.2647911), wk = 0.0025126 k( 341) = ( 0.0000000 0.5000000 0.2774002), wk = 0.0025126 k( 342) = ( 0.0000000 0.5000000 0.2900093), wk = 0.0025126 k( 343) = ( 0.0000000 0.5000000 0.3026184), wk = 0.0025126 k( 344) = ( 0.0000000 0.5000000 0.3152275), wk = 0.0025126 k( 345) = ( 0.0000000 0.5000000 0.3278366), wk = 0.0025126 k( 346) = ( 0.0000000 0.5000000 0.3404457), wk = 0.0025126 k( 347) = ( 0.0000000 0.5000000 0.3530548), wk = 0.0025126 k( 348) = ( 0.0000000 0.5000000 0.3656639), wk = 0.0025126 k( 349) = ( 0.0000000 0.5000000 0.3782730), wk = 0.0025126 k( 350) = ( 0.0000000 0.5000000 0.3908821), wk = 0.0025126 k( 351) = ( 0.0000000 0.5000000 0.4034912), wk = 0.0025126 k( 352) = ( 0.0000000 0.5000000 0.4161003), wk = 0.0025126 k( 353) = ( 0.0000000 0.5000000 0.4287094), wk = 0.0025126 k( 354) = ( 0.0000000 0.5000000 0.4413185), wk = 0.0025126 k( 355) = ( 0.0000000 0.5000000 0.4539276), wk = 0.0025126 k( 356) = ( 0.0000000 0.5000000 0.4665367), wk = 0.0025126 k( 357) = ( 0.0000000 0.5000000 0.4791458), wk = 0.0025126 k( 358) = ( 0.0000000 0.5000000 0.4917549), wk = 0.0025126 k( 359) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 360) = ( 0.5000000 0.5000000 0.0126091), wk = 0.0025126 k( 361) = ( 0.5000000 0.5000000 0.0252182), wk = 0.0025126 k( 362) = ( 0.5000000 0.5000000 0.0378273), wk = 0.0025126 k( 363) = ( 0.5000000 0.5000000 0.0504364), wk = 0.0025126 k( 364) = ( 0.5000000 0.5000000 0.0630455), wk = 0.0025126 k( 365) = ( 0.5000000 0.5000000 0.0756546), wk = 0.0025126 k( 366) = ( 0.5000000 0.5000000 0.0882637), wk = 0.0025126 k( 367) = ( 0.5000000 0.5000000 0.1008728), wk = 0.0025126 k( 368) = ( 0.5000000 0.5000000 0.1134819), wk = 0.0025126 k( 369) = ( 0.5000000 0.5000000 0.1260910), wk = 0.0025126 k( 370) = ( 0.5000000 0.5000000 0.1387001), wk = 0.0025126 k( 371) = ( 0.5000000 0.5000000 0.1513092), wk = 0.0025126 k( 372) = ( 0.5000000 0.5000000 0.1639183), wk = 0.0025126 k( 373) = ( 0.5000000 0.5000000 0.1765274), wk = 0.0025126 k( 374) = ( 0.5000000 0.5000000 0.1891365), wk = 0.0025126 k( 375) = ( 0.5000000 0.5000000 0.2017456), wk = 0.0025126 k( 376) = ( 0.5000000 0.5000000 0.2143547), wk = 0.0025126 k( 377) = ( 0.5000000 0.5000000 0.2269638), wk = 0.0025126 k( 378) = ( 0.5000000 0.5000000 0.2395729), wk = 0.0025126 k( 379) = ( 0.5000000 0.5000000 0.2521820), wk = 0.0025126 k( 380) = ( 0.5000000 0.5000000 0.2647911), wk = 0.0025126 k( 381) = ( 0.5000000 0.5000000 0.2774002), wk = 0.0025126 k( 382) = ( 0.5000000 0.5000000 0.2900093), wk = 0.0025126 k( 383) = ( 0.5000000 0.5000000 0.3026184), wk = 0.0025126 k( 384) = ( 0.5000000 0.5000000 0.3152275), wk = 0.0025126 k( 385) = ( 0.5000000 0.5000000 0.3278366), wk = 0.0025126 k( 386) = ( 0.5000000 0.5000000 0.3404457), wk = 0.0025126 k( 387) = ( 0.5000000 0.5000000 0.3530548), wk = 0.0025126 k( 388) = ( 0.5000000 0.5000000 0.3656639), wk = 0.0025126 k( 389) = ( 0.5000000 0.5000000 0.3782730), wk = 0.0025126 k( 390) = ( 0.5000000 0.5000000 0.3908821), wk = 0.0025126 k( 391) = ( 0.5000000 0.5000000 0.4034912), wk = 0.0025126 k( 392) = ( 0.5000000 0.5000000 0.4161003), wk = 0.0025126 k( 393) = ( 0.5000000 0.5000000 0.4287094), wk = 0.0025126 k( 394) = ( 0.5000000 0.5000000 0.4413185), wk = 0.0025126 k( 395) = ( 0.5000000 0.5000000 0.4539276), wk = 0.0025126 k( 396) = ( 0.5000000 0.5000000 0.4665367), wk = 0.0025126 k( 397) = ( 0.5000000 0.5000000 0.4791458), wk = 0.0025126 k( 398) = ( 0.5000000 0.5000000 0.4917549), wk = 0.0025126 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 2) = ( 0.0000000 0.0125000 -0.0000000), wk = 0.0025126 k( 3) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0025126 k( 4) = ( 0.0000000 0.0375000 -0.0000000), wk = 0.0025126 k( 5) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0025126 k( 6) = ( 0.0000000 0.0625000 -0.0000000), wk = 0.0025126 k( 7) = ( 0.0000000 0.0750000 -0.0000000), wk = 0.0025126 k( 8) = ( 0.0000000 0.0875000 -0.0000000), wk = 0.0025126 k( 9) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0025126 k( 10) = ( 0.0000000 0.1125000 -0.0000000), wk = 0.0025126 k( 11) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0025126 k( 12) = ( 0.0000000 0.1375000 -0.0000000), wk = 0.0025126 k( 13) = ( 0.0000000 0.1500000 -0.0000000), wk = 0.0025126 k( 14) = ( 0.0000000 0.1625000 -0.0000000), wk = 0.0025126 k( 15) = ( 0.0000000 0.1750000 -0.0000000), wk = 0.0025126 k( 16) = ( 0.0000000 0.1875000 -0.0000000), wk = 0.0025126 k( 17) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0025126 k( 18) = ( 0.0000000 0.2125000 -0.0000000), wk = 0.0025126 k( 19) = ( 0.0000000 0.2250000 -0.0000000), wk = 0.0025126 k( 20) = ( 0.0000000 0.2375000 -0.0000000), wk = 0.0025126 k( 21) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0025126 k( 22) = ( 0.0000000 0.2625000 -0.0000000), wk = 0.0025126 k( 23) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0025126 k( 24) = ( 0.0000000 0.2875000 -0.0000000), wk = 0.0025126 k( 25) = ( 0.0000000 0.3000000 -0.0000000), wk = 0.0025126 k( 26) = ( 0.0000000 0.3125000 -0.0000000), wk = 0.0025126 k( 27) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0025126 k( 28) = ( 0.0000000 0.3375000 0.0000000), wk = 0.0025126 k( 29) = ( 0.0000000 0.3500000 -0.0000000), wk = 0.0025126 k( 30) = ( 0.0000000 0.3625000 -0.0000000), wk = 0.0025126 k( 31) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0025126 k( 32) = ( 0.0000000 0.3875000 -0.0000000), wk = 0.0025126 k( 33) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0025126 k( 34) = ( 0.0000000 0.4125000 -0.0000000), wk = 0.0025126 k( 35) = ( 0.0000000 0.4250000 -0.0000000), wk = 0.0025126 k( 36) = ( 0.0000000 0.4375000 0.0000000), wk = 0.0025126 k( 37) = ( 0.0000000 0.4500000 -0.0000000), wk = 0.0025126 k( 38) = ( 0.0000000 0.4625000 0.0000000), wk = 0.0025126 k( 39) = ( 0.0000000 0.4750000 -0.0000000), wk = 0.0025126 k( 40) = ( 0.0000000 0.4875000 0.0000000), wk = 0.0025126 k( 41) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 42) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 43) = ( 0.0125000 0.5000000 -0.0000000), wk = 0.0025126 k( 44) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0025126 k( 45) = ( 0.0375000 0.5000000 -0.0000000), wk = 0.0025126 k( 46) = ( 0.0500000 0.5000000 -0.0000000), wk = 0.0025126 k( 47) = ( 0.0625000 0.5000000 -0.0000000), wk = 0.0025126 k( 48) = ( 0.0750000 0.5000000 -0.0000000), wk = 0.0025126 k( 49) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0025126 k( 50) = ( 0.1000000 0.5000000 -0.0000000), wk = 0.0025126 k( 51) = ( 0.1125000 0.5000000 -0.0000000), wk = 0.0025126 k( 52) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0025126 k( 53) = ( 0.1375000 0.5000000 0.0000000), wk = 0.0025126 k( 54) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0025126 k( 55) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0025126 k( 56) = ( 0.1750000 0.5000000 0.0000000), wk = 0.0025126 k( 57) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0025126 k( 58) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0025126 k( 59) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0025126 k( 60) = ( 0.2250000 0.5000000 -0.0000000), wk = 0.0025126 k( 61) = ( 0.2375000 0.5000000 -0.0000000), wk = 0.0025126 k( 62) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0025126 k( 63) = ( 0.2625000 0.5000000 0.0000000), wk = 0.0025126 k( 64) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0025126 k( 65) = ( 0.2875000 0.5000000 -0.0000000), wk = 0.0025126 k( 66) = ( 0.3000000 0.5000000 0.0000000), wk = 0.0025126 k( 67) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0025126 k( 68) = ( 0.3250000 0.5000000 -0.0000000), wk = 0.0025126 k( 69) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0025126 k( 70) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0025126 k( 71) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0025126 k( 72) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0025126 k( 73) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0025126 k( 74) = ( 0.4000000 0.5000000 -0.0000000), wk = 0.0025126 k( 75) = ( 0.4125000 0.5000000 -0.0000000), wk = 0.0025126 k( 76) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0025126 k( 77) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0025126 k( 78) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0025126 k( 79) = ( 0.4625000 0.5000000 -0.0000000), wk = 0.0025126 k( 80) = ( 0.4750000 0.5000000 0.0000000), wk = 0.0025126 k( 81) = ( 0.4875000 0.5000000 -0.0000000), wk = 0.0025126 k( 82) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 83) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 84) = ( 0.4910714 0.4910714 -0.0000000), wk = 0.0025126 k( 85) = ( 0.4821429 0.4821429 -0.0000000), wk = 0.0025126 k( 86) = ( 0.4732143 0.4732143 -0.0000000), wk = 0.0025126 k( 87) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0025126 k( 88) = ( 0.4553571 0.4553571 -0.0000000), wk = 0.0025126 k( 89) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0025126 k( 90) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0025126 k( 91) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0025126 k( 92) = ( 0.4196429 0.4196429 -0.0000000), wk = 0.0025126 k( 93) = ( 0.4107143 0.4107143 0.0000000), wk = 0.0025126 k( 94) = ( 0.4017857 0.4017857 -0.0000000), wk = 0.0025126 k( 95) = ( 0.3928571 0.3928571 -0.0000000), wk = 0.0025126 k( 96) = ( 0.3839286 0.3839286 0.0000000), wk = 0.0025126 k( 97) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0025126 k( 98) = ( 0.3660714 0.3660714 -0.0000000), wk = 0.0025126 k( 99) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0025126 k( 100) = ( 0.3482143 0.3482143 -0.0000000), wk = 0.0025126 k( 101) = ( 0.3392857 0.3392857 -0.0000000), wk = 0.0025126 k( 102) = ( 0.3303571 0.3303571 0.0000000), wk = 0.0025126 k( 103) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0025126 k( 104) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0025126 k( 105) = ( 0.3035714 0.3035714 0.0000000), wk = 0.0025126 k( 106) = ( 0.2946429 0.2946429 -0.0000000), wk = 0.0025126 k( 107) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0025126 k( 108) = ( 0.2767857 0.2767857 -0.0000000), wk = 0.0025126 k( 109) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0025126 k( 110) = ( 0.2589286 0.2589286 -0.0000000), wk = 0.0025126 k( 111) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0025126 k( 112) = ( 0.2410714 0.2410714 -0.0000000), wk = 0.0025126 k( 113) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0025126 k( 114) = ( 0.2232143 0.2232143 -0.0000000), wk = 0.0025126 k( 115) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0025126 k( 116) = ( 0.2053571 0.2053571 -0.0000000), wk = 0.0025126 k( 117) = ( 0.1964286 0.1964286 -0.0000000), wk = 0.0025126 k( 118) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0025126 k( 119) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0025126 k( 120) = ( 0.1696429 0.1696429 0.0000000), wk = 0.0025126 k( 121) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0025126 k( 122) = ( 0.1517857 0.1517857 -0.0000000), wk = 0.0025126 k( 123) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0025126 k( 124) = ( 0.1339286 0.1339286 -0.0000000), wk = 0.0025126 k( 125) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0025126 k( 126) = ( 0.1160714 0.1160714 0.0000000), wk = 0.0025126 k( 127) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0025126 k( 128) = ( 0.0982143 0.0982143 -0.0000000), wk = 0.0025126 k( 129) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0025126 k( 130) = ( 0.0803571 0.0803571 -0.0000000), wk = 0.0025126 k( 131) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0025126 k( 132) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0025126 k( 133) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0025126 k( 134) = ( 0.0446429 0.0446429 -0.0000000), wk = 0.0025126 k( 135) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0025126 k( 136) = ( 0.0267857 0.0267857 -0.0000000), wk = 0.0025126 k( 137) = ( 0.0178571 0.0178571 -0.0000000), wk = 0.0025126 k( 138) = ( 0.0089286 0.0089286 -0.0000000), wk = 0.0025126 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025126 k( 141) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0025126 k( 142) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0025126 k( 143) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0025126 k( 144) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0025126 k( 145) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0025126 k( 146) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0025126 k( 147) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0025126 k( 148) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0025126 k( 149) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0025126 k( 150) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0025126 k( 151) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0025126 k( 152) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0025126 k( 153) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0025126 k( 154) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0025126 k( 155) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0025126 k( 156) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0025126 k( 157) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0025126 k( 158) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0025126 k( 159) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0025126 k( 160) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0025126 k( 161) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0025126 k( 162) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0025126 k( 163) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0025126 k( 164) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0025126 k( 165) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0025126 k( 166) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0025126 k( 167) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0025126 k( 168) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0025126 k( 169) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0025126 k( 170) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0025126 k( 171) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0025126 k( 172) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0025126 k( 173) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0025126 k( 174) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0025126 k( 175) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0025126 k( 176) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0025126 k( 177) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0025126 k( 178) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0025126 k( 179) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025126 k( 180) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025126 k( 181) = ( 0.0000000 0.0125000 0.5000000), wk = 0.0025126 k( 182) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0025126 k( 183) = ( 0.0000000 0.0375000 0.5000000), wk = 0.0025126 k( 184) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0025126 k( 185) = ( 0.0000000 0.0625000 0.5000000), wk = 0.0025126 k( 186) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0025126 k( 187) = ( 0.0000000 0.0875000 0.5000000), wk = 0.0025126 k( 188) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0025126 k( 189) = ( 0.0000000 0.1125000 0.5000000), wk = 0.0025126 k( 190) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0025126 k( 191) = ( 0.0000000 0.1375000 0.5000000), wk = 0.0025126 k( 192) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0025126 k( 193) = ( 0.0000000 0.1625000 0.5000000), wk = 0.0025126 k( 194) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0025126 k( 195) = ( 0.0000000 0.1875000 0.5000000), wk = 0.0025126 k( 196) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0025126 k( 197) = ( 0.0000000 0.2125000 0.5000000), wk = 0.0025126 k( 198) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0025126 k( 199) = ( 0.0000000 0.2375000 0.5000000), wk = 0.0025126 k( 200) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0025126 k( 201) = ( 0.0000000 0.2625000 0.5000000), wk = 0.0025126 k( 202) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0025126 k( 203) = ( 0.0000000 0.2875000 0.5000000), wk = 0.0025126 k( 204) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0025126 k( 205) = ( 0.0000000 0.3125000 0.5000000), wk = 0.0025126 k( 206) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0025126 k( 207) = ( 0.0000000 0.3375000 0.5000000), wk = 0.0025126 k( 208) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0025126 k( 209) = ( 0.0000000 0.3625000 0.5000000), wk = 0.0025126 k( 210) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0025126 k( 211) = ( 0.0000000 0.3875000 0.5000000), wk = 0.0025126 k( 212) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0025126 k( 213) = ( 0.0000000 0.4125000 0.5000000), wk = 0.0025126 k( 214) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0025126 k( 215) = ( 0.0000000 0.4375000 0.5000000), wk = 0.0025126 k( 216) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0025126 k( 217) = ( 0.0000000 0.4625000 0.5000000), wk = 0.0025126 k( 218) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0025126 k( 219) = ( 0.0000000 0.4875000 0.5000000), wk = 0.0025126 k( 220) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025126 k( 221) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025126 k( 222) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0025126 k( 223) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0025126 k( 224) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0025126 k( 225) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0025126 k( 226) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0025126 k( 227) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0025126 k( 228) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0025126 k( 229) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0025126 k( 230) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0025126 k( 231) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0025126 k( 232) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0025126 k( 233) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0025126 k( 234) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0025126 k( 235) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0025126 k( 236) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0025126 k( 237) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0025126 k( 238) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0025126 k( 239) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0025126 k( 240) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0025126 k( 241) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0025126 k( 242) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0025126 k( 243) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0025126 k( 244) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0025126 k( 245) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0025126 k( 246) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0025126 k( 247) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0025126 k( 248) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0025126 k( 249) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0025126 k( 250) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0025126 k( 251) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0025126 k( 252) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0025126 k( 253) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0025126 k( 254) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0025126 k( 255) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0025126 k( 256) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0025126 k( 257) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0025126 k( 258) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0025126 k( 259) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0025126 k( 260) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0025126 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025126 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025126 k( 263) = ( 0.4910714 0.4910714 0.5000000), wk = 0.0025126 k( 264) = ( 0.4821429 0.4821429 0.5000000), wk = 0.0025126 k( 265) = ( 0.4732143 0.4732143 0.5000000), wk = 0.0025126 k( 266) = ( 0.4642857 0.4642857 0.5000000), wk = 0.0025126 k( 267) = ( 0.4553571 0.4553571 0.5000000), wk = 0.0025126 k( 268) = ( 0.4464286 0.4464286 0.5000000), wk = 0.0025126 k( 269) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0025126 k( 270) = ( 0.4285714 0.4285714 0.5000000), wk = 0.0025126 k( 271) = ( 0.4196429 0.4196429 0.5000000), wk = 0.0025126 k( 272) = ( 0.4107143 0.4107143 0.5000000), wk = 0.0025126 k( 273) = ( 0.4017857 0.4017857 0.5000000), wk = 0.0025126 k( 274) = ( 0.3928571 0.3928571 0.5000000), wk = 0.0025126 k( 275) = ( 0.3839286 0.3839286 0.5000000), wk = 0.0025126 k( 276) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0025126 k( 277) = ( 0.3660714 0.3660714 0.5000000), wk = 0.0025126 k( 278) = ( 0.3571429 0.3571429 0.5000000), wk = 0.0025126 k( 279) = ( 0.3482143 0.3482143 0.5000000), wk = 0.0025126 k( 280) = ( 0.3392857 0.3392857 0.5000000), wk = 0.0025126 k( 281) = ( 0.3303571 0.3303571 0.5000000), wk = 0.0025126 k( 282) = ( 0.3214286 0.3214286 0.5000000), wk = 0.0025126 k( 283) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0025126 k( 284) = ( 0.3035714 0.3035714 0.5000000), wk = 0.0025126 k( 285) = ( 0.2946429 0.2946429 0.5000000), wk = 0.0025126 k( 286) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0025126 k( 287) = ( 0.2767857 0.2767857 0.5000000), wk = 0.0025126 k( 288) = ( 0.2678571 0.2678571 0.5000000), wk = 0.0025126 k( 289) = ( 0.2589286 0.2589286 0.5000000), wk = 0.0025126 k( 290) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0025126 k( 291) = ( 0.2410714 0.2410714 0.5000000), wk = 0.0025126 k( 292) = ( 0.2321429 0.2321429 0.5000000), wk = 0.0025126 k( 293) = ( 0.2232143 0.2232143 0.5000000), wk = 0.0025126 k( 294) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0025126 k( 295) = ( 0.2053571 0.2053571 0.5000000), wk = 0.0025126 k( 296) = ( 0.1964286 0.1964286 0.5000000), wk = 0.0025126 k( 297) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0025126 k( 298) = ( 0.1785714 0.1785714 0.5000000), wk = 0.0025126 k( 299) = ( 0.1696429 0.1696429 0.5000000), wk = 0.0025126 k( 300) = ( 0.1607143 0.1607143 0.5000000), wk = 0.0025126 k( 301) = ( 0.1517857 0.1517857 0.5000000), wk = 0.0025126 k( 302) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0025126 k( 303) = ( 0.1339286 0.1339286 0.5000000), wk = 0.0025126 k( 304) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0025126 k( 305) = ( 0.1160714 0.1160714 0.5000000), wk = 0.0025126 k( 306) = ( 0.1071429 0.1071429 0.5000000), wk = 0.0025126 k( 307) = ( 0.0982143 0.0982143 0.5000000), wk = 0.0025126 k( 308) = ( 0.0892857 0.0892857 0.5000000), wk = 0.0025126 k( 309) = ( 0.0803571 0.0803571 0.5000000), wk = 0.0025126 k( 310) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0025126 k( 311) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0025126 k( 312) = ( 0.0535714 0.0535714 0.5000000), wk = 0.0025126 k( 313) = ( 0.0446429 0.0446429 0.5000000), wk = 0.0025126 k( 314) = ( 0.0357143 0.0357143 0.5000000), wk = 0.0025126 k( 315) = ( 0.0267857 0.0267857 0.5000000), wk = 0.0025126 k( 316) = ( 0.0178571 0.0178571 0.5000000), wk = 0.0025126 k( 317) = ( 0.0089286 0.0089286 0.5000000), wk = 0.0025126 k( 318) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025126 k( 319) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0025126 k( 320) = ( 0.0000000 0.5000000 0.0128205), wk = 0.0025126 k( 321) = ( 0.0000000 0.5000000 0.0256410), wk = 0.0025126 k( 322) = ( 0.0000000 0.5000000 0.0384615), wk = 0.0025126 k( 323) = ( 0.0000000 0.5000000 0.0512821), wk = 0.0025126 k( 324) = ( 0.0000000 0.5000000 0.0641026), wk = 0.0025126 k( 325) = ( 0.0000000 0.5000000 0.0769231), wk = 0.0025126 k( 326) = ( 0.0000000 0.5000000 0.0897436), wk = 0.0025126 k( 327) = ( 0.0000000 0.5000000 0.1025641), wk = 0.0025126 k( 328) = ( 0.0000000 0.5000000 0.1153846), wk = 0.0025126 k( 329) = ( 0.0000000 0.5000000 0.1282051), wk = 0.0025126 k( 330) = ( 0.0000000 0.5000000 0.1410256), wk = 0.0025126 k( 331) = ( 0.0000000 0.5000000 0.1538461), wk = 0.0025126 k( 332) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0025126 k( 333) = ( 0.0000000 0.5000000 0.1794872), wk = 0.0025126 k( 334) = ( 0.0000000 0.5000000 0.1923077), wk = 0.0025126 k( 335) = ( 0.0000000 0.5000000 0.2051282), wk = 0.0025126 k( 336) = ( 0.0000000 0.5000000 0.2179487), wk = 0.0025126 k( 337) = ( 0.0000000 0.5000000 0.2307692), wk = 0.0025126 k( 338) = ( 0.0000000 0.5000000 0.2435897), wk = 0.0025126 k( 339) = ( 0.0000000 0.5000000 0.2564103), wk = 0.0025126 k( 340) = ( 0.0000000 0.5000000 0.2692308), wk = 0.0025126 k( 341) = ( 0.0000000 0.5000000 0.2820513), wk = 0.0025126 k( 342) = ( 0.0000000 0.5000000 0.2948718), wk = 0.0025126 k( 343) = ( 0.0000000 0.5000000 0.3076923), wk = 0.0025126 k( 344) = ( 0.0000000 0.5000000 0.3205128), wk = 0.0025126 k( 345) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0025126 k( 346) = ( 0.0000000 0.5000000 0.3461538), wk = 0.0025126 k( 347) = ( 0.0000000 0.5000000 0.3589744), wk = 0.0025126 k( 348) = ( 0.0000000 0.5000000 0.3717949), wk = 0.0025126 k( 349) = ( 0.0000000 0.5000000 0.3846154), wk = 0.0025126 k( 350) = ( 0.0000000 0.5000000 0.3974359), wk = 0.0025126 k( 351) = ( 0.0000000 0.5000000 0.4102564), wk = 0.0025126 k( 352) = ( 0.0000000 0.5000000 0.4230769), wk = 0.0025126 k( 353) = ( 0.0000000 0.5000000 0.4358974), wk = 0.0025126 k( 354) = ( 0.0000000 0.5000000 0.4487179), wk = 0.0025126 k( 355) = ( 0.0000000 0.5000000 0.4615385), wk = 0.0025126 k( 356) = ( 0.0000000 0.5000000 0.4743590), wk = 0.0025126 k( 357) = ( 0.0000000 0.5000000 0.4871795), wk = 0.0025126 k( 358) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025126 k( 359) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0025126 k( 360) = ( 0.5000000 0.5000000 0.0128205), wk = 0.0025126 k( 361) = ( 0.5000000 0.5000000 0.0256410), wk = 0.0025126 k( 362) = ( 0.5000000 0.5000000 0.0384615), wk = 0.0025126 k( 363) = ( 0.5000000 0.5000000 0.0512821), wk = 0.0025126 k( 364) = ( 0.5000000 0.5000000 0.0641026), wk = 0.0025126 k( 365) = ( 0.5000000 0.5000000 0.0769231), wk = 0.0025126 k( 366) = ( 0.5000000 0.5000000 0.0897436), wk = 0.0025126 k( 367) = ( 0.5000000 0.5000000 0.1025641), wk = 0.0025126 k( 368) = ( 0.5000000 0.5000000 0.1153846), wk = 0.0025126 k( 369) = ( 0.5000000 0.5000000 0.1282051), wk = 0.0025126 k( 370) = ( 0.5000000 0.5000000 0.1410256), wk = 0.0025126 k( 371) = ( 0.5000000 0.5000000 0.1538461), wk = 0.0025126 k( 372) = ( 0.5000000 0.5000000 0.1666667), wk = 0.0025126 k( 373) = ( 0.5000000 0.5000000 0.1794872), wk = 0.0025126 k( 374) = ( 0.5000000 0.5000000 0.1923077), wk = 0.0025126 k( 375) = ( 0.5000000 0.5000000 0.2051282), wk = 0.0025126 k( 376) = ( 0.5000000 0.5000000 0.2179487), wk = 0.0025126 k( 377) = ( 0.5000000 0.5000000 0.2307692), wk = 0.0025126 k( 378) = ( 0.5000000 0.5000000 0.2435897), wk = 0.0025126 k( 379) = ( 0.5000000 0.5000000 0.2564103), wk = 0.0025126 k( 380) = ( 0.5000000 0.5000000 0.2692308), wk = 0.0025126 k( 381) = ( 0.5000000 0.5000000 0.2820513), wk = 0.0025126 k( 382) = ( 0.5000000 0.5000000 0.2948718), wk = 0.0025126 k( 383) = ( 0.5000000 0.5000000 0.3076923), wk = 0.0025126 k( 384) = ( 0.5000000 0.5000000 0.3205128), wk = 0.0025126 k( 385) = ( 0.5000000 0.5000000 0.3333333), wk = 0.0025126 k( 386) = ( 0.5000000 0.5000000 0.3461538), wk = 0.0025126 k( 387) = ( 0.5000000 0.5000000 0.3589744), wk = 0.0025126 k( 388) = ( 0.5000000 0.5000000 0.3717949), wk = 0.0025126 k( 389) = ( 0.5000000 0.5000000 0.3846154), wk = 0.0025126 k( 390) = ( 0.5000000 0.5000000 0.3974359), wk = 0.0025126 k( 391) = ( 0.5000000 0.5000000 0.4102564), wk = 0.0025126 k( 392) = ( 0.5000000 0.5000000 0.4230769), wk = 0.0025126 k( 393) = ( 0.5000000 0.5000000 0.4358974), wk = 0.0025126 k( 394) = ( 0.5000000 0.5000000 0.4487179), wk = 0.0025126 k( 395) = ( 0.5000000 0.5000000 0.4615385), wk = 0.0025126 k( 396) = ( 0.5000000 0.5000000 0.4743590), wk = 0.0025126 k( 397) = ( 0.5000000 0.5000000 0.4871795), wk = 0.0025126 k( 398) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025126 Dense grid: 43179 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 19685 G-vectors FFT dimensions: ( 36, 36, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 104, 48) NL pseudopotentials 0.09 Mb ( 52, 110) Each V/rho on FFT grid 0.03 Mb ( 2025) Each G-vector array 0.01 Mb ( 898) G-vector shells 0.00 Mb ( 450) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.30 Mb ( 104, 192) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.16 Mb ( 110, 2, 48) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./KNbO3.save/charge-density.dat Starting wfc are 66 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 16.8 secs Computing kpt #: 2 total cpu time spent up to now is 18.3 secs Computing kpt #: 3 total cpu time spent up to now is 19.3 secs Computing kpt #: 4 total cpu time spent up to now is 20.7 secs Computing kpt #: 5 total cpu time spent up to now is 22.1 secs Computing kpt #: 6 total cpu time spent up to now is 23.5 secs Computing kpt #: 7 total cpu time spent up to now is 24.6 secs Computing kpt #: 8 total cpu time spent up to now is 25.5 secs Computing kpt #: 9 total cpu time spent up to now is 26.5 secs Computing kpt #: 10 total cpu time spent up to now is 27.4 secs Computing kpt #: 11 total cpu time spent up to now is 28.3 secs Computing kpt #: 12 total cpu time spent up to now is 29.2 secs Computing kpt #: 13 total cpu time spent up to now is 30.0 secs Computing kpt #: 14 total cpu time spent up to now is 30.8 secs Computing kpt 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Computing kpt #: 62 total cpu time spent up to now is 66.3 secs Computing kpt #: 63 total cpu time spent up to now is 66.9 secs Computing kpt #: 64 total cpu time spent up to now is 67.5 secs Computing kpt #: 65 total cpu time spent up to now is 68.0 secs Computing kpt #: 66 total cpu time spent up to now is 68.6 secs Computing kpt #: 67 total cpu time spent up to now is 69.1 secs Computing kpt #: 68 total cpu time spent up to now is 69.7 secs Computing kpt #: 69 total cpu time spent up to now is 70.3 secs Computing kpt #: 70 total cpu time spent up to now is 70.8 secs Computing kpt #: 71 total cpu time spent up to now is 71.3 secs Computing kpt #: 72 total cpu time spent up to now is 71.9 secs Computing kpt #: 73 total cpu time spent up to now is 72.4 secs Computing kpt #: 74 total cpu time spent up to now is 73.0 secs Computing kpt #: 75 total cpu time spent up to now is 73.5 secs Computing kpt #: 76 total cpu time spent up to now is 74.1 secs Computing kpt #: 77 total cpu time spent up to now is 74.6 secs Computing kpt #: 78 total cpu time spent up to now is 75.2 secs Computing kpt #: 79 total cpu time spent up to now is 75.7 secs Computing kpt #: 80 total cpu time spent up to now is 76.2 secs Computing kpt #: 81 total cpu time spent up to now is 76.8 secs Computing kpt #: 82 total cpu time spent up to now is 77.3 secs Computing kpt #: 83 total cpu time spent up to now is 77.9 secs Computing kpt #: 84 total cpu time spent up to now is 78.4 secs Computing kpt #: 85 total cpu time spent up to now is 79.0 secs Computing kpt #: 86 total cpu time spent up to now is 79.5 secs Computing kpt #: 87 total cpu time spent up to now is 80.0 secs Computing kpt #: 88 total cpu time spent up to now is 80.6 secs Computing kpt #: 89 total cpu time spent up to now is 81.1 secs Computing kpt #: 90 total cpu time spent up to now is 81.7 secs Computing kpt #: 91 total cpu time spent up to now is 82.2 secs Computing kpt #: 92 total cpu time spent up to now is 82.8 secs Computing kpt #: 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secs Computing kpt #: 124 total cpu time spent up to now is 108.9 secs Computing kpt #: 125 total cpu time spent up to now is 109.7 secs Computing kpt #: 126 total cpu time spent up to now is 110.6 secs Computing kpt #: 127 total cpu time spent up to now is 111.5 secs Computing kpt #: 128 total cpu time spent up to now is 112.4 secs Computing kpt #: 129 total cpu time spent up to now is 113.3 secs Computing kpt #: 130 total cpu time spent up to now is 114.3 secs Computing kpt #: 131 total cpu time spent up to now is 115.3 secs Computing kpt #: 132 total cpu time spent up to now is 116.4 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 118.1 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 119.8 secs Computing kpt #: 135 total cpu time spent up to now is 121.1 secs Computing kpt #: 136 total cpu time spent up to now is 122.5 secs Computing kpt #: 137 total cpu time spent up to now is 123.6 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Computing kpt #: 153 total cpu time spent up to now is 137.9 secs Computing kpt #: 154 total cpu time spent up to now is 138.7 secs Computing kpt #: 155 total cpu time spent up to now is 139.5 secs Computing kpt #: 156 total cpu time spent up to now is 140.3 secs Computing kpt #: 157 total cpu time spent up to now is 141.1 secs Computing kpt #: 158 total cpu time spent up to now is 141.9 secs Computing kpt #: 159 total cpu time spent up to now is 142.6 secs Computing kpt #: 160 total cpu time spent up to now is 143.4 secs Computing kpt #: 161 total cpu time spent up to now is 144.1 secs Computing kpt #: 162 total cpu time spent up to now is 144.8 secs Computing kpt #: 163 total cpu time spent up to now is 145.4 secs Computing kpt #: 164 total cpu time spent up to now is 146.0 secs Computing kpt #: 165 total cpu time spent up to now is 146.6 secs Computing kpt #: 166 total cpu time spent up to now is 147.3 secs Computing kpt #: 167 total cpu time spent up to now is 148.0 secs Computing kpt #: 168 total cpu time spent up to now is 148.5 secs Computing kpt #: 169 total cpu time spent up to now is 149.2 secs Computing kpt #: 170 total cpu time spent up to now is 149.8 secs Computing kpt #: 171 total cpu time spent up to now is 150.4 secs Computing kpt #: 172 total cpu time spent up to now is 151.0 secs Computing kpt #: 173 total cpu time spent up to now is 151.6 secs Computing kpt #: 174 total cpu time spent up to now is 152.1 secs Computing kpt #: 175 total cpu time spent up to now is 152.7 secs Computing kpt #: 176 total cpu time spent up to now is 153.2 secs Computing kpt #: 177 total cpu time spent up to now is 153.8 secs Computing kpt #: 178 total cpu time spent up to now is 154.4 secs Computing kpt #: 179 total cpu time spent up to now is 155.0 secs Computing kpt #: 180 total cpu time spent up to now is 155.6 secs Computing kpt #: 181 total cpu time spent up to now is 156.2 secs Computing kpt #: 182 total cpu time spent up to now is 156.7 secs Computing kpt #: 183 total cpu time spent up to now is 157.3 secs Computing kpt #: 184 total cpu time spent up to now is 158.0 secs Computing kpt #: 185 total cpu time spent up to now is 158.5 secs Computing kpt #: 186 total cpu time spent up to now is 159.1 secs Computing kpt #: 187 total cpu time spent up to now is 159.7 secs Computing kpt #: 188 total cpu time spent up to now is 160.2 secs Computing kpt #: 189 total cpu time spent up to now is 163.8 secs Computing kpt #: 190 total cpu time spent up to now is 164.4 secs Computing kpt #: 191 total cpu time spent up to now is 165.0 secs Computing kpt #: 192 total cpu time spent up to now is 165.7 secs Computing kpt #: 193 total cpu time spent up to now is 166.2 secs Computing kpt #: 194 total cpu time spent up to now is 166.8 secs Computing kpt #: 195 total cpu time spent up to now is 167.4 secs Computing kpt #: 196 total cpu time spent up to now is 168.0 secs Computing kpt #: 197 total cpu time spent up to now is 168.5 secs Computing kpt #: 198 total cpu 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up to now is 177.6 secs Computing kpt #: 214 total cpu time spent up to now is 178.2 secs Computing kpt #: 215 total cpu time spent up to now is 178.8 secs Computing kpt #: 216 total cpu time spent up to now is 179.4 secs Computing kpt #: 217 total cpu time spent up to now is 179.9 secs Computing kpt #: 218 total cpu time spent up to now is 180.5 secs Computing kpt #: 219 total cpu time spent up to now is 181.1 secs Computing kpt #: 220 total cpu time spent up to now is 181.6 secs Computing kpt #: 221 total cpu time spent up to now is 182.2 secs Computing kpt #: 222 total cpu time spent up to now is 182.8 secs Computing kpt #: 223 total cpu time spent up to now is 183.4 secs Computing kpt #: 224 total cpu time spent up to now is 183.9 secs Computing kpt #: 225 total cpu time spent up to now is 184.5 secs Computing kpt #: 226 total cpu time spent up to now is 185.1 secs Computing kpt #: 227 total cpu time spent up to now is 185.7 secs Computing kpt #: 228 total cpu time spent up to now is 186.3 secs Computing kpt #: 229 total cpu time spent up to now is 186.9 secs Computing kpt #: 230 total cpu time spent up to now is 187.5 secs Computing kpt #: 231 total cpu time spent up to now is 188.1 secs Computing kpt #: 232 total cpu time spent up to now is 188.7 secs Computing kpt #: 233 total cpu time spent up to now is 189.3 secs Computing kpt #: 234 total cpu time spent up to now is 190.0 secs Computing kpt #: 235 total cpu time spent up to now is 190.7 secs Computing kpt #: 236 total cpu time spent up to now is 191.3 secs Computing kpt #: 237 total cpu time spent up to now is 192.0 secs Computing kpt #: 238 total cpu time spent up to now is 192.6 secs Computing kpt #: 239 total cpu time spent up to now is 193.3 secs Computing kpt #: 240 total cpu time spent up to now is 194.0 secs Computing kpt #: 241 total cpu time spent up to now is 194.7 secs Computing kpt #: 242 total cpu time spent up to now is 195.4 secs Computing kpt #: 243 total cpu time spent up to now is 196.9 secs Computing kpt #: 244 total cpu time spent up to now is 197.7 secs Computing kpt #: 245 total cpu time spent up to now is 198.4 secs Computing kpt #: 246 total cpu time spent up to now is 199.3 secs Computing kpt #: 247 total cpu time spent up to now is 200.1 secs Computing kpt #: 248 total cpu time spent up to now is 200.8 secs Computing kpt #: 249 total cpu time spent up to now is 201.7 secs Computing kpt #: 250 total cpu time spent up to now is 202.5 secs Computing kpt #: 251 total cpu time spent up to now is 203.4 secs Computing kpt #: 252 total cpu time spent up to now is 204.3 secs Computing kpt #: 253 total cpu time spent up to now is 205.2 secs Computing kpt #: 254 total cpu time spent up to now is 206.1 secs Computing kpt #: 255 total cpu time spent up to now is 206.9 secs Computing kpt #: 256 total cpu time spent up to now is 207.9 secs Computing kpt #: 257 total cpu time spent up to now is 208.8 secs Computing kpt #: 258 total cpu time spent up to now is 209.7 secs Computing kpt #: 259 total cpu time spent up to now is 210.5 secs Computing kpt #: 260 total cpu time spent up to now is 211.3 secs Computing kpt #: 261 total cpu time spent up to now is 212.1 secs Computing kpt #: 262 total cpu time spent up to now is 212.9 secs Computing kpt #: 263 total cpu time spent up to now is 213.7 secs Computing kpt #: 264 total cpu time spent up to now is 214.4 secs Computing kpt #: 265 total cpu time spent up to now is 215.3 secs Computing kpt #: 266 total cpu time spent up to now is 216.1 secs Computing kpt #: 267 total cpu time spent up to now is 217.0 secs Computing kpt #: 268 total cpu time spent up to now is 217.9 secs Computing kpt #: 269 total cpu time spent up to now is 218.8 secs Computing kpt #: 270 total cpu time spent up to now is 219.8 secs Computing kpt #: 271 total cpu time spent up to now is 220.7 secs Computing kpt #: 272 total cpu time spent up to now is 221.6 secs Computing kpt #: 273 total cpu time spent up to now is 222.5 secs Computing kpt #: 274 total cpu time spent up to now is 223.4 secs Computing kpt #: 275 total cpu time spent up to now is 224.4 secs Computing kpt #: 276 total cpu time spent up to now is 225.3 secs Computing kpt #: 277 total cpu time spent up to now is 226.2 secs Computing kpt #: 278 total cpu time spent up to now is 227.1 secs Computing kpt #: 279 total cpu time spent up to now is 228.1 secs Computing kpt #: 280 total cpu time spent up to now is 229.0 secs Computing kpt #: 281 total cpu time spent up to now is 230.0 secs Computing kpt #: 282 total cpu time spent up to now is 231.3 secs Computing kpt #: 283 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 233.1 secs Computing kpt #: 284 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 234.8 secs Computing kpt #: 285 total cpu time spent up to now is 235.9 secs Computing kpt #: 286 total cpu time spent up to now is 236.8 secs Computing kpt #: 287 total cpu time spent up to now is 237.7 secs Computing kpt #: 288 total cpu time spent up to now is 238.5 secs Computing kpt #: 289 total cpu time spent up to now is 239.3 secs Computing kpt #: 290 total cpu time spent up to now is 240.0 secs Computing kpt #: 291 total cpu time spent up to now is 240.7 secs Computing kpt #: 292 total cpu time spent up to now is 241.4 secs Computing kpt #: 293 total cpu time spent up to now is 242.1 secs Computing kpt #: 294 total cpu time spent up to now is 242.8 secs Computing kpt #: 295 total cpu time spent up to now is 243.4 secs Computing kpt #: 296 total cpu time spent up to now is 244.0 secs Computing kpt #: 297 total cpu time spent up to now is 244.7 secs Computing kpt #: 298 total cpu time spent up to now is 245.4 secs Computing kpt #: 299 total cpu time spent up to now is 246.0 secs Computing kpt #: 300 total cpu time spent up to now is 246.7 secs Computing kpt #: 301 total cpu time spent up to now is 247.5 secs Computing kpt #: 302 total cpu time spent up to now is 248.0 secs Computing kpt #: 303 total cpu time spent up to now is 248.6 secs Computing kpt #: 304 total cpu time spent up to now is 249.2 secs Computing kpt #: 305 total cpu time spent up to now is 249.8 secs Computing kpt #: 306 total cpu time spent up to now is 250.4 secs Computing kpt #: 307 total cpu time spent up to now is 251.0 secs Computing kpt #: 308 total cpu time spent up to now is 251.6 secs Computing kpt #: 309 total cpu time spent up to now is 252.3 secs Computing kpt #: 310 total cpu time spent up to now is 252.9 secs Computing kpt #: 311 total cpu time spent up to now is 253.4 secs Computing kpt #: 312 total cpu time spent up to now is 254.0 secs Computing kpt #: 313 total cpu time spent up to now is 254.7 secs Computing kpt #: 314 total cpu time spent up to now is 255.3 secs Computing kpt #: 315 total cpu time spent up to now is 256.0 secs Computing kpt #: 316 total cpu time spent up to now is 256.6 secs Computing kpt #: 317 total cpu time spent up to now is 257.1 secs Computing kpt #: 318 total cpu time spent up to now is 257.7 secs Computing kpt #: 319 total cpu time spent up to now is 258.3 secs Computing kpt #: 320 total cpu time spent up to now is 258.8 secs Computing kpt #: 321 total cpu time spent up to now is 259.4 secs Computing kpt #: 322 total cpu time spent up to now is 260.0 secs Computing kpt #: 323 total cpu time spent up to now is 260.6 secs Computing kpt #: 324 total cpu time spent up to now is 261.2 secs Computing kpt #: 325 total cpu time spent up to now is 261.8 secs Computing kpt #: 326 total cpu time spent up to now is 262.3 secs Computing kpt #: 327 total cpu time spent up to now is 262.9 secs Computing kpt #: 328 total cpu time spent up to now is 263.5 secs Computing kpt #: 329 total cpu time spent up to now is 264.0 secs Computing kpt #: 330 total cpu time spent up to now is 264.6 secs Computing kpt #: 331 total cpu time spent up to now is 265.2 secs Computing kpt #: 332 total cpu time spent up to now is 266.8 secs Computing kpt #: 333 total cpu time spent up to now is 267.3 secs Computing kpt #: 334 total cpu time spent up to now is 267.9 secs Computing kpt #: 335 total cpu time spent up to now is 268.5 secs Computing kpt #: 336 total cpu time spent up to now is 269.1 secs Computing kpt #: 337 total cpu time spent up to now is 269.6 secs Computing kpt #: 338 total cpu time spent up to now is 270.2 secs Computing kpt #: 339 total cpu time spent up to now is 270.8 secs Computing kpt #: 340 total cpu time spent up to now is 271.4 secs Computing kpt #: 341 total cpu time spent up to now is 272.0 secs Computing kpt #: 342 total cpu time spent up to now is 272.5 secs Computing kpt #: 343 total cpu time spent up to now is 273.1 secs Computing kpt #: 344 total cpu time spent up to now is 273.7 secs Computing kpt #: 345 total cpu time spent up to now is 274.2 secs Computing kpt #: 346 total cpu time spent up to now is 274.8 secs Computing kpt #: 347 total cpu time spent up to now is 275.4 secs Computing kpt #: 348 total cpu time spent up to now is 276.0 secs Computing kpt #: 349 total cpu time spent up to now is 276.5 secs Computing kpt #: 350 total cpu time spent up to now is 277.1 secs Computing kpt #: 351 total cpu time spent up to now is 277.7 secs Computing kpt #: 352 total cpu time spent up to now is 278.2 secs Computing kpt #: 353 total cpu time spent up to now is 278.8 secs Computing kpt #: 354 total cpu time spent up to now is 279.4 secs Computing kpt #: 355 total cpu time spent up to now is 280.0 secs Computing kpt #: 356 total cpu time spent up to now is 280.5 secs Computing kpt #: 357 total cpu time spent up to now is 281.1 secs Computing kpt #: 358 total cpu time spent up to now is 281.7 secs Computing kpt #: 359 total cpu time spent up to now is 282.2 secs Computing kpt #: 360 total cpu time spent up to now is 282.7 secs Computing kpt #: 361 total cpu time spent up to now is 283.3 secs Computing kpt #: 362 total cpu time spent up to now is 283.8 secs Computing kpt #: 363 total cpu time spent up to now is 284.4 secs Computing kpt #: 364 total cpu time spent up to now is 284.9 secs Computing kpt #: 365 total cpu time spent up to now is 285.5 secs Computing kpt #: 366 total cpu time spent up to now is 286.0 secs Computing kpt #: 367 total cpu time spent up to now is 286.6 secs Computing kpt #: 368 total cpu time spent up to now is 287.2 secs Computing kpt #: 369 total cpu time spent up to now is 287.7 secs Computing kpt #: 370 total cpu time spent up to now is 288.3 secs Computing kpt #: 371 total cpu time spent up to now is 288.9 secs Computing kpt #: 372 total cpu time spent up to now is 289.5 secs Computing kpt #: 373 total cpu time spent up to now is 290.1 secs Computing kpt #: 374 total cpu time spent up to now is 290.7 secs Computing kpt #: 375 total cpu time spent up to now is 291.4 secs Computing kpt #: 376 total cpu time spent up to now is 292.0 secs Computing kpt #: 377 total cpu time spent up to now is 292.7 secs Computing kpt #: 378 total cpu time spent up to now is 293.3 secs Computing kpt #: 379 total cpu time spent up to now is 294.0 secs Computing kpt #: 380 total cpu time spent up to now is 294.7 secs Computing kpt #: 381 total cpu time spent up to now is 295.4 secs Computing kpt #: 382 total cpu time spent up to now is 296.1 secs Computing kpt #: 383 total cpu time spent up to now is 296.8 secs Computing kpt #: 384 total cpu time spent up to now is 297.5 secs Computing kpt #: 385 total cpu time spent up to now is 298.2 secs Computing kpt #: 386 total cpu time spent up to now is 298.9 secs Computing kpt #: 387 total cpu time spent up to now is 299.7 secs Computing kpt #: 388 total cpu time spent up to now is 300.4 secs Computing kpt #: 389 total cpu time spent up to now is 302.6 secs Computing kpt #: 390 total cpu time spent up to now is 303.3 secs Computing kpt #: 391 total cpu time spent up to now is 304.0 secs Computing kpt #: 392 total cpu time spent up to now is 304.7 secs Computing kpt #: 393 total cpu time spent up to now is 305.4 secs Computing kpt #: 394 total cpu time spent up to now is 306.2 secs Computing kpt #: 395 total cpu time spent up to now is 307.0 secs Computing kpt #: 396 total cpu time spent up to now is 307.7 secs Computing kpt #: 397 total cpu time spent up to now is 308.6 secs Computing kpt #: 398 total cpu time spent up to now is 309.5 secs ethr = 2.50E-11, avg # of iterations = 28.9 total cpu time spent up to now is 309.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2501 PWs) bands (ev): -46.3979 -46.3979 -23.9871 -23.9871 -21.9440 -21.9440 -21.8515 -21.8515 -19.0318 -19.0318 -8.7887 -8.7887 -8.3584 -8.3584 -8.3203 -8.3203 -2.7474 -2.7474 -2.4867 -2.4867 -2.4852 -2.4852 5.9814 5.9814 6.1809 6.1809 6.1922 6.1922 6.7903 6.7903 6.8142 6.8142 7.2436 7.2436 7.3563 7.3563 7.5562 7.5562 7.5961 7.5961 9.9966 9.9966 10.6232 10.6232 10.7022 10.7022 13.8923 13.8923 k = 0.0000 0.0125-0.0000 ( 2497 PWs) bands (ev): -46.3978 -46.3978 -23.9873 -23.9871 -21.9442 -21.9438 -21.8516 -21.8516 -19.0318 -19.0318 -8.7886 -8.7879 -8.3588 -8.3575 -8.3197 -8.3197 -2.7475 -2.7471 -2.4868 -2.4864 -2.4851 -2.4850 5.9796 5.9805 6.1793 6.1803 6.1901 6.1904 6.7869 6.7886 6.8115 6.8124 7.2422 7.2448 7.3538 7.3563 7.5515 7.5576 7.5941 7.5950 10.0016 10.0023 10.6219 10.6254 10.7002 10.7050 13.8970 13.8992 k = 0.0000 0.0250-0.0000 ( 2489 PWs) bands (ev): -46.3977 -46.3977 -23.9875 -23.9871 -21.9445 -21.9438 -21.8520 -21.8520 -19.0317 -19.0316 -8.7876 -8.7862 -8.3587 -8.3561 -8.3179 -8.3177 -2.7473 -2.7466 -2.4868 -2.4861 -2.4847 -2.4845 5.9750 5.9768 6.1735 6.1767 6.1859 6.1863 6.7770 6.7805 6.8063 6.8075 7.2406 7.2456 7.3490 7.3540 7.5431 7.5538 7.5891 7.5922 10.0171 10.0186 10.6217 10.6285 10.6991 10.7087 13.9124 13.9163 k = 0.0000 0.0375-0.0000 ( 2485 PWs) bands (ev): -46.3976 -46.3976 -23.9879 -23.9872 -21.9448 -21.9438 -21.8526 -21.8526 -19.0315 -19.0314 -8.7859 -8.7837 -8.3581 -8.3544 -8.3147 -8.3142 -2.7470 -2.7460 -2.4866 -2.4858 -2.4841 -2.4837 5.9670 5.9695 6.1614 6.1669 6.1821 6.1833 6.7591 6.7639 6.8011 6.8025 7.2386 7.2457 7.3422 7.3497 7.5297 7.5422 7.5822 7.5899 10.0426 10.0450 10.6227 10.6325 10.6990 10.7135 13.9348 13.9395 k = 0.0000 0.0500-0.0000 ( 2489 PWs) bands (ev): -46.3977 -46.3977 -23.9883 -23.9874 -21.9453 -21.9439 -21.8534 -21.8534 -19.0312 -19.0311 -8.7834 -8.7805 -8.3571 -8.3527 -8.3101 -8.3089 -2.7464 -2.7451 -2.4862 -2.4854 -2.4832 -2.4825 5.9546 5.9577 6.1441 6.1518 6.1792 6.1806 6.7344 6.7395 6.7961 6.7978 7.2361 7.2450 7.3337 7.3436 7.5102 7.5228 7.5741 7.5876 10.0777 10.0811 10.6255 10.6378 10.7004 10.7201 13.9571 13.9614 k = 0.0000 0.0625-0.0000 ( 2477 PWs) bands (ev): -46.3975 -46.3975 -23.9888 -23.9878 -21.9458 -21.9440 -21.8545 -21.8544 -19.0308 -19.0307 -8.7802 -8.7767 -8.3558 -8.3511 -8.3037 -8.3016 -2.7457 -2.7441 -2.4857 -2.4849 -2.4821 -2.4810 5.9362 5.9398 6.1236 6.1338 6.1760 6.1776 6.7050 6.7095 6.7906 6.7929 7.2327 7.2430 7.3239 7.3362 7.4845 7.4972 7.5645 7.5835 10.1215 10.1262 10.6304 10.6443 10.7040 10.7294 13.9727 13.9764 k = 0.0000 0.0750-0.0000 ( 2477 PWs) bands (ev): -46.3974 -46.3974 -23.9895 -23.9882 -21.9464 -21.9443 -21.8557 -21.8556 -19.0304 -19.0302 -8.7766 -8.7724 -8.3544 -8.3496 -8.2955 -8.2921 -2.7448 -2.7429 -2.4851 -2.4844 -2.4808 -2.4793 5.9095 5.9136 6.1021 6.1151 6.1723 6.1742 6.6728 6.6758 6.7843 6.7872 7.2281 7.2395 7.3129 7.3277 7.4538 7.4667 7.5523 7.5762 10.1730 10.1793 10.6373 10.6522 10.7108 10.7424 13.9814 13.9851 k = 0.0000 0.0875-0.0000 ( 2471 PWs) bands (ev): -46.3973 -46.3973 -23.9902 -23.9887 -21.9471 -21.9447 -21.8572 -21.8571 -19.0299 -19.0296 -8.7727 -8.7678 -8.3529 -8.3483 -8.2851 -8.2803 -2.7437 -2.7415 -2.4844 -2.4837 -2.4792 -2.4773 5.8725 5.8774 6.0817 6.0976 6.1679 6.1701 6.6393 6.6401 6.7769 6.7805 7.2222 7.2343 7.3008 7.3182 7.4191 7.4326 7.5369 7.5649 10.2311 10.2397 10.6456 10.6612 10.7224 10.7602 13.9862 13.9903 k = 0.0000 0.1000-0.0000 ( 2465 PWs) bands (ev): -46.3972 -46.3972 -23.9909 -23.9893 -21.9479 -21.9451 -21.8588 -21.8586 -19.0293 -19.0290 -8.7685 -8.7631 -8.3515 -8.3472 -8.2724 -8.2662 -2.7424 -2.7400 -2.4836 -2.4829 -2.4774 -2.4751 5.8241 5.8301 6.0638 6.0823 6.1628 6.1655 6.6036 6.6054 6.7682 6.7725 7.2148 7.2272 7.2877 7.3076 7.3817 7.3961 7.5178 7.5493 10.2947 10.3064 10.6541 10.6713 10.7407 10.7842 13.9890 13.9936 k = 0.0000 0.1125-0.0000 ( 2465 PWs) bands (ev): -46.3971 -46.3971 -23.9918 -23.9899 -21.9488 -21.9457 -21.8606 -21.8603 -19.0286 -19.0283 -8.7644 -8.7584 -8.3502 -8.3461 -8.2574 -8.2497 -2.7410 -2.7383 -2.4827 -2.4820 -2.4753 -2.4727 5.7644 5.7718 6.0483 6.0694 6.1569 6.1601 6.5672 6.5719 6.7581 6.7631 7.2057 7.2179 7.2733 7.2957 7.3424 7.3582 7.4954 7.5298 10.3621 10.3783 10.6621 10.6829 10.7670 10.8149 13.9906 13.9958 k = 0.0000 0.1250-0.0000 ( 2465 PWs) bands (ev): -46.3970 -46.3970 -23.9927 -23.9907 -21.9499 -21.9464 -21.8625 -21.8621 -19.0279 -19.0276 -8.7603 -8.7539 -8.3489 -8.3452 -8.2398 -8.2309 -2.7394 -2.7365 -2.4817 -2.4811 -2.4729 -2.4700 5.6947 5.7036 6.0348 6.0584 6.1502 6.1541 6.5315 6.5395 6.7464 6.7520 7.1951 7.2064 7.2573 7.2819 7.3023 7.3201 7.4704 7.5070 10.4309 10.4543 10.6699 10.6977 10.8019 10.8527 13.9916 13.9974 k = 0.0000 0.1375-0.0000 ( 2467 PWs) bands (ev): -46.3970 -46.3970 -23.9937 -23.9915 -21.9510 -21.9472 -21.8646 -21.8640 -19.0271 -19.0268 -8.7565 -8.7498 -8.3476 -8.3442 -8.2198 -8.2097 -2.7377 -2.7346 -2.4806 -2.4801 -2.4704 -2.4672 5.6162 5.6266 6.0225 6.0488 6.1426 6.1473 6.4970 6.5082 6.7329 6.7392 7.1827 7.1924 7.2387 7.2613 7.2663 7.2829 7.4441 7.4820 10.4973 10.5321 10.6790 10.7186 10.8448 10.8976 13.9921 13.9986 k = 0.0000 0.1500-0.0000 ( 2471 PWs) bands (ev): -46.3970 -46.3970 -23.9948 -23.9925 -21.9523 -21.9481 -21.8667 -21.8660 -19.0263 -19.0259 -8.7531 -8.7460 -8.3464 -8.3434 -8.1973 -8.1861 -2.7359 -2.7326 -2.4795 -2.4790 -2.4676 -2.4642 5.5302 5.5421 6.0109 6.0399 6.1340 6.1398 6.4638 6.4783 6.7173 6.7243 7.1686 7.1754 7.2168 7.2225 7.2456 7.2483 7.4183 7.4563 10.5552 10.6051 10.6959 10.7513 10.8955 10.9492 13.9924 13.9995 k = 0.0000 0.1625-0.0000 ( 2471 PWs) bands (ev): -46.3969 -46.3969 -23.9959 -23.9934 -21.9537 -21.9492 -21.8688 -21.8680 -19.0254 -19.0250 -8.7500 -8.7428 -8.3453 -8.3425 -8.1724 -8.1603 -2.7339 -2.7304 -2.4783 -2.4778 -2.4647 -2.4609 5.4382 5.4513 5.9993 6.0313 6.1243 6.1314 6.4321 6.4500 6.6997 6.7072 7.1526 7.1548 7.1847 7.1909 7.2175 7.2210 7.3946 7.4313 10.5980 10.6512 10.7422 10.8018 10.9531 11.0072 13.9924 14.0002 k = 0.0000 0.1750-0.0000 ( 2471 PWs) bands (ev): -46.3968 -46.3968 -23.9970 -23.9945 -21.9552 -21.9504 -21.8710 -21.8700 -19.0245 -19.0241 -8.7475 -8.7401 -8.3442 -8.3416 -8.1452 -8.1323 -2.7319 -2.7282 -2.4770 -2.4766 -2.4615 -2.4576 5.3410 5.3552 5.9876 6.0228 6.1135 6.1223 6.4022 6.4232 6.6798 6.6878 7.1300 7.1339 7.1493 7.1622 7.1902 7.1925 7.3742 7.4082 10.6258 10.6680 10.8199 10.8695 11.0169 11.0709 13.9923 14.0008 k = 0.0000 0.1875-0.0000 ( 2467 PWs) bands (ev): -46.3967 -46.3967 -23.9982 -23.9956 -21.9569 -21.9518 -21.8731 -21.8720 -19.0235 -19.0231 -8.7454 -8.7380 -8.3431 -8.3407 -8.1158 -8.1023 -2.7297 -2.7260 -2.4757 -2.4753 -2.4582 -2.4541 5.2397 5.2548 5.9754 6.0138 6.1016 6.1123 6.3741 6.3981 6.6576 6.6660 7.1009 7.1093 7.1181 7.1321 7.1621 7.1655 7.3574 7.3878 10.6436 10.6762 10.9077 10.9488 11.0863 11.1397 13.9921 14.0012 k = 0.0000 0.2000-0.0000 ( 2467 PWs) bands (ev): -46.3966 -46.3966 -23.9994 -23.9967 -21.9587 -21.9533 -21.8752 -21.8740 -19.0225 -19.0221 -8.7438 -8.7365 -8.3420 -8.3399 -8.0844 -8.0704 -2.7275 -2.7237 -2.4743 -2.4740 -2.4547 -2.4504 5.1351 5.1510 5.9624 6.0043 6.0886 6.1016 6.3479 6.3747 6.6332 6.6419 7.0676 7.0769 7.0908 7.1021 7.1337 7.1429 7.3437 7.3703 10.6561 10.6821 10.9989 11.0346 11.1605 11.2129 13.9917 14.0014 k = 0.0000 0.2125-0.0000 ( 2459 PWs) bands (ev): -46.3964 -46.3964 -24.0007 -23.9979 -21.9606 -21.9550 -21.8772 -21.8759 -19.0215 -19.0211 -8.7428 -8.7355 -8.3409 -8.3390 -8.0511 -8.0368 -2.7252 -2.7213 -2.4729 -2.4726 -2.4511 -2.4467 5.0283 5.0446 5.9486 5.9937 6.0747 6.0901 6.3239 6.3532 6.6069 6.6157 7.0298 7.0394 7.0642 7.0744 7.1094 7.1217 7.3324 7.3554 10.6658 10.6872 11.0917 11.1240 11.2387 11.2899 13.9912 14.0016 k = 0.0000 0.2250-0.0000 ( 2461 PWs) bands (ev): -46.3963 -46.3963 -24.0020 -23.9991 -21.9626 -21.9568 -21.8792 -21.8777 -19.0204 -19.0200 -8.7422 -8.7351 -8.3399 -8.3381 -8.0163 -8.0017 -2.7229 -2.7190 -2.4715 -2.4712 -2.4474 -2.4429 4.9198 4.9365 5.9339 5.9817 6.0603 6.0780 6.3020 6.3334 6.5790 6.5878 6.9881 6.9973 7.0402 7.0500 7.0881 7.1013 7.3229 7.3428 10.6738 10.6919 11.1851 11.2153 11.3202 11.3701 13.9905 14.0015 k = 0.0000 0.2375-0.0000 ( 2453 PWs) bands (ev): -46.3961 -46.3961 -24.0032 -24.0004 -21.9648 -21.9588 -21.8810 -21.8794 -19.0194 -19.0189 -8.7420 -8.7351 -8.3388 -8.3372 -7.9801 -7.9653 -2.7206 -2.7166 -2.4701 -2.4697 -2.4436 -2.4390 4.8104 4.8274 5.9181 5.9680 6.0458 6.0654 6.2822 6.3155 6.5498 6.5586 6.9439 6.9526 7.0193 7.0287 7.0683 7.0814 7.3146 7.3320 10.6808 10.6964 11.2786 11.3074 11.4043 11.4526 13.9897 14.0014 k = 0.0000 0.2500-0.0000 ( 2453 PWs) bands (ev): -46.3960 -46.3960 -24.0045 -24.0016 -21.9670 -21.9609 -21.8828 -21.8811 -19.0183 -19.0179 -8.7423 -8.7356 -8.3378 -8.3363 -7.9427 -7.9280 -2.7182 -2.7142 -2.4686 -2.4683 -2.4398 -2.4351 4.7010 4.7181 5.9013 5.9521 6.0316 6.0524 6.2645 6.2994 6.5200 6.5287 6.8985 6.9069 7.0012 7.0103 7.0491 7.0619 7.3074 7.3226 10.6871 10.7008 11.3717 11.3995 11.4901 11.5369 13.9888 14.0010 k = 0.0000 0.2625-0.0000 ( 2453 PWs) bands (ev): -46.3960 -46.3960 -24.0058 -24.0029 -21.9693 -21.9632 -21.8844 -21.8826 -19.0172 -19.0168 -8.7429 -8.7365 -8.3368 -8.3354 -7.9046 -7.8899 -2.7159 -2.7119 -2.4672 -2.4669 -2.4359 -2.4313 4.5920 4.6091 5.8835 5.9340 6.0181 6.0391 6.2488 6.2849 6.4899 6.4986 6.8528 6.8612 6.9856 6.9942 7.0305 7.0427 7.3009 7.3143 10.6930 10.7050 11.4641 11.4910 11.5770 11.6223 13.9877 14.0005 k = 0.0000 0.2750-0.0000 ( 2445 PWs) bands (ev): -46.3958 -46.3958 -24.0070 -24.0042 -21.9717 -21.9655 -21.8859 -21.8840 -19.0162 -19.0157 -8.7438 -8.7377 -8.3358 -8.3346 -7.8659 -7.8514 -2.7135 -2.7096 -2.4657 -2.4655 -2.4319 -2.4273 4.4843 4.5012 5.8649 5.9140 6.0055 6.0258 6.2347 6.2721 6.4600 6.4688 6.8074 6.8162 6.9720 6.9802 7.0123 7.0238 7.2950 7.3069 10.6985 10.7092 11.5552 11.5814 11.6643 11.7081 13.9865 13.9998 k = 0.0000 0.2875-0.0000 ( 2453 PWs) bands (ev): -46.3958 -46.3958 -24.0083 -24.0055 -21.9741 -21.9680 -21.8872 -21.8853 -19.0151 -19.0147 -8.7449 -8.7391 -8.3348 -8.3337 -7.8269 -7.8127 -2.7112 -2.7074 -2.4643 -2.4641 -2.4281 -2.4236 4.3784 4.3950 5.8456 5.8924 5.9935 6.0124 6.2222 6.2608 6.4308 6.4398 6.7630 6.7722 6.9602 6.9679 6.9945 7.0054 7.2897 7.3002 10.7037 10.7133 11.6449 11.6701 11.7513 11.7937 13.9852 13.9989 k = 0.0000 0.3000-0.0000 ( 2457 PWs) bands (ev): -46.3957 -46.3957 -24.0095 -24.0068 -21.9765 -21.9705 -21.8884 -21.8866 -19.0141 -19.0137 -8.7463 -8.7408 -8.3339 -8.3329 -7.7879 -7.7741 -2.7090 -2.7052 -2.4629 -2.4627 -2.4243 -2.4198 4.2749 4.2912 5.8259 5.8698 5.9820 5.9990 6.2111 6.2508 6.4027 6.4120 6.7197 6.7296 6.9500 6.9571 6.9772 6.9875 7.2847 7.2941 10.7086 10.7173 11.7326 11.7567 11.8374 11.8786 13.9837 13.9978 k = 0.0000 0.3125-0.0000 ( 2457 PWs) bands (ev): -46.3957 -46.3957 -24.0107 -24.0080 -21.9789 -21.9731 -21.8895 -21.8877 -19.0131 -19.0127 -8.7478 -8.7427 -8.3330 -8.3321 -7.7493 -7.7359 -2.7068 -2.7031 -2.4615 -2.4613 -2.4205 -2.4162 4.1745 4.1903 5.8060 5.8467 5.9709 5.9858 6.2011 6.2420 6.3760 6.3858 6.6780 6.6886 6.9410 6.9476 6.9606 6.9702 7.2801 7.2885 10.7134 10.7211 11.8179 11.8408 11.9221 11.9621 13.9820 13.9965 k = 0.0000 0.3250-0.0000 ( 2463 PWs) bands (ev): -46.3956 -46.3956 -24.0118 -24.0093 -21.9813 -21.9756 -21.8904 -21.8887 -19.0121 -19.0118 -8.7494 -8.7446 -8.3321 -8.3313 -7.7113 -7.6983 -2.7046 -2.7011 -2.4602 -2.4600 -2.4168 -2.4126 4.0776 4.0928 5.7862 5.8235 5.9600 5.9727 6.1922 6.2342 6.3509 6.3615 6.6380 6.6494 6.9329 6.9391 6.9447 6.9537 7.2758 7.2834 10.7179 10.7249 11.9004 11.9220 12.0047 12.0436 13.9803 13.9949 k = 0.0000 0.3375-0.0000 ( 2462 PWs) bands (ev): -46.3956 -46.3956 -24.0129 -24.0105 -21.9836 -21.9782 -21.8913 -21.8896 -19.0112 -19.0109 -8.7511 -8.7467 -8.3313 -8.3305 -7.6742 -7.6618 -2.7026 -2.6992 -2.4589 -2.4587 -2.4132 -2.4092 3.9849 3.9994 5.7667 5.8007 5.9492 5.9599 6.1843 6.2273 6.3279 6.3392 6.5999 6.6121 6.9249 6.9305 6.9309 6.9385 7.2719 7.2787 10.7222 10.7285 11.9797 11.9997 12.0849 12.1227 13.9784 13.9932 k = 0.0000 0.3500-0.0000 ( 2462 PWs) bands (ev): -46.3955 -46.3955 -24.0139 -24.0116 -21.9858 -21.9807 -21.8920 -21.8904 -19.0103 -19.0100 -8.7528 -8.7487 -8.3305 -8.3298 -7.6383 -7.6266 -2.7006 -2.6974 -2.4577 -2.4575 -2.4098 -2.4060 3.8968 3.9106 5.7478 5.7786 5.9386 5.9473 6.1772 6.2210 6.3071 6.3193 6.5638 6.5768 6.9132 6.9202 6.9217 6.9275 7.2683 7.2744 10.7262 10.7319 12.0553 12.0737 12.1620 12.1986 13.9764 13.9913 k = 0.0000 0.3625-0.0000 ( 2462 PWs) bands (ev): -46.3954 -46.3954 -24.0149 -24.0127 -21.9879 -21.9831 -21.8926 -21.8911 -19.0095 -19.0092 -8.7545 -8.7508 -8.3298 -8.3291 -7.6039 -7.5929 -2.6987 -2.6958 -2.4565 -2.4564 -2.4065 -2.4029 3.8139 3.8268 5.7298 5.7573 5.9282 5.9351 6.1709 6.2152 6.2888 6.3017 6.5298 6.5435 6.9000 6.9068 6.9160 6.9209 7.2650 7.2704 10.7301 10.7351 12.1268 12.1435 12.2357 12.2710 13.9744 13.9891 k = 0.0000 0.3750-0.0000 ( 2458 PWs) bands (ev): -46.3953 -46.3953 -24.0157 -24.0137 -21.9899 -21.9854 -21.8932 -21.8918 -19.0087 -19.0084 -8.7562 -8.7528 -8.3291 -8.3285 -7.5714 -7.5612 -2.6969 -2.6942 -2.4554 -2.4553 -2.4034 -2.4000 3.7365 3.7486 5.7128 5.7373 5.9180 5.9234 6.1653 6.2094 6.2734 6.2866 6.4980 6.5123 6.8874 6.8937 6.9113 6.9156 7.2620 7.2668 10.7336 10.7381 12.1937 12.2087 12.3055 12.3391 13.9723 13.9867 k = 0.0000 0.3875-0.0000 ( 2458 PWs) bands (ev): -46.3952 -46.3952 -24.0166 -24.0147 -21.9917 -21.9876 -21.8936 -21.8923 -19.0080 -19.0077 -8.7578 -8.7547 -8.3284 -8.3279 -7.5409 -7.5315 -2.6953 -2.6928 -2.4544 -2.4543 -2.4005 -2.3974 3.6652 3.6763 5.6969 5.7186 5.9081 5.9123 6.1604 6.2033 6.2612 6.2739 6.4684 6.4832 6.8758 6.8815 6.9073 6.9111 7.2594 7.2636 10.7369 10.7409 12.2557 12.2690 12.3708 12.4026 13.9702 13.9842 k = 0.0000 0.4000-0.0000 ( 2454 PWs) bands (ev): -46.3951 -46.3951 -24.0173 -24.0156 -21.9934 -21.9897 -21.8940 -21.8928 -19.0073 -19.0070 -8.7592 -8.7565 -8.3278 -8.3274 -7.5128 -7.5043 -2.6938 -2.6915 -2.4535 -2.4534 -2.3978 -2.3950 3.6004 3.6103 5.6825 5.7014 5.8988 5.9020 6.1562 6.1965 6.2524 6.2636 6.4412 6.4563 6.8652 6.8703 6.9038 6.9072 7.2570 7.2607 10.7399 10.7434 12.3123 12.3239 12.4312 12.4609 13.9682 13.9815 k = 0.0000 0.4125-0.0000 ( 2450 PWs) bands (ev): -46.3950 -46.3950 -24.0179 -24.0164 -21.9949 -21.9915 -21.8943 -21.8933 -19.0067 -19.0065 -8.7606 -8.7582 -8.3273 -8.3269 -7.4872 -7.4797 -2.6924 -2.6904 -2.4527 -2.4526 -2.3954 -2.3929 3.5423 3.5512 5.6695 5.6858 5.8901 5.8924 6.1527 6.1892 6.2469 6.2557 6.4163 6.4315 6.8557 6.8602 6.9009 6.9039 7.2549 7.2581 10.7426 10.7456 12.3632 12.3732 12.4863 12.5134 13.9664 13.9788 k = 0.0000 0.4250-0.0000 ( 2454 PWs) bands (ev): -46.3950 -46.3950 -24.0185 -24.0172 -21.9961 -21.9933 -21.8945 -21.8936 -19.0062 -19.0060 -8.7618 -8.7597 -8.3268 -8.3265 -7.4645 -7.4579 -2.6912 -2.6895 -2.4519 -2.4519 -2.3933 -2.3911 3.4913 3.4991 5.6582 5.6719 5.8822 5.8839 6.1499 6.1817 6.2441 6.2500 6.3940 6.4090 6.8475 6.8514 6.8985 6.9010 7.2531 7.2558 10.7450 10.7476 12.4080 12.4164 12.5355 12.5597 13.9647 13.9760 k = 0.0000 0.4375-0.0000 ( 2446 PWs) bands (ev): -46.3948 -46.3948 -24.0189 -24.0178 -21.9972 -21.9948 -21.8947 -21.8940 -19.0057 -19.0055 -8.7628 -8.7611 -8.3264 -8.3262 -7.4448 -7.4393 -2.6901 -2.6887 -2.4513 -2.4512 -2.3913 -2.3895 3.4478 3.4543 5.6486 5.6599 5.8752 5.8764 6.1479 6.1744 6.2433 6.2464 6.3744 6.3887 6.8405 6.8437 6.8965 6.8986 7.2516 7.2538 10.7471 10.7492 12.4466 12.4534 12.5785 12.5994 13.9634 13.9732 k = 0.0000 0.4500-0.0000 ( 2446 PWs) bands (ev): -46.3948 -46.3948 -24.0192 -24.0184 -21.9980 -21.9961 -21.8949 -21.8943 -19.0053 -19.0052 -8.7636 -8.7622 -8.3261 -8.3259 -7.4284 -7.4239 -2.6892 -2.6880 -2.4508 -2.4507 -2.3898 -2.3883 3.4120 3.4173 5.6409 5.6498 5.8693 5.8702 6.1466 6.1677 6.2439 6.2446 6.3577 6.3709 6.8348 6.8373 6.8950 6.8966 7.2504 7.2522 10.7489 10.7506 12.4785 12.4840 12.6147 12.6320 13.9624 13.9706 k = 0.0000 0.4625-0.0000 ( 2446 PWs) bands (ev): -46.3948 -46.3948 -24.0195 -24.0188 -21.9986 -21.9971 -21.8949 -21.8945 -19.0050 -19.0049 -8.7642 -8.7632 -8.3258 -8.3257 -7.4152 -7.4119 -2.6885 -2.6876 -2.4504 -2.4503 -2.3885 -2.3873 3.3841 3.3880 5.6350 5.6417 5.8646 5.8652 6.1460 6.1618 6.2443 6.2453 6.3444 6.3556 6.8303 6.8323 6.8938 6.8950 7.2496 7.2509 10.7503 10.7516 12.5038 12.5078 12.6439 12.6572 13.9618 13.9681 k = 0.0000 0.4750-0.0000 ( 2454 PWs) bands (ev): -46.3949 -46.3949 -24.0197 -24.0192 -21.9990 -21.9980 -21.8950 -21.8947 -19.0048 -19.0047 -8.7646 -8.7639 -8.3256 -8.3255 -7.4056 -7.4034 -2.6879 -2.6873 -2.4501 -2.4501 -2.3875 -2.3867 3.3642 3.3668 5.6311 5.6355 5.8612 5.8616 6.1464 6.1568 6.2451 6.2468 6.3349 6.3434 6.8273 6.8286 6.8931 6.8939 7.2490 7.2499 10.7514 10.7522 12.5221 12.5247 12.6657 12.6747 13.9616 13.9659 k = 0.0000 0.4875-0.0000 ( 2462 PWs) bands (ev): -46.3950 -46.3950 -24.0197 -24.0195 -21.9991 -21.9986 -21.8950 -21.8948 -19.0047 -19.0047 -8.7648 -8.7645 -8.3255 -8.3254 -7.3996 -7.3985 -2.6875 -2.6872 -2.4499 -2.4499 -2.3868 -2.3865 3.3525 3.3538 5.6291 5.6313 5.8592 5.8593 6.1476 6.1528 6.2464 6.2477 6.3299 6.3345 6.8255 6.8262 6.8927 6.8931 7.2487 7.2492 10.7521 10.7525 12.5333 12.5347 12.6797 12.6843 13.9619 13.9641 k = 0.0000 0.5000-0.0000 ( 2460 PWs) bands (ev): -46.3950 -46.3950 -24.0197 -24.0197 -21.9990 -21.9990 -21.8949 -21.8949 -19.0046 -19.0046 -8.7647 -8.7647 -8.3254 -8.3254 -7.3972 -7.3972 -2.6873 -2.6873 -2.4498 -2.4498 -2.3865 -2.3865 3.3490 3.3490 5.6292 5.6292 5.8585 5.8585 6.1497 6.1497 6.2475 6.2475 6.3299 6.3299 6.8252 6.8252 6.8927 6.8927 7.2488 7.2488 10.7525 10.7525 12.5375 12.5375 12.6860 12.6860 13.9628 13.9628 k = 0.0000 0.5000-0.0000 ( 2460 PWs) bands (ev): -46.3950 -46.3950 -24.0197 -24.0197 -21.9990 -21.9990 -21.8949 -21.8949 -19.0046 -19.0046 -8.7647 -8.7647 -8.3254 -8.3254 -7.3972 -7.3972 -2.6873 -2.6873 -2.4498 -2.4498 -2.3865 -2.3865 3.3490 3.3490 5.6292 5.6292 5.8585 5.8585 6.1497 6.1497 6.2475 6.2475 6.3299 6.3299 6.8252 6.8252 6.8927 6.8927 7.2488 7.2488 10.7525 10.7525 12.5375 12.5375 12.6860 12.6860 13.9628 13.9628 k = 0.0125 0.5000-0.0000 ( 2462 PWs) bands (ev): -46.3950 -46.3950 -24.0198 -24.0196 -21.9990 -21.9990 -21.8953 -21.8949 -19.0046 -19.0046 -8.7646 -8.7632 -8.3257 -8.3236 -7.3973 -7.3972 -2.6881 -2.6865 -2.4509 -2.4488 -2.3869 -2.3865 3.3489 3.3490 5.6264 5.6299 5.8437 5.8503 6.1440 6.1524 6.2408 6.2514 6.3360 6.3397 6.8293 6.8302 6.8743 6.8915 7.2465 7.2638 10.7492 10.7569 12.5363 12.5405 12.6842 12.6881 13.9663 13.9689 k = 0.0250 0.5000-0.0000 ( 2462 PWs) bands (ev): -46.3950 -46.3950 -24.0200 -24.0196 -21.9990 -21.9989 -21.8960 -21.8952 -19.0046 -19.0046 -8.7629 -8.7601 -8.3246 -8.3204 -7.3975 -7.3974 -2.6891 -2.6859 -2.4519 -2.4478 -2.3877 -2.3868 3.3487 3.3489 5.6209 5.6285 5.8090 5.8221 6.1352 6.1511 6.2320 6.2517 6.3556 6.3623 6.8396 6.8439 6.8443 6.8712 7.2565 7.2872 10.7471 10.7625 12.5365 12.5451 12.6828 12.6907 13.9794 13.9845 k = 0.0375 0.5000-0.0000 ( 2458 PWs) bands (ev): -46.3949 -46.3949 -24.0204 -24.0197 -21.9990 -21.9988 -21.8970 -21.8958 -19.0045 -19.0045 -8.7596 -8.7554 -8.3219 -8.3156 -7.3979 -7.3978 -2.6901 -2.6853 -2.4530 -2.4468 -2.3888 -2.3875 3.3484 3.3488 5.6107 5.6239 5.7617 5.7817 6.1231 6.1446 6.2212 6.2474 6.3832 6.3918 6.7982 6.8360 6.8659 6.8688 7.2742 7.3140 10.7469 10.7695 12.5384 12.5514 12.6816 12.6937 14.0013 14.0088 k = 0.0500 0.5000-0.0000 ( 2470 PWs) bands (ev): -46.3950 -46.3950 -24.0208 -24.0199 -21.9989 -21.9988 -21.8983 -21.8967 -19.0044 -19.0044 -8.7548 -8.7493 -8.3177 -8.3093 -7.3985 -7.3983 -2.6912 -2.6850 -2.4541 -2.4459 -2.3904 -2.3886 3.3480 3.3485 5.5919 5.6120 5.7111 5.7387 6.1075 6.1313 6.2088 6.2371 6.4132 6.4229 6.7523 6.7942 6.8985 6.9017 7.2946 7.3400 10.7490 10.7787 12.5416 12.5595 12.6807 12.6973 14.0312 14.0409 k = 0.0625 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3950 -46.3950 -24.0213 -24.0202 -21.9988 -21.9986 -21.9000 -21.8980 -19.0042 -19.0042 -8.7486 -8.7417 -8.3119 -8.3014 -7.3992 -7.3989 -2.6924 -2.6847 -2.4552 -2.4450 -2.3922 -2.3900 3.3476 3.3482 5.5582 5.5812 5.6726 5.7034 6.0875 6.1097 6.1949 6.2198 6.4419 6.4521 6.7076 6.7501 6.9403 6.9437 7.3138 7.3629 10.7546 10.7907 12.5462 12.5694 12.6800 12.7017 14.0679 14.0796 k = 0.0750 0.5000-0.0000 ( 2476 PWs) bands (ev): -46.3950 -46.3950 -24.0219 -24.0206 -21.9987 -21.9985 -21.9019 -21.8996 -19.0041 -19.0041 -8.7412 -8.7329 -8.3044 -8.2918 -7.4000 -7.3997 -2.6937 -2.6846 -2.4562 -2.4442 -2.3944 -2.3917 3.3470 3.3477 5.5077 5.5261 5.6541 5.6803 6.0613 6.0781 6.1795 6.1952 6.4677 6.4780 6.6680 6.7079 6.9903 6.9936 7.3296 7.3811 10.7645 10.8065 12.5520 12.5811 12.6795 12.7069 14.1100 14.1233 k = 0.0875 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3949 -46.3949 -24.0225 -24.0211 -21.9986 -21.9983 -21.9041 -21.9014 -19.0039 -19.0039 -8.7327 -8.7231 -8.2950 -8.2804 -7.4010 -7.4006 -2.6951 -2.6846 -2.4572 -2.4434 -2.3969 -2.3938 3.3463 3.3472 5.4454 5.4586 5.6452 5.6662 6.0260 6.0352 6.1628 6.1650 6.4903 6.5004 6.6361 6.6706 7.0469 7.0500 7.3406 7.3938 10.7794 10.8267 12.5590 12.5948 12.6792 12.7131 14.1559 14.1708 k = 0.1000 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3948 -46.3948 -24.0232 -24.0216 -21.9985 -21.9982 -21.9065 -21.9035 -19.0036 -19.0036 -8.7233 -8.7124 -8.2838 -8.2673 -7.4020 -7.4016 -2.6965 -2.6847 -2.4582 -2.4427 -2.3997 -2.3961 3.3456 3.3466 5.3769 5.3865 5.6393 5.6566 5.9778 5.9803 6.1330 6.1448 6.5098 6.5197 6.6125 6.6402 7.1085 7.1114 7.3464 7.4005 10.8000 10.8521 12.5669 12.6105 12.6790 12.7206 14.2040 14.2202 k = 0.1125 0.5000-0.0000 ( 2460 PWs) bands (ev): -46.3947 -46.3947 -24.0240 -24.0222 -21.9983 -21.9980 -21.9093 -21.9059 -19.0034 -19.0034 -8.7131 -8.7010 -8.2706 -8.2522 -7.4032 -7.4028 -2.6979 -2.6850 -2.4592 -2.4420 -2.4026 -2.3987 3.3447 3.3458 5.3053 5.3125 5.6342 5.6490 5.9138 5.9148 6.1027 6.1255 6.5269 6.5365 6.5968 6.6169 7.1736 7.1763 7.3468 7.4013 10.8270 10.8831 12.5755 12.6283 12.6791 12.7296 14.2531 14.2704 k = 0.1250 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3947 -46.3947 -24.0249 -24.0229 -21.9982 -21.9978 -21.9122 -21.9086 -19.0031 -19.0031 -8.7024 -8.6892 -8.2552 -8.2351 -7.4045 -7.4040 -2.6995 -2.6855 -2.4601 -2.4415 -2.4058 -2.4015 3.3437 3.3450 5.2324 5.2380 5.6292 5.6424 5.8368 5.8382 6.0748 6.1050 6.5420 6.5516 6.5874 6.6006 7.2409 7.2433 7.3419 7.3963 10.8605 10.9201 12.5845 12.6481 12.6792 12.7405 14.3016 14.3199 k = 0.1375 0.5000-0.0000 ( 2460 PWs) bands (ev): -46.3945 -46.3945 -24.0258 -24.0237 -21.9980 -21.9975 -21.9153 -21.9114 -19.0028 -19.0028 -8.6914 -8.6772 -8.2377 -8.2160 -7.4060 -7.4054 -2.7011 -2.6862 -2.4610 -2.4411 -2.4091 -2.4044 3.3427 3.3441 5.1591 5.1636 5.6238 5.6360 5.7510 5.7511 6.0487 6.0834 6.5554 6.5652 6.5831 6.5905 7.3093 7.3114 7.3322 7.3862 10.9006 10.9631 12.5935 12.6700 12.6796 12.7535 14.3487 14.3678 k = 0.1500 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3946 -46.3946 -24.0268 -24.0245 -21.9978 -21.9973 -21.9187 -21.9145 -19.0025 -19.0025 -8.6802 -8.6651 -8.2179 -8.1948 -7.4075 -7.4068 -2.7027 -2.6870 -2.4619 -2.4409 -2.4125 -2.4076 3.3415 3.3430 5.0863 5.0899 5.6156 5.6283 5.6584 5.6591 6.0234 6.0606 6.5663 6.5770 6.5834 6.5867 7.3182 7.3711 7.3781 7.3799 10.9473 11.0121 12.6024 12.6796 12.6945 12.7691 14.3934 14.4133 k = 0.1625 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3946 -46.3946 -24.0278 -24.0254 -21.9976 -21.9971 -21.9222 -21.9178 -19.0022 -19.0022 -8.6690 -8.6533 -8.1959 -8.1716 -7.4091 -7.4083 -2.7044 -2.6880 -2.4628 -2.4411 -2.4158 -2.4108 3.3401 3.3418 5.0142 5.0172 5.5492 5.5567 5.6175 5.6253 5.9983 6.0367 6.5723 6.5822 6.5907 6.5922 7.3007 7.3525 7.4462 7.4479 11.0002 11.0669 12.6108 12.6802 12.7208 12.7874 14.4350 14.4557 k = 0.1750 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3944 -46.3944 -24.0288 -24.0263 -21.9974 -21.9968 -21.9259 -21.9212 -19.0018 -19.0018 -8.6579 -8.6417 -8.1715 -8.1463 -7.4107 -7.4099 -2.7062 -2.6891 -2.4637 -2.4416 -2.4187 -2.4140 3.3387 3.3405 4.9432 4.9457 5.4444 5.4532 5.6103 5.6185 5.9732 6.0118 6.5750 6.5861 6.6003 6.6040 7.2804 7.3305 7.5134 7.5151 11.0590 11.1271 12.6186 12.6808 12.7494 12.8087 14.4732 14.4947 k = 0.1875 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3943 -46.3943 -24.0299 -24.0273 -21.9972 -21.9966 -21.9296 -21.9248 -19.0014 -19.0014 -8.6471 -8.6306 -8.1450 -8.1190 -7.4124 -7.4115 -2.7079 -2.6904 -2.4646 -2.4427 -2.4213 -2.4172 3.3371 3.3391 4.8736 4.8757 5.3351 5.3459 5.6040 5.6119 5.9477 5.9861 6.5779 6.5911 6.6117 6.6159 7.2578 7.3060 7.5792 7.5808 11.1231 11.1922 12.6257 12.6814 12.7801 12.8328 14.5078 14.5300 k = 0.2000 0.5000-0.0000 ( 2466 PWs) bands (ev): -46.3942 -46.3942 -24.0311 -24.0284 -21.9970 -21.9963 -21.9335 -21.9285 -19.0011 -19.0011 -8.6366 -8.6200 -8.1164 -8.0899 -7.4142 -7.4132 -2.7097 -2.6919 -2.4656 -2.4446 -2.4232 -2.4203 3.3353 3.3375 4.8056 4.8074 5.2234 5.2360 5.5977 5.6053 5.9220 5.9594 6.5819 6.5971 6.6234 6.6277 7.2337 7.2797 7.6433 7.6447 11.1919 11.2616 12.6321 12.6822 12.8129 12.8599 14.5386 14.5616 k = 0.2125 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3942 -46.3942 -24.0322 -24.0295 -21.9968 -21.9960 -21.9374 -21.9323 -19.0007 -19.0007 -8.6266 -8.6100 -8.0859 -8.0590 -7.4160 -7.4149 -2.7115 -2.6936 -2.4667 -2.4472 -2.4245 -2.4233 3.3333 3.3357 4.7394 4.7410 5.1101 5.1244 5.5913 5.5984 5.8958 5.9321 6.5869 6.6037 6.6354 6.6396 7.2086 7.2522 7.7053 7.7066 11.2647 11.3348 12.6378 12.6830 12.8478 12.8897 14.5657 14.5894 k = 0.2250 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3941 -46.3941 -24.0334 -24.0306 -21.9965 -21.9958 -21.9414 -21.9361 -19.0003 -19.0003 -8.6170 -8.6006 -8.0536 -8.0266 -7.4178 -7.4166 -2.7134 -2.6953 -2.4680 -2.4504 -2.4260 -2.4252 3.3311 3.3337 4.6752 4.6765 4.9963 5.0119 5.5846 5.5915 5.8694 5.9042 6.5928 6.6109 6.6473 6.6514 7.1831 7.2241 7.7650 7.7662 11.3410 11.4112 12.6429 12.6838 12.8847 12.9222 14.5893 14.6137 k = 0.2375 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3940 -46.3940 -24.0345 -24.0317 -21.9963 -21.9955 -21.9454 -21.9400 -18.9999 -18.9999 -8.6079 -8.5919 -8.0199 -7.9929 -7.4196 -7.4182 -2.7152 -2.6972 -2.4695 -2.4540 -2.4283 -2.4255 3.3286 3.3314 4.6130 4.6142 4.8826 4.8993 5.5778 5.5843 5.8427 5.8760 6.5993 6.6186 6.6593 6.6632 7.1576 7.1958 7.8221 7.8233 11.4201 11.4901 12.6476 12.6847 12.9233 12.9570 14.6095 14.6346 k = 0.2500 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3939 -46.3939 -24.0357 -24.0329 -21.9961 -21.9952 -21.9494 -21.9439 -18.9995 -18.9995 -8.5993 -8.5837 -7.9849 -7.9581 -7.4213 -7.4199 -2.7170 -2.6993 -2.4712 -2.4580 -2.4304 -2.4255 3.3259 3.3288 4.5530 4.5540 4.7697 4.7874 5.5709 5.5771 5.8160 5.8474 6.6064 6.6265 6.6713 6.6749 7.1323 7.1677 7.8766 7.8777 11.5014 11.5709 12.6519 12.6856 12.9636 12.9938 14.6265 14.6524 k = 0.2625 0.5000-0.0000 ( 2466 PWs) bands (ev): -46.3938 -46.3938 -24.0369 -24.0341 -21.9959 -21.9949 -21.9534 -21.9478 -18.9991 -18.9991 -8.5912 -8.5762 -7.9489 -7.9225 -7.4230 -7.4215 -2.7188 -2.7014 -2.4732 -2.4620 -2.4320 -2.4253 3.3228 3.3260 4.4953 4.4962 4.6584 4.6768 5.5639 5.5698 5.7892 5.8188 6.6140 6.6347 6.6832 6.6866 7.1077 7.1402 7.9283 7.9294 11.5841 11.6530 12.6557 12.6866 13.0053 13.0326 14.6406 14.6671 k = 0.2750 0.5000-0.0000 ( 2466 PWs) bands (ev): -46.3937 -46.3937 -24.0380 -24.0352 -21.9957 -21.9947 -21.9573 -21.9517 -18.9987 -18.9987 -8.5836 -8.5692 -7.9123 -7.8864 -7.4247 -7.4230 -2.7206 -2.7036 -2.4754 -2.4662 -2.4331 -2.4250 3.3193 3.3226 4.4399 4.4408 4.5493 4.5682 5.5569 5.5625 5.7627 5.7904 6.6219 6.6431 6.6950 6.6981 7.0839 7.1134 7.9772 7.9782 11.6676 11.7358 12.6593 12.6876 13.0482 13.0727 14.6521 14.6792 k = 0.2875 0.5000-0.0000 ( 2470 PWs) bands (ev): -46.3936 -46.3936 -24.0392 -24.0364 -21.9956 -21.9945 -21.9611 -21.9555 -18.9983 -18.9983 -8.5764 -8.5627 -7.8753 -7.8501 -7.4262 -7.4244 -2.7224 -2.7058 -2.4778 -2.4703 -2.4339 -2.4246 3.3153 3.3188 4.3868 4.3875 4.4434 4.4626 5.5498 5.5552 5.7365 5.7622 6.6300 6.6516 6.7066 6.7095 7.0611 7.0876 8.0231 8.0241 11.7515 11.8185 12.6626 12.6886 13.0920 13.1141 14.6611 14.6886 k = 0.3000 0.5000-0.0000 ( 2470 PWs) bands (ev): -46.3935 -46.3935 -24.0403 -24.0376 -21.9954 -21.9942 -21.9648 -21.9592 -18.9979 -18.9979 -8.5697 -8.5567 -7.8384 -7.8138 -7.4276 -7.4256 -2.7241 -2.7081 -2.4804 -2.4743 -2.4344 -2.4242 3.3106 3.3144 4.3315 4.3345 4.3463 4.3621 5.5428 5.5480 5.7108 5.7345 6.6384 6.6601 6.7179 6.7206 7.0392 7.0628 8.0661 8.0670 11.8350 11.9008 12.6657 12.6897 13.1363 13.1563 14.6678 14.6957 k = 0.3125 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3935 -46.3935 -24.0414 -24.0388 -21.9953 -21.9940 -21.9683 -21.9628 -18.9975 -18.9975 -8.5635 -8.5513 -7.8017 -7.7780 -7.4288 -7.4267 -2.7257 -2.7105 -2.4831 -2.4783 -2.4345 -2.4238 3.3053 3.3093 4.2396 4.2574 4.2920 4.2930 5.5359 5.5408 5.6858 5.7076 6.6470 6.6688 6.7290 6.7314 7.0185 7.0392 8.1061 8.1070 11.9176 11.9819 12.6685 12.6907 13.1809 13.1990 14.6726 14.7006 k = 0.3250 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3934 -46.3934 -24.0424 -24.0399 -21.9952 -21.9939 -21.9717 -21.9663 -18.9971 -18.9971 -8.5577 -8.5463 -7.7657 -7.7429 -7.4298 -7.4276 -2.7273 -2.7128 -2.4858 -2.4820 -2.4344 -2.4234 3.2991 3.3033 4.1462 4.1648 4.2468 4.2469 5.5292 5.5339 5.6617 5.6815 6.6557 6.6774 6.7398 6.7419 6.9988 7.0167 8.1431 8.1440 11.9987 12.0613 12.6712 12.6918 13.2254 13.2416 14.6755 14.7036 k = 0.3375 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3933 -46.3933 -24.0434 -24.0410 -21.9952 -21.9938 -21.9749 -21.9696 -18.9968 -18.9968 -8.5523 -8.5417 -7.7308 -7.7089 -7.4306 -7.4281 -2.7288 -2.7151 -2.4886 -2.4856 -2.4340 -2.4230 3.2919 3.2962 4.0580 4.0764 4.2047 4.2047 5.5226 5.5271 5.6386 5.6565 6.6646 6.6861 6.7501 6.7520 6.9802 6.9954 8.1773 8.1781 12.0777 12.1384 12.6738 12.6929 13.2693 13.2840 14.6769 14.7048 k = 0.3500 0.5000-0.0000 ( 2476 PWs) bands (ev): -46.3933 -46.3933 -24.0443 -24.0420 -21.9953 -21.9938 -21.9778 -21.9726 -18.9964 -18.9964 -8.5473 -8.5375 -7.6972 -7.6763 -7.4309 -7.4284 -2.7302 -2.7174 -2.4912 -2.4890 -2.4335 -2.4226 3.2835 3.2878 3.9759 3.9939 4.1655 4.1656 5.5163 5.5206 5.6166 5.6327 6.6735 6.6947 6.7600 6.7616 6.9626 6.9752 8.2085 8.2093 12.1541 12.2125 12.6763 12.6940 13.3124 13.3255 14.6769 14.7044 k = 0.3625 0.5000-0.0000 ( 2476 PWs) bands (ev): -46.3932 -46.3932 -24.0452 -24.0430 -21.9954 -21.9938 -21.9805 -21.9754 -18.9961 -18.9961 -8.5427 -8.5337 -7.6654 -7.6457 -7.4308 -7.4282 -2.7315 -2.7196 -2.4938 -2.4922 -2.4328 -2.4223 3.2737 3.2780 3.9007 3.9179 4.1294 4.1295 5.5102 5.5143 5.5960 5.6102 6.6825 6.7034 6.7693 6.7707 6.9460 6.9561 8.2369 8.2377 12.2273 12.2832 12.6786 12.6951 13.3541 13.3658 14.6759 14.7027 k = 0.3750 0.5000-0.0000 ( 2472 PWs) bands (ev): -46.3931 -46.3931 -24.0460 -24.0440 -21.9956 -21.9940 -21.9828 -21.9780 -18.9958 -18.9958 -8.5385 -8.5304 -7.6357 -7.6172 -7.4302 -7.4274 -2.7326 -2.7217 -2.4963 -2.4951 -2.4320 -2.4221 3.2623 3.2664 3.8330 3.8493 4.0963 4.0964 5.5044 5.5084 5.5769 5.5893 6.6916 6.7120 6.7781 6.7791 6.9303 6.9381 8.2626 8.2633 12.2968 12.3498 12.6810 12.6963 13.3940 13.4044 14.6739 14.6998 k = 0.3875 0.5000-0.0000 ( 2474 PWs) bands (ev): -46.3931 -46.3931 -24.0467 -24.0449 -21.9959 -21.9944 -21.9846 -21.9802 -18.9955 -18.9955 -8.5347 -8.5274 -7.6085 -7.5915 -7.4288 -7.4260 -2.7337 -2.7238 -2.4986 -2.4977 -2.4311 -2.4219 3.2493 3.2532 3.7732 3.7884 4.0662 4.0663 5.4989 5.5028 5.5593 5.5700 6.7008 6.7207 6.7862 6.7869 6.9156 6.9211 8.2856 8.2862 12.3618 12.4116 12.6834 12.6976 13.4318 13.4409 14.6713 14.6959 k = 0.4000 0.5000-0.0000 ( 2474 PWs) bands (ev): -46.3930 -46.3930 -24.0474 -24.0457 -21.9964 -21.9951 -21.9861 -21.9821 -18.9953 -18.9953 -8.5313 -8.5248 -7.5842 -7.5688 -7.4265 -7.4239 -2.7346 -2.7257 -2.5007 -2.5001 -2.4302 -2.4218 3.2348 3.2383 3.7218 3.7355 4.0392 4.0393 5.4938 5.4976 5.5436 5.5526 6.7100 6.7292 6.7936 6.7940 6.9017 6.9052 8.3059 8.3065 12.4218 12.4681 12.6859 12.6991 13.4669 13.4749 14.6682 14.6914 k = 0.4125 0.5000-0.0000 ( 2470 PWs) bands (ev): -46.3929 -46.3929 -24.0480 -24.0465 -21.9969 -21.9959 -21.9871 -21.9837 -18.9951 -18.9951 -8.5282 -8.5225 -7.5632 -7.5495 -7.4232 -7.4209 -2.7353 -2.7275 -2.5026 -2.5023 -2.4293 -2.4217 3.2191 3.2221 3.6787 3.6908 4.0153 4.0153 5.4889 5.4927 5.5298 5.5371 6.7193 6.7378 6.8002 6.8003 6.8886 6.8902 8.3237 8.3241 12.4763 12.5186 12.6887 12.7009 13.4990 13.5059 14.6650 14.6863 k = 0.4250 0.5000-0.0000 ( 2470 PWs) bands (ev): -46.3928 -46.3928 -24.0484 -24.0472 -21.9976 -21.9969 -21.9877 -21.9849 -18.9949 -18.9949 -8.5255 -8.5206 -7.5456 -7.5339 -7.4189 -7.4171 -2.7359 -2.7291 -2.5043 -2.5041 -2.4284 -2.4217 3.2028 3.2052 3.6436 3.6539 3.9945 3.9945 5.4843 5.4880 5.5180 5.5237 6.7286 6.7462 6.8057 6.8061 6.8761 6.8762 8.3389 8.3393 12.5243 12.5621 12.6922 12.7032 13.5277 13.5335 14.6619 14.6809 k = 0.4375 0.5000-0.0000 ( 2466 PWs) bands (ev): -46.3928 -46.3928 -24.0488 -24.0478 -21.9983 -21.9978 -21.9881 -21.9859 -18.9947 -18.9947 -8.5231 -8.5191 -7.5315 -7.5219 -7.4139 -7.4126 -2.7363 -2.7306 -2.5057 -2.5057 -2.4275 -2.4218 3.1867 3.1886 3.6158 3.6244 3.9769 3.9769 5.4800 5.4837 5.5085 5.5125 6.7379 6.7546 6.8102 6.8111 6.8632 6.8646 8.3517 8.3521 12.5654 12.5977 12.6968 12.7061 13.5527 13.5575 14.6591 14.6755 k = 0.4500 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3928 -46.3928 -24.0492 -24.0483 -21.9989 -21.9987 -21.9882 -21.9866 -18.9945 -18.9945 -8.5211 -8.5179 -7.5207 -7.5133 -7.4085 -7.4078 -2.7365 -2.7320 -2.5070 -2.5069 -2.4266 -2.4221 3.1718 3.1731 3.5947 3.6015 3.9624 3.9624 5.4760 5.4795 5.5011 5.5037 6.7472 6.7626 6.8136 6.8152 6.8515 6.8538 8.3621 8.3624 12.5986 12.6245 12.7031 12.7101 13.5737 13.5775 14.6568 14.6704 k = 0.4625 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3927 -46.3927 -24.0494 -24.0487 -21.9995 -21.9994 -21.9883 -21.9872 -18.9944 -18.9944 -8.5195 -8.5170 -7.5128 -7.5074 -7.4035 -7.4031 -2.7366 -2.7332 -2.5079 -2.5079 -2.4258 -2.4223 3.1590 3.1599 3.5795 3.5845 3.9511 3.9512 5.4726 5.4756 5.4957 5.4973 6.7564 6.7701 6.8156 6.8182 6.8415 6.8440 8.3702 8.3704 12.6235 12.6420 12.7111 12.7152 13.5904 13.5932 14.6552 14.6657 k = 0.4750 0.5000-0.0000 ( 2468 PWs) bands (ev): -46.3927 -46.3927 -24.0495 -24.0491 -22.0000 -22.0000 -21.9883 -21.9876 -18.9943 -18.9943 -8.5182 -8.5166 -7.5073 -7.5039 -7.3994 -7.3993 -2.7365 -2.7342 -2.5086 -2.5086 -2.4250 -2.4227 3.1493 3.1498 3.5694 3.5726 3.9431 3.9431 5.4700 5.4722 5.4922 5.4931 6.7651 6.7763 6.8158 6.8198 6.8344 6.8359 8.3759 8.3760 12.6404 12.6516 12.7193 12.7207 13.6026 13.6045 14.6545 14.6616 k = 0.4875 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3926 -46.3926 -24.0495 -24.0493 -22.0003 -22.0003 -21.9882 -21.9878 -18.9943 -18.9943 -8.5173 -8.5164 -7.5039 -7.5022 -7.3968 -7.3968 -2.7362 -2.7350 -2.5090 -2.5090 -2.4243 -2.4232 3.1432 3.1434 3.5638 3.5654 3.9382 3.9383 5.4686 5.4698 5.4903 5.4907 6.7729 6.7797 6.8151 6.8189 6.8307 6.8308 8.3793 8.3794 12.6503 12.6555 12.7251 12.7253 13.6102 13.6111 14.6548 14.6584 k = 0.5000 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3926 -46.3926 -24.0495 -24.0495 -22.0004 -22.0004 -21.9881 -21.9881 -18.9943 -18.9943 -8.5167 -8.5167 -7.5022 -7.5022 -7.3959 -7.3959 -2.7357 -2.7357 -2.5091 -2.5091 -2.4237 -2.4237 3.1412 3.1412 3.5625 3.5625 3.9366 3.9366 5.4685 5.4685 5.4898 5.4898 6.7784 6.7784 6.8162 6.8162 6.8296 6.8296 8.3805 8.3805 12.6550 12.6550 12.7272 12.7272 13.6131 13.6131 14.6561 14.6561 k = 0.5000 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3926 -46.3926 -24.0495 -24.0495 -22.0004 -22.0004 -21.9881 -21.9881 -18.9943 -18.9943 -8.5167 -8.5167 -7.5022 -7.5022 -7.3959 -7.3959 -2.7357 -2.7357 -2.5091 -2.5091 -2.4237 -2.4237 3.1412 3.1412 3.5625 3.5625 3.9366 3.9366 5.4685 5.4685 5.4898 5.4898 6.7784 6.7784 6.8162 6.8162 6.8296 6.8296 8.3805 8.3805 12.6550 12.6550 12.7272 12.7272 13.6131 13.6131 14.6561 14.6561 k = 0.4911 0.4911-0.0000 ( 2466 PWs) bands (ev): -46.3927 -46.3927 -24.0495 -24.0493 -22.0003 -22.0003 -21.9882 -21.9878 -18.9943 -18.9943 -8.5173 -8.5164 -7.5039 -7.5022 -7.3968 -7.3968 -2.7362 -2.7350 -2.5090 -2.5090 -2.4244 -2.4232 3.1432 3.1435 3.5638 3.5655 3.9383 3.9383 5.4686 5.4698 5.4903 5.4907 6.7728 6.7796 6.8151 6.8192 6.8305 6.8309 8.3793 8.3794 12.6504 12.6554 12.7251 12.7251 13.6102 13.6111 14.6548 14.6584 k = 0.4821 0.4821-0.0000 ( 2470 PWs) bands (ev): -46.3927 -46.3927 -24.0495 -24.0491 -22.0000 -22.0000 -21.9883 -21.9876 -18.9944 -18.9944 -8.5182 -8.5166 -7.5072 -7.5038 -7.3996 -7.3996 -2.7365 -2.7342 -2.5086 -2.5086 -2.4251 -2.4227 3.1496 3.1501 3.5694 3.5726 3.9432 3.9432 5.4701 5.4725 5.4922 5.4930 6.7645 6.7758 6.8168 6.8219 6.8334 6.8348 8.3758 8.3760 12.6414 12.6517 12.7189 12.7192 13.6024 13.6043 14.6545 14.6617 k = 0.4732 0.4732-0.0000 ( 2470 PWs) bands (ev): -46.3928 -46.3928 -24.0494 -24.0487 -21.9994 -21.9994 -21.9883 -21.9872 -18.9944 -18.9944 -8.5195 -8.5171 -7.5122 -7.5071 -7.4042 -7.4041 -2.7366 -2.7332 -2.5079 -2.5079 -2.4259 -2.4223 3.1604 3.1611 3.5791 3.5840 3.9515 3.9515 5.4728 5.4765 5.4956 5.4969 6.7547 6.7685 6.8195 6.8237 6.8385 6.8408 8.3700 8.3702 12.6280 12.6439 12.7086 12.7095 13.5898 13.5927 14.6552 14.6659 k = 0.4643 0.4643-0.0000 ( 2474 PWs) bands (ev): -46.3928 -46.3928 -24.0492 -24.0483 -21.9987 -21.9987 -21.9882 -21.9868 -18.9946 -18.9946 -8.5212 -8.5179 -7.5187 -7.5119 -7.4106 -7.4105 -2.7365 -2.7320 -2.5070 -2.5069 -2.4268 -2.4220 3.1754 3.1764 3.5930 3.5995 3.9630 3.9630 5.4767 5.4818 5.5005 5.5023 6.7439 6.7590 6.8221 6.8253 6.8456 6.8480 8.3620 8.3623 12.6101 12.6320 12.6941 12.6963 13.5725 13.5763 14.6569 14.6710 k = 0.4554 0.4554-0.0000 ( 2468 PWs) bands (ev): -46.3928 -46.3928 -24.0488 -24.0477 -21.9977 -21.9977 -21.9881 -21.9863 -18.9947 -18.9947 -8.5231 -8.5191 -7.5269 -7.5183 -7.4188 -7.4185 -2.7363 -2.7307 -2.5058 -2.5055 -2.4277 -2.4217 3.1947 3.1959 3.6109 3.6190 3.9779 3.9779 5.4817 5.4883 5.5070 5.5095 6.7321 6.7482 6.8246 6.8269 6.8542 6.8559 8.3517 8.3521 12.5878 12.6161 12.6759 12.6799 13.5504 13.5552 14.6595 14.6767 k = 0.4464 0.4464-0.0000 ( 2472 PWs) bands (ev): -46.3929 -46.3929 -24.0484 -24.0471 -21.9966 -21.9965 -21.9879 -21.9858 -18.9949 -18.9949 -8.5254 -8.5206 -7.5366 -7.5263 -7.4287 -7.4283 -2.7359 -2.7293 -2.5044 -2.5039 -2.4288 -2.4214 3.2182 3.2197 3.6329 3.6425 3.9961 3.9961 5.4877 5.4957 5.5152 5.5183 6.7197 6.7363 6.8270 6.8288 6.8637 6.8642 8.3393 8.3397 12.5609 12.5959 12.6539 12.6603 13.5238 13.5295 14.6628 14.6829 k = 0.4375 0.4375-0.0000 ( 2472 PWs) bands (ev): -46.3929 -46.3929 -24.0479 -24.0464 -21.9952 -21.9951 -21.9876 -21.9852 -18.9951 -18.9951 -8.5281 -8.5224 -7.5479 -7.5359 -7.4403 -7.4397 -2.7353 -2.7279 -2.5029 -2.5020 -2.4299 -2.4212 3.2459 3.2476 3.6588 3.6699 4.0177 4.0177 5.4946 5.5040 5.5253 5.5290 6.7065 6.7236 6.8295 6.8310 6.8729 6.8741 8.3248 8.3253 12.5298 12.5715 12.6288 12.6378 13.4926 13.4993 14.6666 14.6894 k = 0.4286 0.4286-0.0000 ( 2468 PWs) bands (ev): -46.3929 -46.3929 -24.0473 -24.0456 -21.9937 -21.9936 -21.9872 -21.9846 -18.9954 -18.9953 -8.5310 -8.5246 -7.5607 -7.5469 -7.4534 -7.4527 -2.7347 -2.7263 -2.5011 -2.4998 -2.4310 -2.4209 3.2776 3.2796 3.6884 3.7009 4.0427 4.0428 5.5024 5.5130 5.5374 5.5414 6.6927 6.7101 6.8324 6.8336 6.8822 6.8851 8.3083 8.3089 12.4946 12.5427 12.6007 12.6124 13.4571 13.4648 14.6709 14.6961 k = 0.4196 0.4196-0.0000 ( 2468 PWs) bands (ev): -46.3930 -46.3930 -24.0466 -24.0447 -21.9921 -21.9918 -21.9867 -21.9838 -18.9956 -18.9956 -8.5342 -8.5270 -7.5750 -7.5594 -7.4682 -7.4671 -2.7339 -2.7247 -2.4992 -2.4973 -2.4322 -2.4207 3.3133 3.3156 3.7216 3.7355 4.0711 4.0712 5.5110 5.5226 5.5513 5.5555 6.6784 6.6960 6.8355 6.8366 6.8919 6.8969 8.2899 8.2905 12.4554 12.5096 12.5701 12.5842 13.4173 13.4260 14.6753 14.7028 k = 0.4107 0.4107-0.0000 ( 2472 PWs) bands (ev): -46.3931 -46.3931 -24.0458 -24.0437 -21.9904 -21.9898 -21.9859 -21.9831 -18.9960 -18.9960 -8.5376 -8.5297 -7.5907 -7.5733 -7.4843 -7.4829 -2.7331 -2.7232 -2.4973 -2.4946 -2.4334 -2.4204 3.3529 3.3555 3.7583 3.7734 4.1029 4.1031 5.5203 5.5330 5.5671 5.5714 6.6636 6.6813 6.8390 6.8399 6.9023 6.9093 8.2696 8.2703 12.4126 12.4722 12.5370 12.5534 13.3734 13.3831 14.6798 14.7093 k = 0.4018 0.4018-0.0000 ( 2480 PWs) bands (ev): -46.3933 -46.3933 -24.0449 -24.0426 -21.9887 -21.9877 -21.9849 -21.9822 -18.9964 -18.9963 -8.5413 -8.5327 -7.6078 -7.5886 -7.5019 -7.5001 -2.7322 -2.7216 -2.4953 -2.4918 -2.4347 -2.4201 3.3963 3.3991 3.7982 3.8145 4.1383 4.1386 5.5305 5.5440 5.5847 5.5890 6.6484 6.6662 6.8429 6.8437 6.9133 6.9224 8.2476 8.2483 12.3664 12.4308 12.5016 12.5198 13.3255 13.3363 14.6842 14.7153 k = 0.3929 0.3929-0.0000 ( 2478 PWs) bands (ev): -46.3933 -46.3933 -24.0440 -24.0415 -21.9874 -21.9855 -21.9833 -21.9812 -18.9968 -18.9967 -8.5452 -8.5359 -7.6262 -7.6053 -7.5207 -7.5184 -2.7312 -2.7201 -2.4933 -2.4887 -2.4359 -2.4198 3.4434 3.4464 3.8412 3.8586 4.1772 4.1777 5.5414 5.5558 5.6039 5.6083 6.6330 6.6508 6.8472 6.8479 6.9250 6.9363 8.2240 8.2248 12.3172 12.3858 12.4640 12.4837 13.2740 13.2857 14.6882 14.7208 k = 0.3839 0.3839-0.0000 ( 2482 PWs) bands (ev): -46.3935 -46.3935 -24.0430 -24.0403 -21.9863 -21.9833 -21.9812 -21.9799 -18.9972 -18.9972 -8.5494 -8.5393 -7.6459 -7.6232 -7.5406 -7.5379 -2.7303 -2.7187 -2.4913 -2.4856 -2.4371 -2.4193 3.4940 3.4973 3.8869 3.9053 4.2198 4.2205 5.5530 5.5683 5.6248 5.6291 6.6174 6.6351 6.8520 6.8526 6.9374 6.9510 8.1988 8.1997 12.2652 12.3375 12.4241 12.4450 13.2188 13.2316 14.6918 14.7256 k = 0.3750 0.3750-0.0000 ( 2474 PWs) bands (ev): -46.3935 -46.3935 -24.0418 -24.0390 -21.9854 -21.9814 -21.9787 -21.9782 -18.9977 -18.9976 -8.5537 -8.5429 -7.6668 -7.6423 -7.5616 -7.5584 -2.7293 -2.7173 -2.4893 -2.4824 -2.4382 -2.4187 3.5480 3.5517 3.9353 3.9545 4.2660 4.2670 5.5654 5.5815 5.6472 5.6515 6.6017 6.6194 6.8572 6.8578 6.9507 6.9664 8.1724 8.1733 12.2108 12.2864 12.3819 12.4040 13.1603 13.1741 14.6947 14.7295 k = 0.3661 0.3661-0.0000 ( 2476 PWs) bands (ev): -46.3936 -46.3936 -24.0407 -24.0377 -21.9845 -21.9798 -21.9760 -21.9759 -18.9982 -18.9982 -8.5582 -8.5467 -7.6887 -7.6626 -7.5835 -7.5798 -2.7284 -2.7160 -2.4875 -2.4793 -2.4391 -2.4180 3.6053 3.6092 3.9861 4.0059 4.3158 4.3172 5.5784 5.5954 5.6711 5.6754 6.5862 6.6038 6.8630 6.8636 6.9647 6.9826 8.1446 8.1456 12.1541 12.2325 12.3375 12.3605 13.0986 13.1134 14.6968 14.7323 k = 0.3571 0.3571-0.0000 ( 2476 PWs) bands (ev): -46.3937 -46.3937 -24.0394 -24.0363 -21.9836 -21.9785 -21.9731 -21.9730 -18.9988 -18.9987 -8.5628 -8.5507 -7.7117 -7.6841 -7.6062 -7.6021 -2.7275 -2.7149 -2.4858 -2.4764 -2.4399 -2.4172 3.6657 3.6700 4.0390 4.0593 4.3694 4.3713 5.5920 5.6099 5.6964 5.7007 6.5708 6.5883 6.8694 6.8699 6.9795 6.9997 8.1158 8.1168 12.0955 12.1765 12.2910 12.3149 13.0338 13.0496 14.6978 14.7340 k = 0.3482 0.3482-0.0000 ( 2464 PWs) bands (ev): -46.3937 -46.3937 -24.0381 -24.0348 -21.9827 -21.9773 -21.9700 -21.9699 -18.9994 -18.9993 -8.5675 -8.5548 -7.7357 -7.7065 -7.6296 -7.6251 -2.7266 -2.7138 -2.4844 -2.4737 -2.4403 -2.4162 3.7290 3.7337 4.0939 4.1144 4.4267 4.4291 5.6063 5.6251 5.7231 5.7273 6.5558 6.5732 6.8763 6.8768 6.9952 7.0175 8.0860 8.0871 12.0352 12.1185 12.2424 12.2671 12.9663 12.9831 14.6979 14.7345 k = 0.3393 0.3393-0.0000 ( 2464 PWs) bands (ev): -46.3938 -46.3938 -24.0367 -24.0333 -21.9818 -21.9762 -21.9668 -21.9666 -19.0001 -19.0000 -8.5724 -8.5590 -7.7605 -7.7299 -7.6536 -7.6487 -2.7258 -2.7129 -2.4831 -2.4715 -2.4404 -2.4152 3.7952 3.8002 4.1505 4.1711 4.4877 4.4907 5.6212 5.6408 5.7510 5.7552 6.5413 6.5585 6.8839 6.8844 7.0117 7.0362 8.0553 8.0565 11.9735 12.0589 12.1918 12.2173 12.8960 12.9139 14.6968 14.7336 k = 0.3304 0.3304-0.0000 ( 2464 PWs) bands (ev): -46.3939 -46.3939 -24.0352 -24.0317 -21.9808 -21.9750 -21.9633 -21.9631 -19.0008 -19.0006 -8.5773 -8.5634 -7.7860 -7.7542 -7.6781 -7.6729 -2.7251 -2.7122 -2.4820 -2.4698 -2.4400 -2.4141 3.8640 3.8694 4.2087 4.2292 4.5522 4.5561 5.6366 5.6571 5.7801 5.7843 6.5273 6.5444 6.8922 6.8927 7.0290 7.0556 8.0240 8.0252 11.9107 11.9978 12.1393 12.1656 12.8234 12.8422 14.6943 14.7313 k = 0.3214 0.3214-0.0000 ( 2460 PWs) bands (ev): -46.3939 -46.3939 -24.0337 -24.0301 -21.9798 -21.9738 -21.9598 -21.9595 -19.0015 -19.0014 -8.5824 -8.5679 -7.8121 -7.7792 -7.7030 -7.6975 -2.7244 -2.7115 -2.4812 -2.4686 -2.4392 -2.4130 3.9353 3.9410 4.2683 4.2885 4.6203 4.6250 5.6526 5.6740 5.8103 5.8145 6.5140 6.5309 6.9012 6.9017 7.0471 7.0758 7.9921 7.9934 11.8470 11.9357 12.0852 12.1122 12.7485 12.7682 14.6905 14.7275 k = 0.3125 0.3125-0.0000 ( 2458 PWs) bands (ev): -46.3940 -46.3940 -24.0322 -24.0285 -21.9788 -21.9727 -21.9561 -21.9558 -19.0023 -19.0021 -8.5875 -8.5725 -7.8387 -7.8049 -7.7281 -7.7224 -2.7238 -2.7111 -2.4806 -2.4681 -2.4379 -2.4119 4.0089 4.0149 4.3291 4.3490 4.6919 4.6973 5.6692 5.6913 5.8415 5.8456 6.5016 6.5183 6.9109 6.9115 7.0660 7.0967 7.9598 7.9611 11.7826 11.8728 12.0294 12.0572 12.6714 12.6921 14.6853 14.7221 k = 0.3036 0.3036-0.0000 ( 2472 PWs) bands (ev): -46.3944 -46.3944 -24.0306 -24.0268 -21.9777 -21.9715 -21.9523 -21.9521 -19.0031 -19.0030 -8.5927 -8.5772 -7.8658 -7.8312 -7.7534 -7.7477 -2.7234 -2.7108 -2.4802 -2.4681 -2.4365 -2.4109 4.0845 4.0909 4.3912 4.4105 4.7666 4.7730 5.6862 5.7092 5.8736 5.8776 6.4901 6.5065 6.9215 6.9222 7.0857 7.1182 7.9273 7.9286 11.7177 11.8092 11.9721 12.0007 12.5925 12.6141 14.6785 14.7150 k = 0.2946 0.2946-0.0000 ( 2474 PWs) bands (ev): -46.3945 -46.3945 -24.0290 -24.0251 -21.9766 -21.9703 -21.9484 -21.9482 -19.0040 -19.0038 -8.5980 -8.5820 -7.8931 -7.8578 -7.7789 -7.7731 -2.7231 -2.7106 -2.4800 -2.4684 -2.4348 -2.4100 4.1619 4.1688 4.4543 4.4730 4.8445 4.8517 5.7037 5.7274 5.9064 5.9104 6.4796 6.4957 6.9331 6.9338 7.1060 7.1404 7.8947 7.8960 11.6526 11.7453 11.9136 11.9429 12.5118 12.5344 14.6702 14.7064 k = 0.2857 0.2857-0.0000 ( 2466 PWs) bands (ev): -46.3945 -46.3945 -24.0273 -24.0234 -21.9754 -21.9690 -21.9444 -21.9442 -19.0049 -19.0047 -8.6033 -8.5869 -7.9205 -7.8848 -7.8044 -7.7987 -2.7228 -2.7105 -2.4798 -2.4691 -2.4332 -2.4092 4.2411 4.2483 4.5185 4.5365 4.9252 4.9332 5.7216 5.7462 5.9398 5.9437 6.4702 6.4861 6.9455 6.9463 7.1269 7.1631 7.8621 7.8634 11.5877 11.6814 11.8540 11.8840 12.4294 12.4530 14.6604 14.6961 k = 0.2768 0.2768-0.0000 ( 2464 PWs) bands (ev): -46.3946 -46.3946 -24.0256 -24.0217 -21.9743 -21.9678 -21.9404 -21.9402 -19.0058 -19.0056 -8.6087 -8.5919 -7.9480 -7.9119 -7.8299 -7.8243 -2.7226 -2.7106 -2.4799 -2.4699 -2.4317 -2.4087 4.3216 4.3293 4.5837 4.6008 5.0086 5.0174 5.7400 5.7653 5.9736 5.9776 6.4620 6.4775 6.9590 6.9599 7.1484 7.1863 7.8297 7.8310 11.5231 11.6177 11.7934 11.8242 12.3457 12.3702 14.6490 14.6842 k = 0.2679 0.2679-0.0000 ( 2464 PWs) bands (ev): -46.3948 -46.3948 -24.0239 -24.0199 -21.9730 -21.9665 -21.9363 -21.9361 -19.0068 -19.0066 -8.6142 -8.5971 -7.9753 -7.9390 -7.8553 -7.8499 -2.7226 -2.7108 -2.4800 -2.4708 -2.4304 -2.4085 4.4034 4.4115 4.6497 4.6659 5.0945 5.1039 5.7588 5.7848 6.0078 6.0117 6.4550 6.4703 6.9735 6.9746 7.1703 7.2098 7.7977 7.7990 11.4589 11.5543 11.7321 11.7635 12.2606 12.2861 14.6361 14.6706 k = 0.2589 0.2589-0.0000 ( 2464 PWs) bands (ev): -46.3949 -46.3949 -24.0222 -24.0182 -21.9718 -21.9653 -21.9322 -21.9320 -19.0078 -19.0076 -8.6198 -8.6024 -8.0023 -7.9660 -7.8806 -7.8754 -2.7226 -2.7112 -2.4803 -2.4719 -2.4294 -2.4086 4.4860 4.4947 4.7166 4.7318 5.1825 5.1926 5.7780 5.8047 6.0420 6.0459 6.4495 6.4643 6.9891 6.9904 7.1926 7.2335 7.7661 7.7674 11.3955 11.4916 11.6702 11.7024 12.1744 12.2009 14.6216 14.6554 k = 0.2500 0.2500-0.0000 ( 2464 PWs) bands (ev): -46.3950 -46.3950 -24.0204 -24.0164 -21.9706 -21.9641 -21.9280 -21.9279 -19.0089 -19.0086 -8.6255 -8.6078 -8.0290 -7.9927 -7.9056 -7.9007 -2.7228 -2.7116 -2.4806 -2.4729 -2.4288 -2.4091 4.5694 4.5786 4.7843 4.7983 5.2726 5.2831 5.7974 5.8249 6.0763 6.0802 6.4453 6.4597 7.0058 7.0073 7.2151 7.2574 7.7352 7.7364 11.3331 11.4298 11.6079 11.6408 12.0871 12.1147 14.6056 14.6386 k = 0.2411 0.2411-0.0000 ( 2454 PWs) bands (ev): -46.3950 -46.3950 -24.0186 -24.0146 -21.9693 -21.9628 -21.9239 -21.9237 -19.0099 -19.0096 -8.6313 -8.6134 -8.0552 -8.0191 -7.9304 -7.9257 -2.7230 -2.7122 -2.4809 -2.4740 -2.4285 -2.4099 4.6531 4.6629 4.8527 4.8655 5.3643 5.3753 5.8172 5.8454 6.1103 6.1142 6.4427 6.4565 7.0237 7.0254 7.2377 7.2812 7.7052 7.7063 11.2719 11.3691 11.5456 11.5792 11.9990 12.0276 14.5881 14.6203 k = 0.2321 0.2321-0.0000 ( 2460 PWs) bands (ev): -46.3952 -46.3952 -24.0169 -24.0129 -21.9680 -21.9616 -21.9197 -21.9195 -19.0110 -19.0107 -8.6372 -8.6193 -8.0807 -8.0449 -7.9549 -7.9505 -2.7234 -2.7130 -2.4813 -2.4751 -2.4287 -2.4111 4.7368 4.7473 4.9218 4.9333 5.4575 5.4687 5.8373 5.8663 6.1439 6.1478 6.4416 6.4549 7.0427 7.0447 7.2602 7.3049 7.6761 7.6772 11.2120 11.3097 11.4833 11.5175 11.9102 11.9399 14.5692 14.6005 k = 0.2232 0.2232-0.0000 ( 2460 PWs) bands (ev): -46.3954 -46.3954 -24.0151 -24.0112 -21.9667 -21.9604 -21.9155 -21.9154 -19.0121 -19.0118 -8.6433 -8.6253 -8.1054 -8.0701 -7.9790 -7.9749 -2.7239 -2.7138 -2.4817 -2.4761 -2.4293 -2.4127 4.8202 4.8315 4.9915 5.0015 5.5519 5.5629 5.8577 5.8876 6.1770 6.1809 6.4421 6.4548 7.0627 7.0651 7.2825 7.3282 7.6483 7.6491 11.1538 11.2518 11.4213 11.4562 11.8207 11.8516 14.5489 14.5793 k = 0.2143 0.2143-0.0000 ( 2448 PWs) bands (ev): -46.3953 -46.3953 -24.0134 -24.0095 -21.9654 -21.9592 -21.9114 -21.9113 -19.0132 -19.0129 -8.6495 -8.6316 -8.1293 -8.0945 -8.0027 -7.9989 -2.7244 -2.7148 -2.4821 -2.4770 -2.4302 -2.4146 4.9030 4.9152 5.0617 5.0701 5.6468 5.6573 5.8786 5.9098 6.2094 6.2133 6.4444 6.4563 7.0837 7.0865 7.3045 7.3510 7.6218 7.6225 11.0973 11.1956 11.3600 11.3953 11.7308 11.7630 14.5274 14.5569 k = 0.2054 0.2054-0.0000 ( 2444 PWs) bands (ev): -46.3954 -46.3954 -24.0117 -24.0078 -21.9641 -21.9580 -21.9073 -21.9072 -19.0144 -19.0140 -8.6560 -8.6382 -8.1521 -8.1180 -8.0258 -8.0223 -2.7251 -2.7159 -2.4825 -2.4780 -2.4316 -2.4169 4.9847 4.9978 5.1325 5.1391 5.7415 5.7504 5.9005 5.9338 6.2410 6.2449 6.4484 6.4594 7.1053 7.1087 7.3259 7.3731 7.5970 7.5974 11.0428 11.1412 11.2995 11.3352 11.6406 11.6743 14.5047 14.5332 k = 0.1964 0.1964-0.0000 ( 2442 PWs) bands (ev): -46.3955 -46.3955 -24.0099 -24.0062 -21.9629 -21.9568 -21.9032 -21.9031 -19.0155 -19.0151 -8.6626 -8.6451 -8.1739 -8.1406 -8.0485 -8.0452 -2.7259 -2.7171 -2.4829 -2.4788 -2.4334 -2.4196 5.0650 5.0790 5.2037 5.2084 5.8326 5.8384 5.9266 5.9634 6.2717 6.2756 6.4542 6.4643 7.1274 7.1315 7.3465 7.3944 7.5741 7.5742 10.9903 11.0889 11.2402 11.2761 11.5503 11.5857 14.4809 14.5084 k = 0.1875 0.1875-0.0000 ( 2446 PWs) bands (ev): -46.3957 -46.3957 -24.0083 -24.0046 -21.9616 -21.9557 -21.8993 -21.8992 -19.0167 -19.0163 -8.6695 -8.6522 -8.1945 -8.1622 -8.0705 -8.0676 -2.7267 -2.7184 -2.4833 -2.4797 -2.4355 -2.4226 5.1433 5.1583 5.2753 5.2781 5.9038 5.9090 5.9726 6.0102 6.3014 6.3055 6.4618 6.4710 7.1496 7.1545 7.3662 7.4145 7.5531 7.5534 10.9399 11.0386 11.1824 11.2182 11.4601 11.4975 14.4561 14.4825 k = 0.1786 0.1786-0.0000 ( 2446 PWs) bands (ev): -46.3958 -46.3958 -24.0066 -24.0030 -21.9603 -21.9546 -21.8954 -21.8953 -19.0178 -19.0174 -8.6765 -8.6597 -8.2139 -8.1826 -8.0919 -8.0892 -2.7277 -2.7198 -2.4837 -2.4804 -2.4380 -2.4259 5.2194 5.2352 5.3471 5.3480 5.9390 5.9513 6.0544 6.0851 6.3303 6.3343 6.4713 6.4796 7.1713 7.1771 7.3846 7.4333 7.5347 7.5354 10.8918 10.9904 11.1263 11.1616 11.3704 11.4101 14.4305 14.4559 k = 0.1696 0.1696-0.0000 ( 2446 PWs) bands (ev): -46.3959 -46.3959 -24.0050 -24.0015 -21.9591 -21.9535 -21.8916 -21.8915 -19.0189 -19.0185 -8.6838 -8.6675 -8.2319 -8.2018 -8.1125 -8.1101 -2.7287 -2.7213 -2.4840 -2.4811 -2.4407 -2.4295 5.2929 5.3093 5.4179 5.4187 5.9616 5.9777 6.1480 6.1751 6.3583 6.3624 6.4826 6.4900 7.1918 7.1988 7.4016 7.4507 7.5194 7.5205 10.8459 10.9442 11.0723 11.1066 11.2815 11.3240 14.4042 14.4285 k = 0.1607 0.1607-0.0000 ( 2444 PWs) bands (ev): -46.3960 -46.3960 -24.0034 -24.0000 -21.9578 -21.9525 -21.8879 -21.8878 -19.0200 -19.0196 -8.6912 -8.6756 -8.2485 -8.2198 -8.1324 -8.1303 -2.7299 -2.7228 -2.4843 -2.4818 -2.4436 -2.4332 5.3635 5.3802 5.4877 5.4900 5.9809 5.9984 6.2438 6.2697 6.3857 6.3898 6.4958 6.5024 7.2104 7.2186 7.4167 7.4664 7.5080 7.5093 10.8019 10.8996 11.0208 11.0531 11.1941 11.2400 14.3773 14.4005 k = 0.1518 0.1518-0.0000 ( 2448 PWs) bands (ev): -46.3961 -46.3961 -24.0019 -23.9986 -21.9566 -21.9515 -21.8843 -21.8842 -19.0211 -19.0208 -8.6988 -8.6839 -8.2639 -8.2365 -8.1516 -8.1497 -2.7311 -2.7245 -2.4846 -2.4824 -2.4468 -2.4371 5.4312 5.4477 5.5569 5.5602 5.9987 6.0164 6.3387 6.3652 6.4128 6.4173 6.5107 6.5170 7.2261 7.2357 7.4297 7.4801 7.5013 7.5026 10.7595 10.8560 10.9722 11.0009 11.1090 11.1593 14.3501 14.3721 k = 0.1429 0.1429-0.0000 ( 2452 PWs) bands (ev): -46.3963 -46.3963 -24.0005 -23.9973 -21.9555 -21.9505 -21.8808 -21.8808 -19.0222 -19.0218 -8.7065 -8.6925 -8.2778 -8.2520 -8.1698 -8.1682 -2.7323 -2.7262 -2.4849 -2.4829 -2.4501 -2.4412 5.4956 5.5117 5.6248 5.6289 6.0155 6.0328 6.4245 6.4370 6.4515 6.4634 6.5272 6.5348 7.2384 7.2493 7.4402 7.4910 7.4999 7.5013 10.7181 10.8120 10.9268 10.9496 11.0276 11.0834 14.3225 14.3434 k = 0.1339 0.1339-0.0000 ( 2452 PWs) bands (ev): -46.3964 -46.3964 -23.9990 -23.9960 -21.9543 -21.9496 -21.8775 -21.8775 -19.0233 -19.0229 -8.7143 -8.7011 -8.2904 -8.2662 -8.1872 -8.1858 -2.7336 -2.7279 -2.4851 -2.4834 -2.4535 -2.4453 5.5568 5.5721 5.6909 5.6954 6.0314 6.0478 6.4637 6.4643 6.5211 6.5447 6.5581 6.5641 7.2468 7.2588 7.4484 7.4980 7.5037 7.5063 10.6766 10.7655 10.8853 10.8988 10.9525 11.0146 14.2950 14.3147 k = 0.1250 0.1250-0.0000 ( 2448 PWs) bands (ev): -46.3964 -46.3964 -23.9977 -23.9948 -21.9532 -21.9488 -21.8744 -21.8743 -19.0243 -19.0239 -8.7220 -8.7099 -8.3016 -8.2791 -8.2037 -8.2025 -2.7350 -2.7297 -2.4853 -2.4838 -2.4569 -2.4494 5.6145 5.6288 5.7544 5.7592 6.0465 6.0619 6.4907 6.4907 6.5593 6.5645 6.6370 6.6516 7.2515 7.2643 7.4550 7.5046 7.5113 7.5138 10.6333 10.7132 10.8480 10.8484 10.8866 10.9551 14.2675 14.2861 k = 0.1161 0.1161-0.0000 ( 2452 PWs) bands (ev): -46.3966 -46.3966 -23.9964 -23.9937 -21.9522 -21.9480 -21.8714 -21.8714 -19.0252 -19.0249 -8.7298 -8.7186 -8.3117 -8.2909 -8.2192 -8.2181 -2.7363 -2.7315 -2.4855 -2.4842 -2.4603 -2.4535 5.6685 5.6818 5.8146 5.8195 6.0609 6.0751 6.5170 6.5174 6.5823 6.5851 6.7253 6.7435 7.2531 7.2665 7.4606 7.5123 7.5210 7.5214 10.5862 10.6531 10.8001 10.8149 10.8327 10.9055 14.2404 14.2578 k = 0.1071 0.1071-0.0000 ( 2453 PWs) bands (ev): -46.3967 -46.3967 -23.9952 -23.9927 -21.9512 -21.9473 -21.8686 -21.8686 -19.0261 -19.0258 -8.7374 -8.7271 -8.3205 -8.3014 -8.2337 -8.2328 -2.7377 -2.7333 -2.4856 -2.4845 -2.4636 -2.4575 5.7186 5.7307 5.8711 5.8758 6.0748 6.0876 6.5436 6.5446 6.6044 6.6066 6.8133 6.8330 7.2525 7.2661 7.4651 7.5190 7.5291 7.5326 10.5338 10.5860 10.7570 10.7836 10.7931 10.8648 14.2139 14.2301 k = 0.0982 0.0982-0.0000 ( 2453 PWs) bands (ev): -46.3968 -46.3968 -23.9940 -23.9917 -21.9502 -21.9466 -21.8659 -21.8659 -19.0270 -19.0267 -8.7447 -8.7355 -8.3282 -8.3109 -8.2472 -8.2465 -2.7390 -2.7350 -2.4858 -2.4849 -2.4668 -2.4613 5.7645 5.7754 5.9234 5.9277 6.0883 6.0995 6.5708 6.5722 6.6268 6.6289 6.8985 6.9194 7.2505 7.2641 7.4685 7.5228 7.5390 7.5440 10.4759 10.5147 10.7213 10.7514 10.7676 10.8314 14.1882 14.2032 k = 0.0893 0.0893-0.0000 ( 2461 PWs) bands (ev): -46.3970 -46.3970 -23.9930 -23.9908 -21.9493 -21.9460 -21.8635 -21.8635 -19.0278 -19.0275 -8.7518 -8.7435 -8.3348 -8.3193 -8.2596 -8.2590 -2.7404 -2.7368 -2.4859 -2.4851 -2.4699 -2.4650 5.8059 5.8156 5.9711 5.9749 6.1013 6.1109 6.5984 6.6003 6.6497 6.6517 6.9800 7.0017 7.2478 7.2613 7.4709 7.5245 7.5491 7.5547 10.4140 10.4424 10.6932 10.7237 10.7485 10.8039 14.1634 14.1772 k = 0.0804 0.0804-0.0000 ( 2465 PWs) bands (ev): -46.3971 -46.3971 -23.9920 -23.9900 -21.9485 -21.9455 -21.8613 -21.8613 -19.0285 -19.0283 -8.7584 -8.7511 -8.3405 -8.3267 -8.2709 -8.2705 -2.7416 -2.7384 -2.4860 -2.4854 -2.4728 -2.4685 5.8426 5.8512 6.0140 6.0172 6.1139 6.1220 6.6264 6.6287 6.6728 6.6746 7.0565 7.0790 7.2450 7.2582 7.4726 7.5251 7.5584 7.5642 10.3506 10.3713 10.6715 10.7007 10.7334 10.7812 14.1400 14.1525 k = 0.0714 0.0714-0.0000 ( 2467 PWs) bands (ev): -46.3972 -46.3972 -23.9911 -23.9893 -21.9477 -21.9450 -21.8593 -21.8593 -19.0292 -19.0290 -8.7646 -8.7582 -8.3453 -8.3331 -8.2811 -8.2808 -2.7428 -2.7400 -2.4860 -2.4856 -2.4755 -2.4718 5.8746 5.8820 6.0521 6.0545 6.1262 6.1326 6.6542 6.6569 6.6958 6.6973 7.1267 7.1499 7.2425 7.2553 7.4744 7.5254 7.5661 7.5720 10.2879 10.3029 10.6552 10.6820 10.7216 10.7627 14.1181 14.1294 k = 0.0625 0.0625-0.0000 ( 2469 PWs) bands (ev): -46.3973 -46.3973 -23.9903 -23.9887 -21.9470 -21.9446 -21.8575 -21.8575 -19.0298 -19.0296 -8.7702 -8.7647 -8.3493 -8.3388 -8.2902 -8.2900 -2.7439 -2.7415 -2.4861 -2.4858 -2.4778 -2.4747 5.9017 5.9082 6.0853 6.0870 6.1378 6.1427 6.6813 6.6844 6.7184 6.7193 7.1891 7.2125 7.2407 7.2530 7.4775 7.5265 7.5720 7.5780 10.2277 10.2386 10.6430 10.6669 10.7128 10.7478 14.0980 14.1080 k = 0.0536 0.0536-0.0000 ( 2469 PWs) bands (ev): -46.3973 -46.3973 -23.9895 -23.9882 -21.9464 -21.9443 -21.8559 -21.8559 -19.0304 -19.0302 -8.7752 -8.7706 -8.3525 -8.3436 -8.2981 -8.2980 -2.7449 -2.7428 -2.4861 -2.4860 -2.4799 -2.4774 5.9243 5.9297 6.1139 6.1147 6.1487 6.1521 6.7069 6.7105 6.7402 6.7403 7.2361 7.2456 7.2497 7.2661 7.4836 7.5295 7.5763 7.5822 10.1718 10.1796 10.6343 10.6549 10.7065 10.7359 14.0796 14.0881 k = 0.0446 0.0446-0.0000 ( 2473 PWs) bands (ev): -46.3974 -46.3974 -23.9889 -23.9878 -21.9458 -21.9440 -21.8546 -21.8546 -19.0308 -19.0306 -8.7795 -8.7757 -8.3550 -8.3476 -8.3048 -8.3048 -2.7457 -2.7440 -2.4862 -2.4861 -2.4816 -2.4797 5.9425 5.9470 6.1378 6.1378 6.1586 6.1605 6.7302 6.7341 6.7597 6.7606 7.2381 7.2487 7.2853 7.3051 7.4943 7.5351 7.5793 7.5851 10.1215 10.1271 10.6282 10.6456 10.7022 10.7265 14.0326 14.0426 k = 0.0357 0.0357-0.0000 ( 2473 PWs) bands (ev): -46.3974 -46.3974 -23.9883 -23.9874 -21.9453 -21.9439 -21.8535 -21.8535 -19.0312 -19.0310 -8.7830 -8.7800 -8.3568 -8.3510 -8.3104 -8.3103 -2.7464 -2.7451 -2.4864 -2.4862 -2.4830 -2.4816 5.9568 5.9604 6.1561 6.1573 6.1676 6.1678 6.7503 6.7544 6.7772 6.7788 7.2385 7.2476 7.3158 7.3313 7.5097 7.5430 7.5818 7.5872 10.0783 10.0822 10.6244 10.6383 10.6998 10.7191 13.9822 13.9907 k = 0.0268 0.0268-0.0000 ( 2485 PWs) bands (ev): -46.3976 -46.3976 -23.9879 -23.9872 -21.9448 -21.9438 -21.8526 -21.8526 -19.0315 -19.0314 -8.7857 -8.7835 -8.3581 -8.3538 -8.3147 -8.3147 -2.7470 -2.7460 -2.4866 -2.4862 -2.4840 -2.4832 5.9675 5.9702 6.1688 6.1723 6.1738 6.1763 6.7668 6.7706 6.7921 6.7940 7.2394 7.2467 7.3357 7.3462 7.5268 7.5512 7.5849 7.5893 10.0432 10.0458 10.6222 10.6328 10.6988 10.7133 13.9424 13.9490 k = 0.0179 0.0179-0.0000 ( 2501 PWs) bands (ev): -46.3979 -46.3979 -23.9876 -23.9871 -21.9445 -21.9438 -21.8520 -21.8520 -19.0317 -19.0316 -8.7876 -8.7861 -8.3587 -8.3559 -8.3178 -8.3178 -2.7473 -2.7467 -2.4868 -2.4863 -2.4847 -2.4844 5.9750 5.9768 6.1758 6.1778 6.1833 6.1847 6.7792 6.7821 6.8037 6.8053 7.2407 7.2458 7.3475 7.3535 7.5415 7.5565 7.5895 7.5920 10.0174 10.0190 10.6215 10.6285 10.6990 10.7086 13.9139 13.9184 k = 0.0089 0.0089-0.0000 ( 2497 PWs) bands (ev): -46.3978 -46.3978 -23.9873 -23.9871 -21.9442 -21.9438 -21.8516 -21.8516 -19.0318 -19.0318 -8.7886 -8.7878 -8.3588 -8.3574 -8.3197 -8.3197 -2.7475 -2.7471 -2.4868 -2.4864 -2.4851 -2.4850 5.9796 5.9805 6.1795 6.1803 6.1899 6.1904 6.7871 6.7887 6.8113 6.8122 7.2422 7.2448 7.3536 7.3563 7.5511 7.5579 7.5941 7.5949 10.0017 10.0025 10.6219 10.6254 10.7002 10.7051 13.8972 13.8994 k = 0.0000 0.0000 0.0000 ( 2501 PWs) bands (ev): -46.3979 -46.3979 -23.9871 -23.9871 -21.9440 -21.9440 -21.8515 -21.8515 -19.0318 -19.0318 -8.7887 -8.7887 -8.3584 -8.3584 -8.3203 -8.3203 -2.7474 -2.7474 -2.4867 -2.4867 -2.4852 -2.4852 5.9814 5.9814 6.1809 6.1809 6.1922 6.1922 6.7903 6.7903 6.8142 6.8142 7.2436 7.2436 7.3563 7.3563 7.5562 7.5562 7.5961 7.5961 9.9966 9.9966 10.6232 10.6232 10.7022 10.7022 13.8923 13.8923 k = 0.0000 0.0000 0.0000 ( 2501 PWs) bands (ev): -46.3979 -46.3979 -23.9871 -23.9871 -21.9440 -21.9440 -21.8515 -21.8515 -19.0318 -19.0318 -8.7887 -8.7887 -8.3584 -8.3584 -8.3203 -8.3203 -2.7474 -2.7474 -2.4867 -2.4867 -2.4852 -2.4852 5.9814 5.9814 6.1809 6.1809 6.1922 6.1922 6.7903 6.7903 6.8142 6.8142 7.2436 7.2436 7.3563 7.3563 7.5562 7.5562 7.5961 7.5961 9.9966 9.9966 10.6232 10.6232 10.7022 10.7022 13.8923 13.8923 k = 0.0000 0.0000 0.0126 ( 2501 PWs) bands (ev): -46.3979 -46.3979 -23.9872 -23.9872 -21.9441 -21.9441 -21.8515 -21.8515 -19.0318 -19.0318 -8.7881 -8.7881 -8.3578 -8.3578 -8.3203 -8.3203 -2.7473 -2.7473 -2.4865 -2.4865 -2.4852 -2.4852 5.9794 5.9794 6.1777 6.1777 6.1911 6.1911 6.7887 6.7887 6.8127 6.8127 7.2429 7.2429 7.3528 7.3528 7.5564 7.5564 7.5964 7.5964 9.9968 9.9968 10.6267 10.6267 10.7057 10.7057 13.8923 13.8923 k = 0.0000 0.0000 0.0252 ( 2493 PWs) bands (ev): -46.3978 -46.3978 -23.9873 -23.9873 -21.9445 -21.9445 -21.8515 -21.8515 -19.0317 -19.0317 -8.7864 -8.7864 -8.3559 -8.3559 -8.3202 -8.3202 -2.7469 -2.7469 -2.4860 -2.4860 -2.4850 -2.4850 5.9730 5.9730 6.1683 6.1683 6.1880 6.1880 6.7840 6.7840 6.8084 6.8084 7.2407 7.2407 7.3423 7.3423 7.5568 7.5568 7.5973 7.5973 9.9974 9.9974 10.6371 10.6371 10.7160 10.7160 13.8925 13.8925 k = 0.0000 0.0000 0.0378 ( 2497 PWs) bands (ev): -46.3978 -46.3978 -23.9876 -23.9876 -21.9452 -21.9452 -21.8515 -21.8515 -19.0315 -19.0315 -8.7837 -8.7837 -8.3527 -8.3527 -8.3200 -8.3200 -2.7464 -2.7464 -2.4852 -2.4852 -2.4848 -2.4848 5.9617 5.9617 6.1532 6.1532 6.1828 6.1828 6.7762 6.7762 6.8014 6.8014 7.2372 7.2372 7.3252 7.3252 7.5576 7.5576 7.5986 7.5986 9.9983 9.9983 10.6542 10.6542 10.7329 10.7329 13.8927 13.8927 k = 0.0000 0.0000 0.0504 ( 2489 PWs) bands (ev): -46.3977 -46.3977 -23.9879 -23.9879 -21.9462 -21.9462 -21.8514 -21.8514 -19.0312 -19.0312 -8.7801 -8.7801 -8.3481 -8.3481 -8.3198 -8.3198 -2.7456 -2.7456 -2.4845 -2.4845 -2.4840 -2.4840 5.9445 5.9445 6.1334 6.1334 6.1755 6.1755 6.7657 6.7657 6.7919 6.7919 7.2323 7.2323 7.3022 7.3022 7.5586 7.5586 7.6004 7.6004 9.9995 9.9995 10.6780 10.6780 10.7565 10.7565 13.8931 13.8931 k = 0.0000 0.0000 0.0630 ( 2489 PWs) bands (ev): -46.3976 -46.3976 -23.9883 -23.9883 -21.9474 -21.9474 -21.8513 -21.8513 -19.0308 -19.0308 -8.7756 -8.7756 -8.3420 -8.3420 -8.3195 -8.3195 -2.7447 -2.7447 -2.4840 -2.4840 -2.4825 -2.4825 5.9199 5.9199 6.1104 6.1104 6.1661 6.1661 6.7526 6.7526 6.7801 6.7801 7.2261 7.2261 7.2740 7.2740 7.5598 7.5598 7.6024 7.6024 10.0011 10.0011 10.7081 10.7081 10.7864 10.7864 13.8935 13.8935 k = 0.0000 0.0000 0.0757 ( 2497 PWs) bands (ev): -46.3977 -46.3977 -23.9889 -23.9889 -21.9489 -21.9489 -21.8513 -21.8513 -19.0304 -19.0304 -8.7704 -8.7704 -8.3343 -8.3343 -8.3192 -8.3192 -2.7436 -2.7436 -2.4836 -2.4836 -2.4808 -2.4808 5.8862 5.8862 6.0859 6.0859 6.1546 6.1546 6.7372 6.7372 6.7664 6.7664 7.2185 7.2185 7.2415 7.2415 7.5612 7.5612 7.6048 7.6048 10.0030 10.0030 10.7443 10.7443 10.8224 10.8224 13.8940 13.8940 k = 0.0000 0.0000 0.0883 ( 2497 PWs) bands (ev): -46.3977 -46.3977 -23.9895 -23.9895 -21.9506 -21.9506 -21.8512 -21.8512 -19.0299 -19.0299 -8.7647 -8.7647 -8.3250 -8.3250 -8.3188 -8.3188 -2.7423 -2.7423 -2.4830 -2.4830 -2.4787 -2.4787 5.8419 5.8419 6.0615 6.0615 6.1410 6.1410 6.7201 6.7201 6.7513 6.7513 7.2056 7.2056 7.2098 7.2098 7.5627 7.5627 7.6073 7.6073 10.0052 10.0052 10.7864 10.7864 10.8642 10.8642 13.8946 13.8946 k = 0.0000 0.0000 0.1009 ( 2501 PWs) bands (ev): -46.3977 -46.3977 -23.9902 -23.9902 -21.9525 -21.9525 -21.8511 -21.8511 -19.0293 -19.0293 -8.7588 -8.7588 -8.3184 -8.3184 -8.3138 -8.3138 -2.7408 -2.7408 -2.4824 -2.4824 -2.4763 -2.4763 5.7866 5.7866 6.0379 6.0379 6.1253 6.1253 6.7014 6.7014 6.7349 6.7349 7.1673 7.1673 7.1999 7.1999 7.5641 7.5641 7.6098 7.6098 10.0077 10.0077 10.8338 10.8338 10.9114 10.9114 13.8952 13.8952 k = 0.0000 0.0000 0.1135 ( 2493 PWs) bands (ev): -46.3975 -46.3975 -23.9910 -23.9910 -21.9547 -21.9547 -21.8510 -21.8510 -19.0287 -19.0287 -8.7527 -8.7527 -8.3179 -8.3179 -8.3007 -8.3007 -2.7391 -2.7391 -2.4816 -2.4816 -2.4736 -2.4736 5.7206 5.7206 6.0152 6.0152 6.1077 6.1077 6.6816 6.6816 6.7178 6.7178 7.1274 7.1274 7.1889 7.1889 7.5655 7.5655 7.6123 7.6123 10.0104 10.0104 10.8864 10.8864 10.9637 10.9637 13.8960 13.8960 k = 0.0000 0.0000 0.1261 ( 2477 PWs) bands (ev): -46.3973 -46.3973 -23.9918 -23.9918 -21.9571 -21.9571 -21.8508 -21.8508 -19.0280 -19.0280 -8.7467 -8.7467 -8.3173 -8.3173 -8.2856 -8.2856 -2.7373 -2.7373 -2.4808 -2.4808 -2.4706 -2.4706 5.6447 5.6447 5.9930 5.9930 6.0881 6.0881 6.6610 6.6610 6.7001 6.7001 7.0866 7.0866 7.1770 7.1770 7.5668 7.5668 7.6147 7.6147 10.0135 10.0135 10.9436 10.9436 11.0207 11.0207 13.8968 13.8968 k = 0.0000 0.0000 0.1387 ( 2481 PWs) bands (ev): -46.3973 -46.3973 -23.9928 -23.9928 -21.9596 -21.9596 -21.8507 -21.8507 -19.0272 -19.0272 -8.7410 -8.7410 -8.3167 -8.3167 -8.2683 -8.2683 -2.7353 -2.7353 -2.4799 -2.4799 -2.4674 -2.4674 5.5602 5.5602 5.9708 5.9708 6.0668 6.0668 6.6399 6.6399 6.6822 6.6822 7.0455 7.0455 7.1641 7.1641 7.5679 7.5679 7.6169 7.6169 10.0167 10.0167 11.0049 11.0049 11.0818 11.0818 13.8976 13.8976 k = 0.0000 0.0000 0.1513 ( 2473 PWs) bands (ev): -46.3971 -46.3971 -23.9937 -23.9937 -21.9623 -21.9623 -21.8505 -21.8505 -19.0264 -19.0264 -8.7357 -8.7357 -8.3161 -8.3161 -8.2488 -8.2488 -2.7333 -2.7333 -2.4790 -2.4790 -2.4639 -2.4639 5.4683 5.4683 5.9484 5.9484 6.0437 6.0437 6.6186 6.6186 6.6644 6.6644 7.0046 7.0046 7.1504 7.1504 7.5687 7.5687 7.6189 7.6189 10.0202 10.0202 11.0701 11.0701 11.1468 11.1468 13.8985 13.8985 k = 0.0000 0.0000 0.1639 ( 2465 PWs) bands (ev): -46.3969 -46.3969 -23.9948 -23.9948 -21.9652 -21.9652 -21.8504 -21.8504 -19.0256 -19.0256 -8.7309 -8.7309 -8.3154 -8.3154 -8.2273 -8.2273 -2.7311 -2.7311 -2.4781 -2.4781 -2.4602 -2.4602 5.3699 5.3699 5.9254 5.9254 6.0192 6.0192 6.5975 6.5975 6.6468 6.6468 6.9642 6.9642 7.1361 7.1361 7.5694 7.5694 7.6207 7.6207 10.0238 10.0238 11.1385 11.1385 11.2151 11.2151 13.8994 13.8994 k = 0.0000 0.0000 0.1765 ( 2465 PWs) bands (ev): -46.3969 -46.3969 -23.9959 -23.9959 -21.9682 -21.9682 -21.8502 -21.8502 -19.0247 -19.0247 -8.7267 -8.7267 -8.3147 -8.3147 -8.2036 -8.2036 -2.7289 -2.7289 -2.4770 -2.4770 -2.4563 -2.4563 5.2664 5.2664 5.9018 5.9018 5.9933 5.9933 6.5766 6.5766 6.6295 6.6295 6.9245 6.9245 7.1211 7.1211 7.5699 7.5699 7.6223 7.6223 10.0277 10.0277 11.2098 11.2098 11.2863 11.2863 13.9004 13.9004 k = 0.0000 0.0000 0.1891 ( 2465 PWs) bands (ev): -46.3968 -46.3968 -23.9970 -23.9970 -21.9713 -21.9713 -21.8501 -21.8501 -19.0238 -19.0238 -8.7232 -8.7232 -8.3140 -8.3140 -8.1779 -8.1779 -2.7267 -2.7267 -2.4760 -2.4760 -2.4523 -2.4523 5.1586 5.1586 5.8776 5.8776 5.9663 5.9663 6.5562 6.5562 6.6128 6.6128 6.8857 6.8857 7.1056 7.1056 7.5701 7.5701 7.6237 7.6237 10.0316 10.0316 11.2834 11.2834 11.3600 11.3600 13.9013 13.9013 k = 0.0000 0.0000 0.2017 ( 2465 PWs) bands (ev): -46.3967 -46.3967 -23.9982 -23.9982 -21.9744 -21.9744 -21.8499 -21.8499 -19.0229 -19.0229 -8.7203 -8.7203 -8.3133 -8.3133 -8.1504 -8.1504 -2.7244 -2.7244 -2.4749 -2.4749 -2.4480 -2.4480 5.0477 5.0477 5.8528 5.8528 5.9384 5.9384 6.5364 6.5364 6.5967 6.5967 6.8479 6.8479 7.0898 7.0898 7.5701 7.5701 7.6248 7.6248 10.0357 10.0357 11.3590 11.3590 11.4356 11.4356 13.9023 13.9023 k = 0.0000 0.0000 0.2144 ( 2461 PWs) bands (ev): -46.3966 -46.3966 -23.9994 -23.9994 -21.9777 -21.9777 -21.8497 -21.8497 -19.0219 -19.0219 -8.7181 -8.7181 -8.3125 -8.3125 -8.1211 -8.1211 -2.7220 -2.7220 -2.4738 -2.4738 -2.4437 -2.4437 4.9347 4.9347 5.8275 5.8275 5.9100 5.9100 6.5173 6.5173 6.5811 6.5811 6.8111 6.8111 7.0736 7.0736 7.5699 7.5699 7.6257 7.6257 10.0399 10.0399 11.4361 11.4361 11.5128 11.5128 13.9033 13.9033 k = 0.0000 0.0000 0.2270 ( 2477 PWs) bands (ev): -46.3967 -46.3967 -24.0007 -24.0007 -21.9810 -21.9810 -21.8496 -21.8496 -19.0209 -19.0209 -8.7166 -8.7166 -8.3118 -8.3118 -8.0904 -8.0904 -2.7197 -2.7197 -2.4727 -2.4727 -2.4392 -2.4392 4.8204 4.8204 5.8018 5.8018 5.8811 5.8811 6.4990 6.4990 6.5663 6.5663 6.7755 6.7755 7.0573 7.0573 7.5696 7.5696 7.6264 7.6264 10.0441 10.0441 11.5142 11.5142 11.5909 11.5909 13.9042 13.9042 k = 0.0000 0.0000 0.2396 ( 2469 PWs) bands (ev): -46.3965 -46.3965 -24.0020 -24.0020 -21.9843 -21.9843 -21.8494 -21.8494 -19.0199 -19.0199 -8.7156 -8.7156 -8.3110 -8.3110 -8.0585 -8.0585 -2.7173 -2.7173 -2.4716 -2.4716 -2.4347 -2.4347 4.7057 4.7057 5.7760 5.7760 5.8521 5.8521 6.4815 6.4815 6.5521 6.5521 6.7411 6.7411 7.0410 7.0410 7.5690 7.5690 7.6268 7.6268 10.0484 10.0484 11.5929 11.5929 11.6697 11.6697 13.9052 13.9052 k = 0.0000 0.0000 0.2522 ( 2469 PWs) bands (ev): -46.3964 -46.3964 -24.0032 -24.0032 -21.9876 -21.9876 -21.8492 -21.8492 -19.0190 -19.0190 -8.7151 -8.7151 -8.3102 -8.3102 -8.0256 -8.0256 -2.7150 -2.7150 -2.4704 -2.4704 -2.4301 -2.4301 4.5914 4.5914 5.7502 5.7502 5.8231 5.8231 6.4649 6.4649 6.5386 6.5386 6.7079 6.7079 7.0246 7.0246 7.5684 7.5684 7.6272 7.6272 10.0527 10.0527 11.6716 11.6716 11.7486 11.7486 13.9061 13.9061 k = 0.0000 0.0000 0.2648 ( 2469 PWs) bands (ev): -46.3964 -46.3964 -24.0045 -24.0045 -21.9909 -21.9909 -21.8490 -21.8490 -19.0180 -19.0180 -8.7151 -8.7151 -8.3094 -8.3094 -7.9919 -7.9919 -2.7127 -2.7127 -2.4693 -2.4693 -2.4254 -2.4254 4.4784 4.4784 5.7245 5.7245 5.7944 5.7944 6.4491 6.4491 6.5258 6.5258 6.6760 6.6760 7.0085 7.0085 7.5676 7.5676 7.6273 7.6273 10.0570 10.0570 11.7500 11.7500 11.8272 11.8272 13.9071 13.9071 k = 0.0000 0.0000 0.2774 ( 2469 PWs) bands (ev): -46.3963 -46.3963 -24.0057 -24.0057 -21.9941 -21.9941 -21.8489 -21.8489 -19.0170 -19.0170 -8.7155 -8.7155 -8.3086 -8.3086 -7.9578 -7.9578 -2.7104 -2.7104 -2.4682 -2.4682 -2.4208 -2.4208 4.3673 4.3673 5.6991 5.6991 5.7663 5.7663 6.4342 6.4342 6.5136 6.5136 6.6454 6.6454 6.9926 6.9926 7.5667 7.5667 7.6273 7.6273 10.0613 10.0613 11.8277 11.8277 11.9051 11.9051 13.9080 13.9080 k = 0.0000 0.0000 0.2900 ( 2465 PWs) bands (ev): -46.3962 -46.3962 -24.0070 -24.0070 -21.9973 -21.9973 -21.8487 -21.8487 -19.0160 -19.0160 -8.7163 -8.7163 -8.3079 -8.3079 -7.9236 -7.9236 -2.7082 -2.7082 -2.4670 -2.4670 -2.4162 -2.4162 4.2588 4.2588 5.6743 5.6743 5.7388 5.7388 6.4201 6.4201 6.5021 6.5021 6.6162 6.6162 6.9770 6.9770 7.5658 7.5658 7.6273 7.6273 10.0655 10.0655 11.9040 11.9040 11.9817 11.9817 13.9089 13.9089 k = 0.0000 0.0000 0.3026 ( 2473 PWs) bands (ev): -46.3962 -46.3962 -24.0082 -24.0082 -22.0004 -22.0004 -21.8485 -21.8485 -19.0151 -19.0151 -8.7173 -8.7173 -8.3071 -8.3071 -7.8895 -7.8895 -2.7061 -2.7061 -2.4660 -2.4660 -2.4117 -2.4117 4.1536 4.1536 5.6501 5.6501 5.7122 5.7122 6.4068 6.4068 6.4913 6.4913 6.5885 6.5885 6.9619 6.9619 7.5648 7.5648 7.6271 7.6271 10.0696 10.0696 11.9786 11.9786 12.0566 12.0566 13.9098 13.9098 k = 0.0000 0.0000 0.3152 ( 2473 PWs) bands (ev): -46.3961 -46.3961 -24.0094 -24.0094 -22.0034 -22.0034 -21.8484 -21.8484 -19.0142 -19.0142 -8.7185 -8.7185 -8.3064 -8.3064 -7.8559 -7.8559 -2.7041 -2.7041 -2.4649 -2.4649 -2.4073 -2.4073 4.0523 4.0523 5.6268 5.6268 5.6867 5.6867 6.3943 6.3943 6.4811 6.4811 6.5623 6.5623 6.9474 6.9474 7.5637 7.5637 7.6268 7.6268 10.0736 10.0736 12.0511 12.0511 12.1293 12.1293 13.9107 13.9107 k = 0.0000 0.0000 0.3278 ( 2473 PWs) bands (ev): -46.3961 -46.3961 -24.0105 -24.0105 -22.0063 -22.0063 -21.8482 -21.8482 -19.0134 -19.0134 -8.7199 -8.7199 -8.3057 -8.3057 -7.8230 -7.8230 -2.7021 -2.7021 -2.4639 -2.4639 -2.4031 -2.4031 3.9553 3.9553 5.6044 5.6044 5.6623 5.6623 6.3826 6.3826 6.4716 6.4716 6.5377 6.5377 6.9334 6.9334 7.5627 7.5627 7.6265 7.6265 10.0774 10.0774 12.1210 12.1210 12.1995 12.1995 13.9115 13.9115 k = 0.0000 0.0000 0.3404 ( 2469 PWs) bands (ev): -46.3959 -46.3959 -24.0116 -24.0116 -22.0090 -22.0090 -21.8481 -21.8481 -19.0125 -19.0125 -8.7214 -8.7214 -8.3050 -8.3050 -7.7911 -7.7911 -2.7003 -2.7003 -2.4630 -2.4630 -2.3989 -2.3989 3.8633 3.8633 5.5833 5.5833 5.6393 5.6393 6.3717 6.3717 6.4628 6.4628 6.5147 6.5147 6.9202 6.9202 7.5617 7.5617 7.6262 7.6262 10.0811 10.0811 12.1879 12.1879 12.2667 12.2667 13.9123 13.9123 k = 0.0000 0.0000 0.3531 ( 2457 PWs) bands (ev): -46.3957 -46.3957 -24.0126 -24.0126 -22.0116 -22.0116 -21.8479 -21.8479 -19.0117 -19.0117 -8.7229 -8.7229 -8.3044 -8.3044 -7.7605 -7.7605 -2.6985 -2.6985 -2.4620 -2.4620 -2.3950 -2.3950 3.7768 3.7768 5.5633 5.5633 5.6177 5.6177 6.3614 6.3614 6.4546 6.4546 6.4935 6.4935 6.9077 6.9077 7.5607 7.5607 7.6258 7.6258 10.0845 10.0845 12.2513 12.2513 12.3304 12.3304 13.9130 13.9130 k = 0.0000 0.0000 0.3657 ( 2465 PWs) bands (ev): -46.3958 -46.3958 -24.0136 -24.0136 -22.0140 -22.0140 -21.8478 -21.8478 -19.0110 -19.0110 -8.7244 -8.7244 -8.3038 -8.3038 -7.7314 -7.7314 -2.6970 -2.6970 -2.4612 -2.4612 -2.3914 -2.3914 3.6961 3.6961 5.5448 5.5448 5.5976 5.5976 6.3520 6.3520 6.4471 6.4471 6.4741 6.4741 6.8961 6.8961 7.5597 7.5597 7.6254 7.6254 10.0878 10.0878 12.3109 12.3109 12.3901 12.3901 13.9137 13.9137 k = 0.0000 0.0000 0.3783 ( 2465 PWs) bands (ev): -46.3957 -46.3957 -24.0144 -24.0144 -22.0162 -22.0162 -21.8477 -21.8477 -19.0103 -19.0103 -8.7259 -8.7259 -8.3033 -8.3033 -7.7043 -7.7043 -2.6955 -2.6955 -2.4604 -2.4604 -2.3880 -2.3880 3.6218 3.6218 5.5277 5.5277 5.5792 5.5792 6.3432 6.3432 6.4403 6.4403 6.4565 6.4565 6.8853 6.8853 7.5588 7.5588 7.6250 7.6250 10.0908 10.0908 12.3661 12.3661 12.4457 12.4457 13.9143 13.9143 k = 0.0000 0.0000 0.3909 ( 2465 PWs) bands (ev): -46.3957 -46.3957 -24.0153 -24.0153 -22.0183 -22.0183 -21.8475 -21.8475 -19.0097 -19.0097 -8.7274 -8.7274 -8.3028 -8.3028 -7.6792 -7.6792 -2.6942 -2.6942 -2.4597 -2.4597 -2.3848 -2.3848 3.5542 3.5542 5.5122 5.5122 5.5625 5.5625 6.3352 6.3352 6.4341 6.4341 6.4408 6.4408 6.8756 6.8756 7.5580 7.5580 7.6247 7.6247 10.0936 10.0936 12.4167 12.4167 12.4965 12.4965 13.9149 13.9149 k = 0.0000 0.0000 0.4035 ( 2461 PWs) bands (ev): -46.3956 -46.3956 -24.0160 -24.0160 -22.0201 -22.0201 -21.8474 -21.8474 -19.0092 -19.0092 -8.7287 -8.7287 -8.3023 -8.3023 -7.6565 -7.6565 -2.6930 -2.6930 -2.4590 -2.4590 -2.3820 -2.3820 3.4937 3.4937 5.4983 5.4983 5.5477 5.5477 6.3280 6.3280 6.4270 6.4270 6.4287 6.4287 6.8669 6.8669 7.5572 7.5572 7.6243 7.6243 10.0961 10.0961 12.4623 12.4623 12.5423 12.5423 13.9155 13.9155 k = 0.0000 0.0000 0.4161 ( 2449 PWs) bands (ev): -46.3953 -46.3953 -24.0166 -24.0166 -22.0216 -22.0216 -21.8473 -21.8473 -19.0087 -19.0087 -8.7299 -8.7299 -8.3019 -8.3019 -7.6363 -7.6363 -2.6919 -2.6919 -2.4584 -2.4584 -2.3794 -2.3794 3.4405 3.4405 5.4861 5.4861 5.5346 5.5346 6.3215 6.3215 6.4151 6.4151 6.4240 6.4240 6.8592 6.8592 7.5565 7.5565 7.6240 7.6240 10.0983 10.0983 12.5026 12.5026 12.5828 12.5828 13.9160 13.9160 k = 0.0000 0.0000 0.4287 ( 2445 PWs) bands (ev): -46.3953 -46.3953 -24.0172 -24.0172 -22.0230 -22.0230 -21.8473 -21.8473 -19.0082 -19.0082 -8.7310 -8.7310 -8.3016 -8.3016 -7.6189 -7.6189 -2.6910 -2.6910 -2.4579 -2.4579 -2.3773 -2.3773 3.3951 3.3951 5.4758 5.4758 5.5235 5.5235 6.3159 6.3159 6.4051 6.4051 6.4199 6.4199 6.8527 6.8527 7.5559 7.5559 7.6237 7.6237 10.1002 10.1002 12.5372 12.5372 12.6175 12.6175 13.9164 13.9164 k = 0.0000 0.0000 0.4413 ( 2445 PWs) bands (ev): -46.3952 -46.3952 -24.0176 -24.0176 -22.0241 -22.0241 -21.8472 -21.8472 -19.0079 -19.0079 -8.7319 -8.7319 -8.3013 -8.3013 -7.6044 -7.6044 -2.6903 -2.6903 -2.4575 -2.4575 -2.3755 -2.3755 3.3576 3.3576 5.4672 5.4672 5.5144 5.5144 6.3112 6.3112 6.3970 6.3970 6.4166 6.4166 6.8473 6.8473 7.5554 7.5554 7.6235 7.6235 10.1017 10.1017 12.5658 12.5658 12.6464 12.6464 13.9167 13.9167 k = 0.0000 0.0000 0.4539 ( 2437 PWs) bands (ev): -46.3951 -46.3951 -24.0180 -24.0180 -22.0250 -22.0250 -21.8471 -21.8471 -19.0076 -19.0076 -8.7326 -8.7326 -8.3011 -8.3011 -7.5930 -7.5930 -2.6897 -2.6897 -2.4572 -2.4572 -2.3741 -2.3741 3.3282 3.3282 5.4605 5.4605 5.5073 5.5073 6.3074 6.3074 6.3908 6.3908 6.4141 6.4141 6.8430 6.8430 7.5550 7.5550 7.6233 7.6233 10.1030 10.1030 12.5884 12.5884 12.6690 12.6690 13.9170 13.9170 k = 0.0000 0.0000 0.4665 ( 2424 PWs) bands (ev): -46.3949 -46.3949 -24.0182 -24.0182 -22.0256 -22.0256 -21.8471 -21.8471 -19.0074 -19.0074 -8.7332 -8.7332 -8.3009 -8.3009 -7.5847 -7.5847 -2.6892 -2.6892 -2.4569 -2.4569 -2.3730 -2.3730 3.3070 3.3070 5.4557 5.4557 5.5021 5.5021 6.3047 6.3047 6.3863 6.3863 6.4122 6.4122 6.8400 6.8400 7.5548 7.5548 7.6232 7.6232 10.1039 10.1039 12.6047 12.6047 12.6854 12.6854 13.9172 13.9172 k = 0.0000 0.0000 0.4791 ( 2424 PWs) bands (ev): -46.3949 -46.3949 -24.0184 -24.0184 -22.0260 -22.0260 -21.8471 -21.8471 -19.0073 -19.0073 -8.7335 -8.7335 -8.3008 -8.3008 -7.5798 -7.5798 -2.6890 -2.6890 -2.4568 -2.4568 -2.3724 -2.3724 3.2943 3.2943 5.4528 5.4528 5.4991 5.4991 6.3030 6.3030 6.3837 6.3837 6.4111 6.4111 6.8382 6.8382 7.5546 7.5546 7.6231 7.6231 10.1044 10.1044 12.6145 12.6145 12.6952 12.6952 13.9174 13.9174 k = 0.0000 0.0000 0.4918 ( 2432 PWs) bands (ev): -46.3950 -46.3950 -24.0184 -24.0184 -22.0261 -22.0261 -21.8471 -21.8471 -19.0073 -19.0073 -8.7336 -8.7336 -8.3008 -8.3008 -7.5781 -7.5781 -2.6889 -2.6889 -2.4568 -2.4568 -2.3722 -2.3722 3.2901 3.2901 5.4518 5.4518 5.4980 5.4980 6.3025 6.3025 6.3828 6.3828 6.4107 6.4107 6.8375 6.8375 7.5545 7.5545 7.6231 7.6231 10.1046 10.1046 12.6178 12.6178 12.6985 12.6985 13.9174 13.9174 k = 0.0000 0.0000 0.4918 ( 2432 PWs) bands (ev): -46.3950 -46.3950 -24.0184 -24.0184 -22.0261 -22.0261 -21.8471 -21.8471 -19.0073 -19.0073 -8.7336 -8.7336 -8.3008 -8.3008 -7.5781 -7.5781 -2.6889 -2.6889 -2.4568 -2.4568 -2.3722 -2.3722 3.2901 3.2901 5.4518 5.4518 5.4980 5.4980 6.3025 6.3025 6.3828 6.3828 6.4107 6.4107 6.8375 6.8375 7.5545 7.5545 7.6231 7.6231 10.1046 10.1046 12.6178 12.6178 12.6985 12.6985 13.9174 13.9174 k = 0.0000 0.0125 0.4918 ( 2428 PWs) bands (ev): -46.3950 -46.3950 -24.0186 -24.0183 -22.0264 -22.0260 -21.8472 -21.8472 -19.0072 -19.0072 -8.7331 -8.7323 -8.3002 -8.3002 -7.5783 -7.5780 -2.6890 -2.6889 -2.4568 -2.4568 -2.3724 -2.3723 3.2900 3.2901 5.4465 5.4493 5.4942 5.4945 6.2889 6.3129 6.3728 6.3911 6.4132 6.4163 6.8403 6.8406 7.5511 7.5512 7.6194 7.6195 10.1096 10.1097 12.6168 12.6182 12.6956 12.7009 13.9211 13.9259 k = 0.0000 0.0250 0.4918 ( 2428 PWs) bands (ev): -46.3949 -46.3949 -24.0188 -24.0184 -22.0267 -22.0259 -21.8475 -21.8475 -19.0072 -19.0072 -8.7308 -8.7292 -8.2983 -8.2983 -7.5787 -7.5782 -2.6891 -2.6889 -2.4567 -2.4567 -2.3730 -2.3728 3.2899 3.2902 5.4305 5.4366 5.4858 5.4872 6.2744 6.3142 6.3679 6.3907 6.4220 6.4340 6.8490 6.8496 7.5409 7.5411 7.6087 7.6089 10.1248 10.1248 12.6152 12.6181 12.6925 12.7025 13.9369 13.9461 k = 0.0000 0.0375 0.4918 ( 2436 PWs) bands (ev): -46.3950 -46.3950 -24.0192 -24.0185 -22.0270 -22.0259 -21.8481 -21.8481 -19.0071 -19.0071 -8.7267 -8.7244 -8.2951 -8.2951 -7.5792 -7.5784 -2.6893 -2.6890 -2.4567 -2.4567 -2.3739 -2.3736 3.2898 3.2902 5.4011 5.4098 5.4783 5.4807 6.2587 6.3043 6.3656 6.3853 6.4394 6.4583 6.8638 6.8648 7.5241 7.5244 7.5916 7.5920 10.1496 10.1497 12.6132 12.6176 12.6893 12.7036 13.9641 13.9772 k = 0.0000 0.0500 0.4918 ( 2438 PWs) bands (ev): -46.3950 -46.3950 -24.0196 -24.0187 -22.0275 -22.0259 -21.8490 -21.8489 -19.0070 -19.0070 -8.7209 -8.7179 -8.2905 -8.2905 -7.5799 -7.5789 -2.6896 -2.6892 -2.4567 -2.4567 -2.3751 -2.3748 3.2896 3.2902 5.3595 5.3698 5.4731 5.4758 6.2403 6.2865 6.3608 6.3771 6.4641 6.4857 6.8853 6.8865 7.5008 7.5012 7.5694 7.5699 10.1839 10.1840 12.6111 12.6171 12.6866 12.7043 14.0017 14.0181 k = 0.0000 0.0625 0.4918 ( 2444 PWs) bands (ev): -46.3951 -46.3951 -24.0201 -24.0189 -22.0280 -22.0261 -21.8500 -21.8500 -19.0069 -19.0068 -8.7136 -8.7098 -8.2846 -8.2845 -7.5807 -7.5794 -2.6899 -2.6894 -2.4566 -2.4566 -2.3767 -2.3762 3.2894 3.2902 5.3089 5.3202 5.4687 5.4715 6.2177 6.2627 6.3527 6.3666 6.4922 6.5138 6.9136 6.9150 7.4716 7.4722 7.5431 7.5437 10.2268 10.2269 12.6092 12.6168 12.6846 12.7050 14.0483 14.0671 k = 0.0000 0.0750 0.4918 ( 2440 PWs) bands (ev): -46.3950 -46.3950 -24.0207 -24.0193 -22.0286 -22.0263 -21.8512 -21.8512 -19.0067 -19.0067 -8.7048 -8.7004 -8.2772 -8.2770 -7.5817 -7.5802 -2.6902 -2.6897 -2.4565 -2.4565 -2.3786 -2.3780 3.2892 3.2901 5.2518 5.2636 5.4644 5.4674 6.1898 6.2329 6.3419 6.3541 6.5207 6.5413 6.9487 6.9503 7.4374 7.4381 7.5140 7.5146 10.2778 10.2779 12.6081 12.6170 12.6833 12.7060 14.1023 14.1229 k = 0.0000 0.0875 0.4918 ( 2440 PWs) bands (ev): -46.3949 -46.3949 -24.0214 -24.0198 -22.0292 -22.0266 -21.8527 -21.8526 -19.0065 -19.0065 -8.6948 -8.6898 -8.2683 -8.2679 -7.5828 -7.5810 -2.6907 -2.6900 -2.4564 -2.4564 -2.3807 -2.3800 3.2890 3.2901 5.1900 5.2022 5.4599 5.4630 6.1553 6.1964 6.3289 6.3398 6.5477 6.5671 6.9902 6.9918 7.3994 7.4002 7.4829 7.4835 10.3360 10.3361 12.6081 12.6179 12.6828 12.7076 14.1619 14.1836 k = 0.0000 0.1000 0.4918 ( 2448 PWs) bands (ev): -46.3950 -46.3950 -24.0221 -24.0203 -22.0299 -22.0269 -21.8543 -21.8542 -19.0063 -19.0062 -8.6837 -8.6782 -8.2576 -8.2571 -7.5841 -7.5820 -2.6912 -2.6905 -2.4563 -2.4563 -2.3831 -2.3824 3.2888 3.2900 5.1251 5.1374 5.4551 5.4583 6.1134 6.1525 6.3140 6.3237 6.5727 6.5907 7.0370 7.0387 7.3594 7.3603 7.4505 7.4512 10.4008 10.4009 12.6098 12.6197 12.6833 12.7101 14.2256 14.2477 k = 0.0000 0.1125 0.4918 ( 2452 PWs) bands (ev): -46.3950 -46.3950 -24.0229 -24.0209 -22.0307 -22.0274 -21.8561 -21.8560 -19.0061 -19.0060 -8.6717 -8.6657 -8.2452 -8.2444 -7.5855 -7.5831 -2.6918 -2.6909 -2.4562 -2.4561 -2.3857 -2.3849 3.2885 3.2899 5.0579 5.0703 5.4498 5.4532 6.0634 6.1007 6.2972 6.3060 6.5954 6.6122 7.0878 7.0895 7.3192 7.3203 7.4175 7.4181 10.4714 10.4714 12.6132 12.6227 12.6848 12.7138 14.2918 14.3137 k = 0.0000 0.1250 0.4918 ( 2460 PWs) bands (ev): -46.3950 -46.3950 -24.0238 -24.0216 -22.0316 -22.0279 -21.8581 -21.8579 -19.0058 -19.0057 -8.6591 -8.6528 -8.2309 -8.2298 -7.5870 -7.5843 -2.6925 -2.6915 -2.4561 -2.4560 -2.3886 -2.3877 3.2882 3.2897 4.9894 5.0018 5.4441 5.4477 6.0049 6.0405 6.2786 6.2867 6.6163 6.6320 7.1403 7.1420 7.2814 7.2828 7.3842 7.3850 10.5469 10.5469 12.6185 12.6266 12.6875 12.7191 14.3589 14.3803 k = 0.0000 0.1375 0.4918 ( 2458 PWs) bands (ev): -46.3950 -46.3950 -24.0247 -24.0224 -22.0325 -22.0285 -21.8602 -21.8599 -19.0055 -19.0054 -8.6461 -8.6395 -8.2146 -8.2131 -7.5886 -7.5856 -2.6932 -2.6921 -2.4560 -2.4558 -2.3916 -2.3906 3.2878 3.2895 4.9201 4.9325 5.4381 5.4419 5.9378 5.9720 6.2584 6.2659 6.6355 6.6503 7.1856 7.1874 7.2547 7.2566 7.3512 7.3522 10.6267 10.6269 12.6252 12.6314 12.6920 12.7264 14.4258 14.4463 k = 0.0000 0.1500 0.4918 ( 2466 PWs) bands (ev): -46.3950 -46.3950 -24.0257 -24.0232 -22.0335 -22.0292 -21.8624 -21.8620 -19.0052 -19.0051 -8.6330 -8.6262 -8.1962 -8.1942 -7.5904 -7.5870 -2.6940 -2.6928 -2.4559 -2.4556 -2.3947 -2.3937 3.2874 3.2893 4.8506 4.8629 5.4317 5.4357 5.8624 5.8953 6.2364 6.2435 6.6536 6.6676 7.1869 7.1887 7.2747 7.2786 7.3188 7.3216 10.7103 10.7105 12.6328 12.6366 12.6990 12.7362 14.4912 14.5106 k = 0.0000 0.1625 0.4918 ( 2462 PWs) bands (ev): -46.3948 -46.3948 -24.0267 -24.0241 -22.0346 -22.0300 -21.8646 -21.8642 -19.0049 -19.0047 -8.6199 -8.6131 -8.1757 -8.1731 -7.5922 -7.5885 -2.6949 -2.6936 -2.4558 -2.4554 -2.3980 -2.3969 3.2870 3.2890 4.7812 4.7934 5.4249 5.4292 5.7793 5.8111 6.2128 6.2196 6.6707 6.6841 7.1609 7.1630 7.2845 7.2872 7.3317 7.3333 10.7969 10.7972 12.6405 12.6420 12.7093 12.7489 14.5543 14.5724 k = 0.0000 0.1750 0.4918 ( 2462 PWs) bands (ev): -46.3948 -46.3948 -24.0278 -24.0250 -22.0358 -22.0309 -21.8670 -21.8665 -19.0045 -19.0044 -8.6071 -8.6002 -8.1531 -8.1497 -7.5940 -7.5900 -2.6959 -2.6944 -2.4558 -2.4553 -2.4012 -2.4002 3.2864 3.2887 4.7123 4.7244 5.4177 5.4223 5.6892 5.7200 6.1877 6.1943 6.6872 6.7001 7.1339 7.1363 7.2560 7.2571 7.3889 7.3889 10.8859 10.8864 12.6472 12.6472 12.7238 12.7650 14.6145 14.6312 k = 0.0000 0.1875 0.4918 ( 2462 PWs) bands (ev): -46.3947 -46.3947 -24.0289 -24.0260 -22.0370 -22.0318 -21.8694 -21.8688 -19.0042 -19.0040 -8.5947 -8.5879 -8.1283 -8.1242 -7.5960 -7.5915 -2.6969 -2.6953 -2.4558 -2.4552 -2.4045 -2.4034 3.2859 3.2883 4.6442 4.6562 5.4101 5.4153 5.5935 5.6231 6.1612 6.1676 6.7032 6.7157 7.1092 7.1121 7.2276 7.2284 7.4461 7.4465 10.9768 10.9775 12.6520 12.6528 12.7428 12.7846 14.6711 14.6864 k = 0.0000 0.2000 0.4918 ( 2460 PWs) bands (ev): -46.3946 -46.3946 -24.0300 -24.0270 -22.0382 -22.0329 -21.8718 -21.8711 -19.0038 -19.0036 -8.5828 -8.5762 -8.1015 -8.0966 -7.5979 -7.5931 -2.6980 -2.6962 -2.4560 -2.4552 -2.4076 -2.4066 3.2852 3.2878 4.5769 4.5888 5.4014 5.4078 5.4939 5.5217 6.1335 6.1397 6.7189 6.7310 7.0875 7.0907 7.2007 7.2014 7.5028 7.5032 11.0691 11.0699 12.6563 12.6571 12.7661 12.8077 14.7239 14.7378 k = 0.0000 0.2125 0.4918 ( 2460 PWs) bands (ev): -46.3945 -46.3945 -24.0311 -24.0281 -22.0396 -22.0340 -21.8742 -21.8734 -19.0034 -19.0032 -8.5715 -8.5651 -8.0728 -8.0670 -7.5999 -7.5946 -2.6991 -2.6973 -2.4563 -2.4553 -2.4106 -2.4097 3.2844 3.2872 4.5108 4.5226 5.3752 5.3976 5.4079 5.4194 6.1046 6.1108 6.7342 6.7460 7.0687 7.0723 7.1754 7.1760 7.5581 7.5586 11.1623 11.1633 12.6601 12.6606 12.7933 12.8341 14.7727 14.7852 k = 0.0000 0.2250 0.4918 ( 2464 PWs) bands (ev): -46.3944 -46.3944 -24.0323 -24.0292 -22.0410 -22.0353 -21.8767 -21.8758 -19.0030 -19.0028 -8.5608 -8.5547 -8.0424 -8.0357 -7.6019 -7.5960 -2.7004 -2.6984 -2.4568 -2.4555 -2.4135 -2.4127 3.2835 3.2865 4.4459 4.4575 5.2772 5.3076 5.3912 5.3943 6.0749 6.0810 6.7493 6.7608 7.0525 7.0564 7.1518 7.1525 7.6117 7.6121 11.2558 11.2570 12.6635 12.6635 12.8240 12.8638 14.8175 14.8287 k = 0.0000 0.2375 0.4918 ( 2468 PWs) bands (ev): -46.3944 -46.3944 -24.0335 -24.0304 -22.0424 -22.0366 -21.8790 -21.8781 -19.0026 -19.0024 -8.5509 -8.5450 -8.0105 -8.0029 -7.6039 -7.5974 -2.7017 -2.6996 -2.4576 -2.4560 -2.4160 -2.4154 3.2825 3.2857 4.3823 4.3938 5.1699 5.1991 5.3826 5.3865 6.0445 6.0506 6.7641 6.7755 7.0386 7.0429 7.1300 7.1307 7.6632 7.6636 11.3493 11.3507 12.6659 12.6665 12.8578 12.8963 14.8584 14.8684 k = 0.0000 0.2500 0.4918 ( 2472 PWs) bands (ev): -46.3944 -46.3944 -24.0346 -24.0315 -22.0439 -22.0380 -21.8814 -21.8803 -19.0022 -19.0020 -8.5416 -8.5361 -7.9775 -7.9688 -7.6057 -7.5987 -2.7030 -2.7008 -2.4586 -2.4567 -2.4181 -2.4177 3.2813 3.2847 4.3201 4.3315 5.0617 5.0902 5.3747 5.3790 6.0137 6.0198 6.7787 6.7899 7.0267 7.0315 7.1100 7.1106 7.7124 7.7127 11.4421 11.4438 12.6681 12.6693 12.8942 12.9314 14.8956 14.9045 k = 0.0000 0.2625 0.4918 ( 2456 PWs) bands (ev): -46.3941 -46.3941 -24.0358 -24.0327 -22.0454 -22.0394 -21.8836 -21.8825 -19.0017 -19.0016 -8.5330 -8.5278 -7.9435 -7.9337 -7.6075 -7.5997 -2.7043 -2.7020 -2.4599 -2.4577 -2.4199 -2.4197 3.2799 3.2835 4.2594 4.2706 4.9542 4.9821 5.3671 5.3715 5.9827 5.9888 6.7929 6.8041 7.0166 7.0218 7.0917 7.0923 7.7592 7.7594 11.5341 11.5361 12.6700 12.6719 12.9331 12.9689 14.9294 14.9372 k = 0.0000 0.2750 0.4918 ( 2460 PWs) bands (ev): -46.3940 -46.3940 -24.0369 -24.0339 -22.0469 -22.0409 -21.8858 -21.8846 -19.0013 -19.0012 -8.5251 -8.5202 -7.9090 -7.8980 -7.6092 -7.6005 -2.7057 -2.7033 -2.4615 -2.4590 -2.4213 -2.4213 3.2782 3.2820 4.2001 4.2111 4.8486 4.8759 5.3597 5.3643 5.9517 5.9578 6.8069 6.8179 7.0080 7.0136 7.0751 7.0756 7.8034 7.8035 11.6246 11.6269 12.6718 12.6742 12.9739 13.0082 14.9597 14.9666 k = 0.0000 0.2875 0.4918 ( 2456 PWs) bands (ev): -46.3939 -46.3939 -24.0381 -24.0350 -22.0484 -22.0425 -21.8879 -21.8866 -19.0009 -19.0008 -8.5177 -8.5131 -7.8744 -7.8621 -7.6106 -7.6008 -2.7071 -2.7045 -2.4634 -2.4606 -2.4225 -2.4222 3.2762 3.2802 4.1423 4.1530 4.7459 4.7726 5.3525 5.3572 5.9210 5.9271 6.8204 6.8315 7.0006 7.0068 7.0600 7.0604 7.8449 7.8450 11.7133 11.7159 12.6734 12.6765 13.0163 13.0490 14.9870 14.9931 k = 0.0000 0.3000 0.4918 ( 2460 PWs) bands (ev): -46.3938 -46.3938 -24.0392 -24.0362 -22.0500 -22.0441 -21.8899 -21.8886 -19.0005 -19.0004 -8.5109 -8.5067 -7.8402 -7.8264 -7.6117 -7.6006 -2.7084 -2.7059 -2.4655 -2.4625 -2.4233 -2.4229 3.2739 3.2780 4.0859 4.0962 4.6470 4.6730 5.3455 5.3503 5.8908 5.8968 6.8335 6.8446 6.9944 7.0010 7.0464 7.0467 7.8838 7.8839 11.7996 11.8026 12.6750 12.6786 13.0599 13.0911 15.0115 15.0168 k = 0.0000 0.3125 0.4918 ( 2462 PWs) bands (ev): -46.3938 -46.3938 -24.0402 -24.0374 -22.0515 -22.0457 -21.8917 -21.8904 -19.0002 -19.0000 -8.5047 -8.5008 -7.8068 -7.7913 -7.6122 -7.5996 -2.7098 -2.7072 -2.4678 -2.4646 -2.4237 -2.4232 3.2711 3.2754 4.0311 4.0409 4.5528 4.5780 5.3389 5.3438 5.8613 5.8673 6.8461 6.8573 6.9890 6.9962 7.0342 7.0344 7.9200 7.9200 11.8833 11.8867 12.6764 12.6806 13.1042 13.1339 15.0333 15.0380 k = 0.0000 0.3250 0.4918 ( 2458 PWs) bands (ev): -46.3936 -46.3936 -24.0413 -24.0385 -22.0530 -22.0473 -21.8935 -21.8922 -18.9998 -18.9996 -8.4990 -8.4953 -7.7750 -7.7575 -7.6119 -7.5975 -2.7111 -2.7085 -2.4701 -2.4668 -2.4238 -2.4232 3.2678 3.2722 3.9777 3.9869 4.4643 4.4883 5.3326 5.3375 5.8328 5.8386 6.8582 6.8695 6.9843 6.9923 7.0233 7.0233 7.9534 7.9534 11.9639 11.9677 12.6778 12.6826 13.1490 13.1770 15.0529 15.0569 k = 0.0000 0.3375 0.4918 ( 2454 PWs) bands (ev): -46.3935 -46.3935 -24.0422 -24.0396 -22.0544 -22.0490 -21.8951 -21.8938 -18.9994 -18.9993 -8.4937 -8.4904 -7.7456 -7.7259 -7.6101 -7.5936 -2.7124 -2.7098 -2.4724 -2.4691 -2.4237 -2.4231 3.2638 3.2684 3.9260 3.9345 4.3819 4.4048 5.3268 5.3316 5.8053 5.8111 6.8696 6.8812 6.9801 6.9889 7.0135 7.0138 7.9842 7.9842 12.0409 12.0453 12.6791 12.6844 13.1937 13.2199 15.0702 15.0737 k = 0.0000 0.3500 0.4918 ( 2454 PWs) bands (ev): -46.3934 -46.3934 -24.0432 -24.0406 -22.0558 -22.0506 -21.8966 -21.8953 -18.9991 -18.9989 -8.4889 -8.4859 -7.7197 -7.6981 -7.6057 -7.5872 -2.7137 -2.7111 -2.4748 -2.4714 -2.4234 -2.4228 3.2591 3.2637 3.8762 3.8837 4.3063 4.3277 5.3213 5.3261 5.7791 5.7847 6.8804 6.8922 6.9765 6.9862 7.0048 7.0055 8.0123 8.0124 12.1141 12.1190 12.6803 12.6863 13.2377 13.2622 15.0856 15.0885 k = 0.0000 0.3625 0.4918 ( 2458 PWs) bands (ev): -46.3934 -46.3934 -24.0440 -24.0417 -22.0571 -22.0522 -21.8980 -21.8968 -18.9987 -18.9986 -8.4846 -8.4818 -7.6984 -7.6762 -7.5966 -7.5774 -2.7149 -2.7123 -2.4770 -2.4738 -2.4231 -2.4224 3.2535 3.2582 3.8285 3.8350 4.2379 4.2577 5.3163 5.3209 5.7544 5.7598 6.8904 6.9025 6.9731 6.9838 6.9973 6.9984 8.0379 8.0380 12.1829 12.1883 12.6815 12.6880 13.2807 13.3034 15.0992 15.1017 k = 0.0000 0.3750 0.4918 ( 2462 PWs) bands (ev): -46.3934 -46.3934 -24.0448 -24.0426 -22.0583 -22.0537 -21.8992 -21.8981 -18.9984 -18.9983 -8.4806 -8.4782 -7.6824 -7.6620 -7.5814 -7.5640 -2.7160 -2.7135 -2.4792 -2.4760 -2.4226 -2.4219 3.2470 3.2516 3.7834 3.7889 4.1768 4.1948 5.3118 5.3162 5.7313 5.7364 6.8995 6.9120 6.9700 6.9817 6.9910 6.9925 8.0609 8.0610 12.2471 12.2531 12.6827 12.6897 13.3222 13.3430 15.1111 15.1132 k = 0.0000 0.3875 0.4918 ( 2458 PWs) bands (ev): -46.3933 -46.3933 -24.0456 -24.0435 -22.0594 -22.0552 -21.9003 -21.8992 -18.9981 -18.9980 -8.4771 -8.4749 -7.6713 -7.6543 -7.5617 -7.5475 -2.7170 -2.7147 -2.4811 -2.4781 -2.4220 -2.4214 3.2395 3.2439 3.7415 3.7459 4.1229 4.1389 5.3077 5.3120 5.7099 5.7148 6.9078 6.9206 6.9671 6.9795 6.9862 6.9877 8.0815 8.0816 12.3062 12.3128 12.6838 12.6914 13.3617 13.3806 15.1215 15.1232 k = 0.0000 0.4000 0.4918 ( 2458 PWs) bands (ev): -46.3932 -46.3932 -24.0462 -24.0444 -22.0604 -22.0566 -21.9013 -21.9003 -18.9979 -18.9978 -8.4739 -8.4720 -7.6640 -7.6506 -7.5401 -7.5293 -2.7179 -2.7157 -2.4829 -2.4801 -2.4215 -2.4209 3.2310 3.2352 3.7034 3.7068 4.0759 4.0900 5.3042 5.3082 5.6904 5.6950 6.9150 6.9282 6.9646 6.9769 6.9830 6.9839 8.0997 8.0998 12.3600 12.3672 12.6849 12.6930 13.3986 13.4156 15.1304 15.1319 k = 0.0000 0.4125 0.4918 ( 2454 PWs) bands (ev): -46.3931 -46.3931 -24.0468 -24.0451 -22.0613 -22.0579 -21.9021 -21.9012 -18.9976 -18.9976 -8.4712 -8.4695 -7.6593 -7.6488 -7.5190 -7.5109 -2.7186 -2.7167 -2.4845 -2.4819 -2.4210 -2.4204 3.2217 3.2256 3.6696 3.6721 4.0357 4.0478 5.3012 5.3048 5.6730 5.6771 6.9212 6.9344 6.9627 6.9740 6.9810 6.9813 8.1155 8.1157 12.4082 12.4159 12.6860 12.6946 13.4326 13.4475 15.1381 15.1393 k = 0.0000 0.4250 0.4918 ( 2460 PWs) bands (ev): -46.3932 -46.3932 -24.0473 -24.0458 -22.0621 -22.0591 -21.9028 -21.9020 -18.9975 -18.9974 -8.4688 -8.4673 -7.6562 -7.6481 -7.4993 -7.4934 -2.7193 -2.7176 -2.4858 -2.4836 -2.4205 -2.4200 3.2119 3.2154 3.6405 3.6422 4.0017 4.0119 5.2987 5.3019 5.6576 5.6613 6.9264 6.9390 6.9619 6.9716 6.9786 6.9802 8.1292 8.1293 12.4504 12.4584 12.6873 12.6961 13.4631 13.4760 15.1446 15.1456 k = 0.0000 0.4375 0.4918 ( 2460 PWs) bands (ev): -46.3931 -46.3931 -24.0476 -24.0464 -22.0627 -22.0602 -21.9034 -21.9027 -18.9973 -18.9972 -8.4667 -8.4655 -7.6541 -7.6480 -7.4820 -7.4777 -2.7199 -2.7184 -2.4870 -2.4850 -2.4200 -2.4196 3.2021 3.2051 3.6163 3.6175 3.9736 3.9820 5.2966 5.2995 5.6445 5.6476 6.9304 6.9415 6.9625 6.9699 6.9769 6.9795 8.1406 8.1407 12.4864 12.4945 12.6887 12.6975 13.4899 13.5007 15.1500 15.1507 k = 0.0000 0.4500 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0479 -24.0470 -22.0631 -22.0611 -21.9039 -21.9033 -18.9971 -18.9971 -8.4650 -8.4641 -7.6527 -7.6481 -7.4673 -7.4642 -2.7203 -2.7191 -2.4879 -2.4863 -2.4196 -2.4192 3.1929 3.1953 3.5970 3.5977 3.9512 3.9578 5.2951 5.2974 5.6337 5.6363 6.9334 6.9422 6.9643 6.9689 6.9755 6.9789 8.1498 8.1499 12.5163 12.5240 12.6903 12.6986 13.5125 13.5212 15.1543 15.1549 k = 0.0000 0.4625 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0481 -24.0474 -22.0635 -22.0619 -21.9042 -21.9038 -18.9970 -18.9970 -8.4637 -8.4630 -7.6517 -7.6484 -7.4556 -7.4535 -2.7206 -2.7197 -2.4885 -2.4873 -2.4192 -2.4190 3.1849 3.1867 3.5823 3.5828 3.9342 3.9391 5.2940 5.2958 5.6253 5.6273 6.9356 6.9419 6.9665 6.9684 6.9747 6.9783 8.1570 8.1571 12.5397 12.5465 12.6921 12.6994 13.5307 13.5372 15.1576 15.1580 k = 0.0000 0.4750 0.4918 ( 2460 PWs) bands (ev): -46.3931 -46.3931 -24.0483 -24.0478 -22.0636 -22.0626 -21.9044 -21.9042 -18.9969 -18.9969 -8.4627 -8.4622 -7.6509 -7.6488 -7.4470 -7.4457 -2.7208 -2.7202 -2.4889 -2.4881 -2.4190 -2.4188 3.1787 3.1800 3.5721 3.5724 3.9224 3.9256 5.2933 5.2945 5.6193 5.6207 6.9372 6.9412 6.9682 6.9685 6.9744 6.9777 8.1621 8.1621 12.5569 12.5620 12.6942 12.6996 13.5441 13.5485 15.1599 15.1602 k = 0.0000 0.4875 0.4918 ( 2460 PWs) bands (ev): -46.3931 -46.3931 -24.0483 -24.0480 -22.0636 -22.0631 -21.9045 -21.9044 -18.9969 -18.9969 -8.4621 -8.4618 -7.6503 -7.6493 -7.4417 -7.4411 -2.7208 -2.7205 -2.4891 -2.4887 -2.4188 -2.4187 3.1749 3.1756 3.5662 3.5663 3.9156 3.9173 5.2930 5.2936 5.6159 5.6165 6.9384 6.9403 6.9687 6.9690 6.9749 6.9769 8.1651 8.1652 12.5678 12.5706 12.6963 12.6992 13.5527 13.5549 15.1614 15.1615 k = 0.0000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0482 -24.0482 -22.0634 -22.0634 -21.9045 -21.9045 -18.9968 -18.9968 -8.4618 -8.4618 -7.6497 -7.6497 -7.4398 -7.4398 -2.7207 -2.7207 -2.4890 -2.4890 -2.4187 -2.4187 3.1738 3.1738 3.5642 3.5642 3.9139 3.9139 5.2931 5.2931 5.6149 5.6149 6.9394 6.9394 6.9690 6.9690 6.9758 6.9758 8.1662 8.1662 12.5724 12.5724 12.6980 12.6980 13.5563 13.5563 15.1619 15.1619 k = 0.0000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0482 -24.0482 -22.0634 -22.0634 -21.9045 -21.9045 -18.9968 -18.9968 -8.4618 -8.4618 -7.6497 -7.6497 -7.4398 -7.4398 -2.7207 -2.7207 -2.4890 -2.4890 -2.4187 -2.4187 3.1738 3.1738 3.5642 3.5642 3.9139 3.9139 5.2931 5.2931 5.6149 5.6149 6.9394 6.9394 6.9690 6.9690 6.9758 6.9758 8.1662 8.1662 12.5724 12.5724 12.6980 12.6980 13.5563 13.5563 15.1619 15.1619 k = 0.0125 0.5000 0.4918 ( 2464 PWs) bands (ev): -46.3931 -46.3931 -24.0484 -24.0481 -22.0635 -22.0633 -21.9048 -21.9046 -18.9968 -18.9968 -8.4608 -8.4598 -7.6499 -7.6493 -7.4397 -7.4396 -2.7219 -2.7204 -2.4896 -2.4892 -2.4202 -2.4182 3.1738 3.1739 3.5642 3.5643 3.9148 3.9149 5.2898 5.2907 5.6112 5.6112 6.9367 6.9390 6.9658 6.9704 6.9795 6.9801 8.1662 8.1662 12.5727 12.5742 12.6967 12.6997 13.5563 13.5567 15.1676 15.1719 k = 0.0250 0.5000 0.4918 ( 2464 PWs) bands (ev): -46.3931 -46.3931 -24.0486 -24.0482 -22.0636 -22.0632 -21.9054 -21.9049 -18.9968 -18.9968 -8.4570 -8.4548 -7.6499 -7.6486 -7.4394 -7.4392 -2.7238 -2.7207 -2.4909 -2.4901 -2.4227 -2.4187 3.1739 3.1740 3.5641 3.5643 3.9175 3.9178 5.2808 5.2826 5.6002 5.6002 6.9249 6.9267 6.9696 6.9753 6.9914 6.9920 8.1664 8.1664 12.5750 12.5781 12.6958 12.7016 13.5566 13.5574 15.1891 15.1974 k = 0.0375 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0489 -24.0482 -22.0636 -22.0632 -21.9063 -21.9056 -18.9966 -18.9966 -8.4502 -8.4470 -7.6496 -7.6477 -7.4389 -7.4386 -2.7264 -2.7218 -2.4929 -2.4917 -2.4262 -2.4202 3.1740 3.1742 3.5639 3.5642 3.9221 3.9224 5.2663 5.2690 5.5824 5.5825 6.8978 6.8985 6.9845 6.9894 7.0111 7.0118 8.1666 8.1667 12.5794 12.5841 12.6959 12.7041 13.5572 13.5585 15.2258 15.2380 k = 0.0500 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3929 -46.3929 -24.0493 -24.0484 -22.0637 -22.0631 -21.9075 -21.9066 -18.9965 -18.9965 -8.4406 -8.4363 -7.6491 -7.6465 -7.4381 -7.4378 -2.7298 -2.7237 -2.4956 -2.4940 -2.4306 -2.4227 3.1742 3.1744 3.5637 3.5642 3.9284 3.9289 5.2468 5.2504 5.5585 5.5586 6.8559 6.8587 7.0067 7.0110 7.0382 7.0389 8.1670 8.1671 12.5857 12.5923 12.6970 12.7072 13.5582 13.5599 15.2771 15.2927 k = 0.0625 0.5000 0.4918 ( 2460 PWs) bands (ev): -46.3929 -46.3929 -24.0498 -24.0487 -22.0638 -22.0630 -21.9090 -21.9078 -18.9963 -18.9963 -8.4282 -8.4228 -7.6484 -7.6451 -7.4372 -7.4367 -2.7338 -2.7263 -2.4990 -2.4970 -2.4360 -2.4261 3.1745 3.1747 3.5635 3.5640 3.9365 3.9371 5.2227 5.2271 5.5293 5.5294 6.8026 6.8073 7.0345 7.0384 7.0719 7.0726 8.1675 8.1676 12.5940 12.6026 12.6998 12.7111 13.5595 13.5615 15.3420 15.3606 k = 0.0750 0.5000 0.4918 ( 2460 PWs) bands (ev): -46.3929 -46.3929 -24.0504 -24.0490 -22.0638 -22.0629 -21.9107 -21.9094 -18.9960 -18.9960 -8.4130 -8.4065 -7.6474 -7.6434 -7.4360 -7.4354 -2.7386 -2.7297 -2.5031 -2.5007 -2.4423 -2.4305 3.1747 3.1750 3.5632 3.5638 3.9464 3.9470 5.1946 5.1997 5.4957 5.4959 6.7389 6.7453 7.0669 7.0706 7.1114 7.1121 8.1680 8.1682 12.6040 12.6151 12.7047 12.7164 13.5611 13.5635 15.4192 15.4403 k = 0.0875 0.5000 0.4918 ( 2460 PWs) bands (ev): -46.3929 -46.3929 -24.0510 -24.0495 -22.0639 -22.0628 -21.9127 -21.9113 -18.9958 -18.9958 -8.3951 -8.3875 -7.6462 -7.6415 -7.4346 -7.4340 -2.7440 -2.7337 -2.5079 -2.5050 -2.4494 -2.4357 3.1751 3.1754 3.5628 3.5635 3.9578 3.9585 5.1628 5.1687 5.4586 5.4588 6.6657 6.6736 7.1034 7.1068 7.1557 7.1563 8.1687 8.1689 12.6159 12.6297 12.7120 12.7234 13.5629 13.5659 15.5076 15.5307 k = 0.1000 0.5000 0.4918 ( 2464 PWs) bands (ev): -46.3929 -46.3929 -24.0517 -24.0500 -22.0640 -22.0627 -21.9150 -21.9134 -18.9954 -18.9954 -8.3746 -8.3659 -7.6449 -7.6394 -7.4330 -7.4323 -2.7500 -2.7384 -2.5132 -2.5100 -2.4573 -2.4418 3.1755 3.1758 3.5623 3.5631 3.9708 3.9716 5.1281 5.1346 5.4187 5.4189 6.5839 6.5933 7.1433 7.1465 7.2039 7.2045 8.1695 8.1697 12.6295 12.6464 12.7221 12.7324 13.5651 13.5684 15.6058 15.6302 k = 0.1125 0.5000 0.4918 ( 2460 PWs) bands (ev): -46.3927 -46.3927 -24.0525 -24.0505 -22.0640 -22.0626 -21.9176 -21.9158 -18.9951 -18.9951 -8.3516 -8.3418 -7.6433 -7.6370 -7.4313 -7.4304 -2.7566 -2.7437 -2.5192 -2.5155 -2.4659 -2.4487 3.1759 3.1763 3.5616 3.5626 3.9853 3.9862 5.0908 5.0980 5.3768 5.3770 6.4944 6.5053 7.1860 7.1891 7.2551 7.2557 8.1703 8.1705 12.6450 12.6651 12.7353 12.7438 13.5676 13.5713 15.7121 15.7374 k = 0.1250 0.5000 0.4918 ( 2452 PWs) bands (ev): -46.3926 -46.3926 -24.0533 -24.0512 -22.0641 -22.0625 -21.9203 -21.9184 -18.9947 -18.9947 -8.3262 -8.3153 -7.6415 -7.6344 -7.4293 -7.4284 -2.7638 -2.7496 -2.5257 -2.5216 -2.4752 -2.4563 3.1764 3.1768 3.5608 3.5619 4.0011 4.0021 5.0514 5.0592 5.3334 5.3336 6.3983 6.4106 7.2311 7.2340 7.3087 7.3092 8.1713 8.1715 12.6624 12.6859 12.7516 12.7578 13.5703 13.5745 15.8252 15.8508 k = 0.1375 0.5000 0.4918 ( 2452 PWs) bands (ev): -46.3925 -46.3925 -24.0542 -24.0519 -22.0642 -22.0625 -21.9232 -21.9212 -18.9942 -18.9942 -8.2985 -8.2865 -7.6395 -7.6316 -7.4272 -7.4262 -2.7714 -2.7562 -2.5327 -2.5282 -2.4852 -2.4647 3.1770 3.1774 3.5598 3.5610 4.0183 4.0193 5.0103 5.0187 5.2891 5.2893 6.2967 6.3102 7.2779 7.2806 7.3640 7.3644 8.1723 8.1726 12.6818 12.7086 12.7710 12.7745 13.5732 13.5779 15.9435 15.9689 k = 0.1500 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3923 -46.3923 -24.0551 -24.0527 -22.0642 -22.0624 -21.9263 -21.9242 -18.9938 -18.9938 -8.2688 -8.2556 -7.6374 -7.6286 -7.4249 -7.4238 -2.7795 -2.7632 -2.5402 -2.5353 -2.4956 -2.4736 3.1776 3.1780 3.5585 3.5598 4.0366 4.0377 4.9678 4.9767 5.2443 5.2445 6.1904 6.2053 7.3261 7.3286 7.4204 7.4208 8.1734 8.1737 12.7033 12.7333 12.7934 12.7942 13.5764 13.5815 16.0654 16.0901 k = 0.1625 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3922 -46.3922 -24.0561 -24.0535 -22.0643 -22.0623 -21.9295 -21.9274 -18.9933 -18.9933 -8.2370 -8.2226 -7.6352 -7.6253 -7.4225 -7.4213 -2.7881 -2.7707 -2.5481 -2.5428 -2.5065 -2.4831 3.1782 3.1787 3.5569 3.5583 4.0559 4.0571 4.9241 4.9336 5.1994 5.1997 6.0807 6.0968 7.3751 7.3774 7.4775 7.4779 8.1745 8.1749 12.7270 12.7598 12.8167 12.8186 13.5797 13.5853 16.1891 16.2127 k = 0.1750 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3922 -46.3922 -24.0571 -24.0544 -22.0644 -22.0623 -21.9329 -21.9307 -18.9928 -18.9928 -8.2036 -8.1879 -7.6328 -7.6218 -7.4199 -7.4186 -2.7969 -2.7787 -2.5564 -2.5507 -2.5179 -2.4931 3.1788 3.1793 3.5549 3.5565 4.0762 4.0774 4.8795 4.8894 5.1548 5.1550 5.9686 5.9858 7.4247 7.4268 7.5348 7.5352 8.1758 8.1762 12.7531 12.7881 12.8421 12.8465 13.5832 13.5893 16.3130 16.3348 k = 0.1875 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3921 -46.3921 -24.0581 -24.0553 -22.0646 -22.0623 -21.9364 -21.9341 -18.9923 -18.9923 -8.1685 -8.1515 -7.6302 -7.6181 -7.4173 -7.4158 -2.8061 -2.7871 -2.5650 -2.5589 -2.5295 -2.5035 3.1795 3.1800 3.5525 3.5542 4.0972 4.0985 4.8341 4.8445 5.1107 5.1109 5.8551 5.8734 7.4743 7.4762 7.5919 7.5924 8.1770 8.1775 12.7815 12.8183 12.8703 12.8770 13.5869 13.5934 16.4351 16.4544 k = 0.2000 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3920 -46.3920 -24.0592 -24.0563 -22.0647 -22.0623 -21.9399 -21.9377 -18.9917 -18.9917 -8.1320 -8.1136 -7.6276 -7.6142 -7.4145 -7.4130 -2.8155 -2.7958 -2.5739 -2.5674 -2.5414 -2.5143 3.1802 3.1808 3.5496 3.5514 4.1189 4.1202 4.7879 4.7987 5.0672 5.0675 5.7413 5.7606 7.5237 7.5255 7.6486 7.6491 8.1783 8.1789 12.8122 12.8503 12.9011 12.9097 13.5907 13.5977 16.5532 16.5694 k = 0.2125 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3919 -46.3919 -24.0603 -24.0574 -22.0648 -22.0623 -21.9435 -21.9413 -18.9912 -18.9912 -8.0944 -8.0745 -7.6248 -7.6100 -7.4116 -7.4100 -2.8251 -2.8048 -2.5830 -2.5761 -2.5534 -2.5254 3.1809 3.1815 3.5460 3.5479 4.1411 4.1424 4.7409 4.7521 5.0248 5.0250 5.6284 5.6485 7.5727 7.5742 7.7045 7.7051 8.1797 8.1804 12.8452 12.8841 12.9344 12.9446 13.5946 13.6022 16.6648 16.6772 k = 0.2250 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3918 -46.3918 -24.0614 -24.0584 -22.0650 -22.0623 -21.9471 -21.9450 -18.9906 -18.9906 -8.0558 -8.0344 -7.6219 -7.6056 -7.4086 -7.4069 -2.8347 -2.8141 -2.5923 -2.5850 -2.5655 -2.5367 3.1817 3.1823 3.5416 3.5437 4.1638 4.1651 4.6932 4.7046 4.9834 4.9836 5.5174 5.5383 7.6209 7.6222 7.7593 7.7599 8.1811 8.1818 12.8804 12.9197 12.9698 12.9814 13.5986 13.6067 16.7674 16.7752 k = 0.2375 0.5000 0.4918 ( 2440 PWs) bands (ev): -46.3916 -46.3916 -24.0625 -24.0595 -22.0652 -22.0624 -21.9507 -21.9487 -18.9900 -18.9900 -8.0167 -7.9934 -7.6189 -7.6008 -7.4056 -7.4038 -2.8445 -2.8235 -2.6017 -2.5941 -2.5776 -2.5481 3.1824 3.1831 3.5364 3.5386 4.1866 4.1879 4.6445 4.6562 4.9432 4.9434 5.4096 5.4311 7.6680 7.6692 7.8128 7.8136 8.1825 8.1834 12.9177 12.9568 13.0072 13.0199 13.6026 13.6114 16.8582 16.8607 k = 0.2500 0.5000 0.4918 ( 2440 PWs) bands (ev): -46.3915 -46.3915 -24.0636 -24.0606 -22.0654 -22.0625 -21.9543 -21.9524 -18.9894 -18.9894 -7.9772 -7.9519 -7.6159 -7.5958 -7.4026 -7.4006 -2.8542 -2.8331 -2.6111 -2.6032 -2.5896 -2.5596 3.1832 3.1838 3.5301 3.5325 4.2095 4.2108 4.5948 4.6065 4.9044 4.9046 5.3060 5.3278 7.7140 7.7150 7.8648 7.8657 8.1839 8.1850 12.9567 12.9955 13.0462 13.0599 13.6067 13.6161 16.9314 16.9347 k = 0.2625 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3915 -46.3915 -24.0647 -24.0617 -22.0656 -22.0626 -21.9579 -21.9561 -18.9889 -18.9889 -7.9377 -7.9102 -7.6127 -7.5903 -7.3995 -7.3974 -2.8639 -2.8427 -2.6205 -2.6123 -2.6014 -2.5711 3.1839 3.1846 3.5226 3.5250 4.2325 4.2337 4.5440 4.5555 4.8671 4.8672 5.2079 5.2297 7.7586 7.7595 7.9150 7.9161 8.1853 8.1866 12.9973 13.0355 13.0865 13.1011 13.6108 13.6209 16.9863 16.9954 k = 0.2750 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3915 -46.3915 -24.0658 -24.0629 -22.0659 -22.0628 -21.9614 -21.9597 -18.9883 -18.9883 -7.8986 -7.8685 -7.6094 -7.5843 -7.3964 -7.3942 -2.8735 -2.8524 -2.6299 -2.6214 -2.6130 -2.5825 3.1846 3.1854 3.5136 3.5161 4.2552 4.2564 4.4920 4.5030 4.8313 4.8314 5.1161 5.1378 7.8016 7.8023 7.9633 7.9646 8.1868 8.1883 13.0393 13.0767 13.1279 13.1434 13.6149 13.6257 17.0257 17.0404 k = 0.2875 0.5000 0.4918 ( 2452 PWs) bands (ev): -46.3914 -46.3914 -24.0669 -24.0640 -22.0662 -22.0630 -21.9648 -21.9632 -18.9877 -18.9877 -7.8602 -7.8272 -7.6059 -7.5776 -7.3932 -7.3909 -2.8828 -2.8619 -2.6391 -2.6305 -2.6242 -2.5938 3.1854 3.1861 3.5029 3.5055 4.2776 4.2788 4.4389 4.4492 4.7971 4.7973 5.0317 5.0527 7.8428 7.8434 8.0095 8.0112 8.1882 8.1901 13.0823 13.1187 13.1700 13.1864 13.6190 13.6307 17.0513 17.0708 k = 0.3000 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3913 -46.3913 -24.0680 -24.0651 -22.0664 -22.0632 -21.9680 -21.9666 -18.9872 -18.9872 -7.8232 -7.7867 -7.6021 -7.5701 -7.3901 -7.3876 -2.8919 -2.8714 -2.6482 -2.6396 -2.6349 -2.6049 3.1861 3.1868 3.4903 3.4930 4.2995 4.3007 4.3851 4.3944 4.7646 4.7648 4.9551 4.9751 7.8822 7.8827 8.0533 8.0555 8.1897 8.1921 13.1261 13.1613 13.2126 13.2299 13.6231 13.6357 17.0656 17.0892 k = 0.3125 0.5000 0.4918 ( 2436 PWs) bands (ev): -46.3910 -46.3910 -24.0690 -24.0662 -22.0667 -22.0635 -21.9711 -21.9699 -18.9866 -18.9866 -7.7880 -7.7475 -7.5978 -7.5614 -7.3869 -7.3844 -2.9007 -2.8807 -2.6570 -2.6489 -2.6447 -2.6157 3.1867 3.1875 3.4755 3.4782 4.3208 4.3219 4.3314 4.3394 4.7339 4.7341 4.8865 4.9052 7.9196 7.9200 8.0944 8.0975 8.1912 8.1945 13.1704 13.2042 13.2552 13.2734 13.6272 13.6409 17.0710 17.0980 k = 0.3250 0.5000 0.4918 ( 2436 PWs) bands (ev): -46.3909 -46.3909 -24.0700 -24.0673 -22.0670 -22.0638 -21.9741 -21.9730 -18.9861 -18.9861 -7.7554 -7.7104 -7.5926 -7.5514 -7.3838 -7.3811 -2.9091 -2.8897 -2.6655 -2.6583 -2.6536 -2.6262 3.1874 3.1881 3.4582 3.4610 4.2781 4.2848 4.3416 4.3427 4.7050 4.7052 4.8257 4.8429 7.9550 7.9553 8.1319 8.1369 8.1928 8.1980 13.2147 13.2470 13.2975 13.3167 13.6314 13.6461 17.0699 17.0997 k = 0.3375 0.5000 0.4918 ( 2436 PWs) bands (ev): -46.3909 -46.3909 -24.0709 -24.0683 -22.0674 -22.0642 -21.9769 -21.9760 -18.9856 -18.9856 -7.7259 -7.6767 -7.5853 -7.5396 -7.3807 -7.3778 -2.9172 -2.8985 -2.6737 -2.6676 -2.6618 -2.6364 3.1879 3.1887 3.4385 3.4412 4.2269 4.2322 4.3614 4.3625 4.6779 4.6781 4.7723 4.7878 7.9882 7.9883 8.1634 8.1726 8.1957 8.2052 13.2587 13.2894 13.3389 13.3593 13.6356 13.6516 17.0643 17.0962 k = 0.3500 0.5000 0.4918 ( 2440 PWs) bands (ev): -46.3908 -46.3908 -24.0718 -24.0693 -22.0677 -22.0645 -21.9796 -21.9788 -18.9851 -18.9851 -7.7001 -7.6486 -7.5743 -7.5258 -7.3775 -7.3744 -2.9247 -2.9070 -2.6815 -2.6766 -2.6695 -2.6461 3.1884 3.1892 3.4163 3.4188 4.1786 4.1826 4.3803 4.3813 4.6527 4.6529 4.7257 4.7394 8.0191 8.0192 8.1821 8.1914 8.2129 8.2225 13.3019 13.3310 13.3791 13.4007 13.6399 13.6574 17.0557 17.0892 k = 0.3625 0.5000 0.4918 ( 2440 PWs) bands (ev): -46.3908 -46.3908 -24.0726 -24.0703 -22.0680 -22.0650 -21.9820 -21.9814 -18.9846 -18.9846 -7.6784 -7.6287 -7.5572 -7.5100 -7.3742 -7.3710 -2.9318 -2.9150 -2.6888 -2.6850 -2.6766 -2.6553 3.1888 3.1896 3.3917 3.3940 4.1342 4.1370 4.3980 4.3990 4.6295 4.6296 4.6850 4.6970 8.0477 8.0477 8.1893 8.1943 8.2434 8.2486 13.3440 13.3713 13.4174 13.4404 13.6446 13.6636 17.0452 17.0798 k = 0.3750 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3907 -46.3907 -24.0734 -24.0712 -22.0684 -22.0654 -21.9843 -21.9838 -18.9842 -18.9842 -7.6607 -7.6166 -7.5347 -7.4926 -7.3708 -7.3675 -2.9383 -2.9227 -2.6957 -2.6928 -2.6831 -2.6639 3.1890 3.1898 3.3653 3.3674 4.0944 4.0962 4.4147 4.4156 4.6081 4.6083 4.6496 4.6601 8.0739 8.0739 8.1926 8.1958 8.2725 8.2759 13.3846 13.4100 13.4533 13.4778 13.6497 13.6703 17.0337 17.0689 k = 0.3875 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3907 -46.3907 -24.0740 -24.0721 -22.0687 -22.0659 -21.9863 -21.9860 -18.9838 -18.9838 -7.6465 -7.6095 -7.5100 -7.4746 -7.3671 -7.3638 -2.9442 -2.9298 -2.7021 -2.6999 -2.6891 -2.6720 3.1890 3.1899 3.3378 3.3395 4.0594 4.0605 4.4300 4.4309 4.5887 4.5889 4.6190 4.6280 8.0977 8.0978 8.1947 8.1970 8.2992 8.3016 13.4231 13.4466 13.4861 13.5121 13.6556 13.6778 17.0220 17.0571 k = 0.4000 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3906 -46.3906 -24.0747 -24.0729 -22.0689 -22.0664 -21.9882 -21.9879 -18.9835 -18.9835 -7.6354 -7.6050 -7.4859 -7.4568 -7.3630 -7.3598 -2.9495 -2.9364 -2.7079 -2.7064 -2.6945 -2.6794 3.1887 3.1896 3.3100 3.3113 4.0294 4.0301 4.4440 4.4448 4.5713 4.5715 4.5927 4.6003 8.1191 8.1191 8.1964 8.1980 8.3232 8.3251 13.4592 13.4807 13.5153 13.5424 13.6629 13.6861 17.0105 17.0449 k = 0.4125 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3905 -46.3905 -24.0752 -24.0736 -22.0692 -22.0668 -21.9898 -21.9896 -18.9831 -18.9831 -7.6265 -7.6019 -7.4640 -7.4405 -7.3584 -7.3555 -2.9541 -2.9425 -2.7131 -2.7122 -2.6992 -2.6861 3.1878 3.1889 3.2832 3.2840 4.0043 4.0045 4.4566 4.4573 4.5559 4.5561 4.5702 4.5765 8.1379 8.1380 8.1977 8.1990 8.3445 8.3459 13.4923 13.5119 13.5403 13.5677 13.6720 13.6955 16.9999 17.0327 k = 0.4250 0.5000 0.4918 ( 2448 PWs) bands (ev): -46.3906 -46.3906 -24.0757 -24.0743 -22.0694 -22.0673 -21.9912 -21.9911 -18.9829 -18.9828 -7.6195 -7.5998 -7.4450 -7.4264 -7.3531 -7.3506 -2.9581 -2.9480 -2.7177 -2.7172 -2.7033 -2.6922 3.1861 3.1873 3.2586 3.2590 3.9835 3.9836 4.4677 4.4683 4.5425 4.5428 4.5513 4.5564 8.1542 8.1543 8.1989 8.1999 8.3630 8.3641 13.5221 13.5398 13.5610 13.5871 13.6835 13.7056 16.9903 17.0208 k = 0.4375 0.5000 0.4918 ( 2444 PWs) bands (ev): -46.3905 -46.3905 -24.0760 -24.0749 -22.0695 -22.0677 -21.9924 -21.9923 -18.9826 -18.9826 -7.6138 -7.5984 -7.4295 -7.4152 -7.3471 -7.3453 -2.9613 -2.9527 -2.7216 -2.7214 -2.7067 -2.6975 3.1828 3.1841 3.2379 3.2380 3.9668 3.9669 4.4772 4.4777 4.5309 4.5314 4.5358 4.5397 8.1678 8.1679 8.2001 8.2008 8.3787 8.3796 13.5481 13.5640 13.5773 13.6010 13.6968 13.7160 16.9823 17.0095 k = 0.4500 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3906 -46.3906 -24.0764 -24.0754 -22.0696 -22.0682 -21.9934 -21.9934 -18.9824 -18.9824 -7.6093 -7.5976 -7.4174 -7.4069 -7.3409 -7.3398 -2.9638 -2.9569 -2.7249 -2.7249 -2.7093 -2.7020 3.1769 3.1783 3.2226 3.2230 3.9537 3.9538 4.4851 4.4855 4.5210 4.5220 4.5238 4.5263 8.1787 8.1788 8.2014 8.2019 8.3916 8.3923 13.5699 13.5842 13.5897 13.6101 13.7105 13.7259 16.9760 16.9990 k = 0.4625 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3906 -46.3906 -24.0765 -24.0758 -22.0697 -22.0686 -21.9942 -21.9942 -18.9823 -18.9823 -7.6057 -7.5972 -7.4086 -7.4014 -7.3351 -7.3345 -2.9656 -2.9604 -2.7276 -2.7275 -2.7112 -2.7058 3.1689 3.1700 3.2136 3.2140 3.9440 3.9441 4.4913 4.4917 4.5124 4.5143 4.5155 4.5161 8.1866 8.1868 8.2029 8.2032 8.4016 8.4021 13.5871 13.5984 13.6005 13.6162 13.7231 13.7344 16.9716 16.9897 k = 0.4750 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3906 -46.3906 -24.0767 -24.0762 -22.0696 -22.0689 -21.9947 -21.9947 -18.9821 -18.9821 -7.6029 -7.5973 -7.4026 -7.3980 -7.3303 -7.3301 -2.9666 -2.9631 -2.7295 -2.7294 -2.7123 -2.7087 3.1610 3.1617 3.2092 3.2095 3.9372 3.9374 4.4959 4.4963 4.5062 4.5078 4.5096 4.5097 8.1916 8.1917 8.2047 8.2048 8.4088 8.4091 13.5994 13.6047 13.6119 13.6200 13.7333 13.7407 16.9693 16.9818 k = 0.4875 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0767 -24.0764 -22.0696 -22.0692 -21.9950 -21.9950 -18.9821 -18.9821 -7.6007 -7.5979 -7.3988 -7.3966 -7.3273 -7.3272 -2.9669 -2.9651 -2.7306 -2.7306 -2.7126 -2.7108 3.1554 3.1558 3.2073 3.2075 3.9333 3.9334 4.4989 4.4992 4.5029 4.5037 4.5057 4.5059 8.1940 8.1941 8.2063 8.2064 8.4132 8.4133 13.6065 13.6082 13.6191 13.6222 13.7404 13.7440 16.9693 16.9756 k = 0.5000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0766 -24.0766 -22.0694 -22.0694 -21.9952 -21.9952 -18.9821 -18.9821 -7.5990 -7.5990 -7.3968 -7.3968 -7.3262 -7.3262 -2.9664 -2.9664 -2.7310 -2.7310 -2.7121 -2.7121 3.1536 3.1536 3.2068 3.2068 3.9320 3.9320 4.4998 4.4998 4.5032 4.5032 4.5036 4.5036 8.1948 8.1948 8.2070 8.2070 8.4147 8.4147 13.6090 13.6090 13.6223 13.6223 13.7440 13.7440 16.9714 16.9714 k = 0.5000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0766 -24.0766 -22.0694 -22.0694 -21.9952 -21.9952 -18.9821 -18.9821 -7.5990 -7.5990 -7.3968 -7.3968 -7.3262 -7.3262 -2.9664 -2.9664 -2.7310 -2.7310 -2.7121 -2.7121 3.1536 3.1536 3.2068 3.2068 3.9320 3.9320 4.4998 4.4998 4.5032 4.5032 4.5036 4.5036 8.1948 8.1948 8.2070 8.2070 8.4147 8.4147 13.6090 13.6090 13.6223 13.6223 13.7440 13.7440 16.9714 16.9714 k = 0.4911 0.4911 0.4918 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0767 -24.0764 -22.0696 -22.0692 -21.9950 -21.9950 -18.9821 -18.9821 -7.6007 -7.5979 -7.3988 -7.3966 -7.3273 -7.3273 -2.9669 -2.9651 -2.7306 -2.7305 -2.7126 -2.7108 3.1555 3.1559 3.2073 3.2074 3.9333 3.9334 4.4991 4.4997 4.5025 4.5031 4.5058 4.5061 8.1940 8.1942 8.2063 8.2063 8.4131 8.4133 13.6065 13.6081 13.6193 13.6219 13.7403 13.7440 16.9693 16.9757 k = 0.4821 0.4821 0.4918 ( 2456 PWs) bands (ev): -46.3906 -46.3906 -24.0767 -24.0762 -22.0697 -22.0689 -21.9947 -21.9947 -18.9821 -18.9821 -7.6029 -7.5973 -7.4024 -7.3980 -7.3305 -7.3305 -2.9666 -2.9631 -2.7295 -2.7293 -2.7123 -2.7086 3.1616 3.1623 3.2089 3.2091 3.9373 3.9374 4.4980 4.4991 4.5039 4.5048 4.5099 4.5102 8.1919 8.1921 8.2043 8.2043 8.4087 8.4090 13.6002 13.6038 13.6135 13.6181 13.7331 13.7404 16.9696 16.9819 k = 0.4732 0.4732 0.4918 ( 2454 PWs) bands (ev): -46.3905 -46.3905 -24.0765 -24.0758 -22.0697 -22.0685 -21.9941 -21.9941 -18.9823 -18.9823 -7.6057 -7.5973 -7.4078 -7.4011 -7.3358 -7.3357 -2.9655 -2.9603 -2.7278 -2.7272 -2.7113 -2.7055 3.1719 3.1730 3.2115 3.2119 3.9439 3.9440 4.4969 4.4984 4.5070 4.5081 4.5157 4.5160 8.1881 8.1884 8.2012 8.2012 8.4014 8.4019 13.5894 13.5962 13.6053 13.6108 13.7223 13.7333 16.9726 16.9900 k = 0.4643 0.4643 0.4918 ( 2450 PWs) bands (ev): -46.3905 -46.3905 -24.0763 -24.0754 -22.0696 -22.0681 -21.9934 -21.9934 -18.9824 -18.9824 -7.6091 -7.5977 -7.4150 -7.4057 -7.3432 -7.3430 -2.9637 -2.9569 -2.7254 -2.7242 -2.7095 -2.7015 3.1864 3.1878 3.2151 3.2155 3.9531 3.9533 4.4958 4.4980 4.5114 4.5128 4.5233 4.5237 8.1826 8.1829 8.1972 8.1972 8.3913 8.3919 13.5740 13.5847 13.5949 13.6005 13.7083 13.7229 16.9784 17.0001 k = 0.4554 0.4554 0.4918 ( 2446 PWs) bands (ev): -46.3905 -46.3905 -24.0760 -24.0748 -22.0695 -22.0676 -21.9924 -21.9923 -18.9826 -18.9826 -7.6133 -7.5986 -7.4240 -7.4117 -7.3526 -7.3521 -2.9611 -2.9527 -2.7225 -2.7203 -2.7070 -2.6965 3.2049 3.2067 3.2196 3.2200 3.9649 3.9651 4.4951 4.4978 4.5172 4.5189 4.5328 4.5333 8.1752 8.1754 8.1924 8.1925 8.3783 8.3792 13.5540 13.5690 13.5824 13.5876 13.6914 13.7095 16.9872 17.0122 k = 0.4464 0.4464 0.4918 ( 2446 PWs) bands (ev): -46.3905 -46.3905 -24.0756 -24.0742 -22.0694 -22.0671 -21.9911 -21.9911 -18.9829 -18.9829 -7.6182 -7.6001 -7.4348 -7.4192 -7.3639 -7.3630 -2.9578 -2.9480 -2.7191 -2.7156 -2.7038 -2.6906 3.2243 3.2251 3.2278 3.2297 3.9793 3.9795 4.4947 4.4981 4.5244 4.5264 4.5445 4.5449 8.1658 8.1660 8.1869 8.1871 8.3627 8.3638 13.5296 13.5484 13.5676 13.5726 13.6720 13.6932 16.9989 17.0263 k = 0.4375 0.4375 0.4918 ( 2450 PWs) bands (ev): -46.3907 -46.3907 -24.0752 -24.0735 -22.0691 -22.0665 -21.9897 -21.9897 -18.9832 -18.9832 -7.6241 -7.6021 -7.4474 -7.4279 -7.3770 -7.3755 -2.9538 -2.9428 -2.7152 -2.7101 -2.6999 -2.6838 3.2302 3.2308 3.2540 3.2564 3.9961 3.9962 4.4948 4.4991 4.5329 4.5353 4.5582 4.5587 8.1546 8.1547 8.1806 8.1810 8.3445 8.3458 13.5009 13.5227 13.5505 13.5555 13.6503 13.6744 17.0136 17.0426 k = 0.4286 0.4286 0.4918 ( 2442 PWs) bands (ev): -46.3906 -46.3906 -24.0746 -24.0727 -22.0688 -22.0658 -21.9880 -21.9880 -18.9835 -18.9835 -7.6309 -7.6048 -7.4617 -7.4377 -7.3919 -7.3895 -2.9492 -2.9370 -2.7107 -2.7039 -2.6951 -2.6762 3.2362 3.2368 3.2843 3.2871 4.0151 4.0152 4.4959 4.5011 4.5429 4.5456 4.5742 4.5747 8.1416 8.1416 8.1734 8.1741 8.3238 8.3254 13.4680 13.4921 13.5312 13.5365 13.6268 13.6533 17.0309 17.0609 k = 0.4196 0.4196 0.4918 ( 2434 PWs) bands (ev): -46.3905 -46.3905 -24.0739 -24.0719 -22.0684 -22.0651 -21.9862 -21.9862 -18.9839 -18.9839 -7.6389 -7.6082 -7.4777 -7.4485 -7.4082 -7.4048 -2.9439 -2.9307 -2.7058 -2.6973 -2.6893 -2.6677 3.2425 3.2429 3.3183 3.3216 4.0359 4.0363 4.4982 4.5044 4.5544 4.5574 4.5925 4.5929 8.1268 8.1269 8.1654 8.1663 8.3008 8.3026 13.4311 13.4567 13.5097 13.5156 13.6018 13.6302 17.0508 17.0813 k = 0.4107 0.4107 0.4918 ( 2438 PWs) bands (ev): -46.3907 -46.3907 -24.0732 -24.0709 -22.0680 -22.0644 -21.9841 -21.9841 -18.9843 -18.9843 -7.6483 -7.6125 -7.4952 -7.4601 -7.4259 -7.4211 -2.9380 -2.9241 -2.7005 -2.6906 -2.6823 -2.6586 3.2487 3.2491 3.3560 3.3596 4.0583 4.0591 4.5021 4.5096 4.5673 4.5707 4.6132 4.6135 8.1104 8.1106 8.1564 8.1576 8.2754 8.2776 13.3901 13.4166 13.4861 13.4927 13.5753 13.6054 17.0728 17.1034 k = 0.4018 0.4018 0.4918 ( 2438 PWs) bands (ev): -46.3907 -46.3907 -24.0724 -24.0699 -22.0675 -22.0636 -21.9819 -21.9819 -18.9847 -18.9847 -7.6592 -7.6181 -7.5141 -7.4724 -7.4447 -7.4383 -2.9317 -2.9171 -2.6946 -2.6839 -2.6740 -2.6487 3.2549 3.2551 3.3971 3.4011 4.0817 4.0830 4.5083 4.5173 4.5818 4.5856 4.6364 4.6366 8.0926 8.0928 8.1463 8.1479 8.2480 8.2506 13.3452 13.3720 13.4606 13.4682 13.5476 13.5789 17.0967 17.1271 k = 0.3929 0.3929 0.4918 ( 2434 PWs) bands (ev): -46.3908 -46.3908 -24.0715 -24.0688 -22.0670 -22.0627 -21.9795 -21.9795 -18.9852 -18.9852 -7.6719 -7.6253 -7.5337 -7.4854 -7.4641 -7.4560 -2.9248 -2.9098 -2.6884 -2.6772 -2.6645 -2.6383 3.2609 3.2610 3.4415 3.4459 4.1056 4.1075 4.5174 4.5280 4.5979 4.6022 4.6621 4.6623 8.0732 8.0736 8.1351 8.1372 8.2186 8.2217 13.2967 13.3234 13.4334 13.4420 13.5188 13.5511 17.1221 17.1520 k = 0.3839 0.3839 0.4918 ( 2434 PWs) bands (ev): -46.3909 -46.3909 -24.0705 -24.0677 -22.0664 -22.0618 -21.9769 -21.9769 -18.9857 -18.9857 -7.6867 -7.6351 -7.5534 -7.4998 -7.4830 -7.4740 -2.9175 -2.9022 -2.6817 -2.6702 -2.6542 -2.6274 3.2664 3.2665 3.4889 3.4938 4.1293 4.1320 4.5300 4.5423 4.6158 4.6205 4.6907 4.6908 8.0525 8.0529 8.1226 8.1254 8.1874 8.1914 13.2446 13.2709 13.4047 13.4144 13.4888 13.5220 17.1486 17.1778 k = 0.3750 0.3750 0.4918 ( 2434 PWs) bands (ev): -46.3910 -46.3910 -24.0695 -24.0664 -22.0657 -22.0608 -21.9741 -21.9741 -18.9863 -18.9863 -7.7036 -7.6485 -7.5723 -7.5173 -7.4992 -7.4920 -2.9099 -2.8944 -2.6747 -2.6630 -2.6432 -2.6161 3.2714 3.2718 3.5393 3.5446 4.1520 4.1556 4.5466 4.5609 4.6354 4.6406 4.7222 4.7223 8.0305 8.0310 8.1084 8.1125 8.1547 8.1600 13.1892 13.2148 13.3746 13.3854 13.4579 13.4917 17.1758 17.2041 k = 0.3661 0.3661 0.4918 ( 2432 PWs) bands (ev): -46.3910 -46.3910 -24.0684 -24.0652 -22.0650 -22.0599 -21.9711 -21.9711 -18.9869 -18.9868 -7.7229 -7.6663 -7.5899 -7.5381 -7.5123 -7.5095 -2.9019 -2.8865 -2.6673 -2.6555 -2.6316 -2.6044 3.2760 3.2765 3.5924 3.5981 4.1733 4.1778 4.5679 4.5841 4.6570 4.6627 4.7568 4.7570 8.0072 8.0078 8.0916 8.0984 8.1207 8.1287 13.1306 13.1554 13.3433 13.3554 13.4260 13.4605 17.2032 17.2305 k = 0.3571 0.3571 0.4918 ( 2434 PWs) bands (ev): -46.3912 -46.3912 -24.0672 -24.0638 -22.0642 -22.0588 -21.9680 -21.9680 -18.9875 -18.9874 -7.7446 -7.6886 -7.6062 -7.5608 -7.5258 -7.5233 -2.8937 -2.8784 -2.6595 -2.6476 -2.6197 -2.5925 3.2800 3.2808 3.6480 3.6541 4.1928 4.1981 4.5939 4.6119 4.6805 4.6868 4.7949 4.7953 7.9827 7.9833 8.0698 8.0804 8.0880 8.0999 13.0690 13.0928 13.3111 13.3244 13.3933 13.4284 17.2304 17.2566 k = 0.3482 0.3482 0.4918 ( 2430 PWs) bands (ev): -46.3912 -46.3912 -24.0659 -24.0624 -22.0634 -22.0578 -21.9648 -21.9648 -18.9881 -18.9880 -7.7685 -7.7149 -7.6223 -7.5846 -7.5405 -7.5329 -2.8852 -2.8701 -2.6514 -2.6396 -2.6074 -2.5804 3.2835 3.2845 3.7057 3.7122 4.2105 4.2164 4.6245 4.6443 4.7063 4.7132 4.8369 4.8373 7.9570 7.9577 8.0407 8.0470 8.0686 8.0762 13.0046 13.0273 13.2782 13.2927 13.3599 13.3957 17.2569 17.2820 k = 0.3393 0.3393 0.4918 ( 2430 PWs) bands (ev): -46.3913 -46.3913 -24.0646 -24.0610 -22.0625 -22.0567 -21.9614 -21.9614 -18.9887 -18.9887 -7.7946 -7.7441 -7.6394 -7.6091 -7.5530 -7.5414 -2.8766 -2.8619 -2.6430 -2.6312 -2.5949 -2.5683 3.2865 3.2878 3.7653 3.7722 4.2264 4.2329 4.6593 4.6805 4.7345 4.7420 4.8830 4.8833 7.9301 7.9308 8.0063 8.0096 8.0509 8.0556 12.9375 12.9591 13.2446 13.2604 13.3259 13.3623 17.2822 17.3061 k = 0.3304 0.3304 0.4918 ( 2430 PWs) bands (ev): -46.3914 -46.3914 -24.0633 -24.0595 -22.0616 -22.0555 -21.9579 -21.9579 -18.9894 -18.9894 -7.8227 -7.7756 -7.6581 -7.6341 -7.5632 -7.5489 -2.8679 -2.8535 -2.6344 -2.6227 -2.5823 -2.5562 3.2890 3.2905 3.8265 3.8338 4.2411 4.2480 4.6975 4.7198 4.7654 4.7734 4.9335 4.9337 7.9021 7.9029 7.9695 7.9714 8.0322 8.0355 12.8678 12.8883 13.2106 13.2276 13.2914 13.3284 17.3058 17.3287 k = 0.3214 0.3214 0.4918 ( 2442 PWs) bands (ev): -46.3917 -46.3917 -24.0619 -24.0580 -22.0606 -22.0544 -21.9543 -21.9543 -18.9901 -18.9900 -7.8526 -7.8087 -7.6785 -7.6595 -7.5713 -7.5556 -2.8590 -2.8452 -2.6256 -2.6140 -2.5697 -2.5443 3.2910 3.2927 3.8889 3.8965 4.2550 4.2620 4.7383 4.7613 4.7992 4.8076 4.9886 4.9886 7.8729 7.8738 7.9315 7.9325 8.0123 8.0147 12.7958 12.8151 13.1764 13.1945 13.2565 13.2942 17.3271 17.3492 k = 0.3125 0.3125 0.4918 ( 2438 PWs) bands (ev): -46.3918 -46.3918 -24.0605 -24.0565 -22.0596 -22.0532 -21.9505 -21.9505 -18.9908 -18.9907 -7.8839 -7.8431 -7.7003 -7.6852 -7.5778 -7.5615 -2.8501 -2.8369 -2.6166 -2.6052 -2.5573 -2.5325 3.2926 3.2944 3.9522 3.9601 4.2686 4.2757 4.7811 4.8041 4.8366 4.8449 5.0480 5.0484 7.8427 7.8436 7.8929 7.8933 7.9911 7.9930 12.7215 12.7398 13.1421 13.1614 13.2216 13.2598 17.3431 17.3672 k = 0.3036 0.3036 0.4918 ( 2442 PWs) bands (ev): -46.3920 -46.3920 -24.0590 -24.0549 -22.0586 -22.0520 -21.9467 -21.9467 -18.9915 -18.9914 -7.9164 -7.8786 -7.7233 -7.7112 -7.5830 -7.5667 -2.8412 -2.8286 -2.6075 -2.5962 -2.5451 -2.5211 3.2937 3.2957 4.0160 4.0241 4.2823 4.2894 4.8254 4.8477 4.8776 4.8853 5.1119 5.1128 7.8113 7.8123 7.8539 7.8540 7.9687 7.9702 12.6451 12.6622 13.1080 13.1283 13.1867 13.2254 17.3041 17.3200 k = 0.2946 0.2946 0.4918 ( 2442 PWs) bands (ev): -46.3921 -46.3921 -24.0575 -24.0533 -22.0575 -22.0508 -21.9428 -21.9428 -18.9922 -18.9921 -7.9500 -7.9147 -7.7471 -7.7373 -7.5871 -7.5713 -2.8323 -2.8203 -2.5983 -2.5872 -2.5332 -2.5100 3.2945 3.2966 4.0799 4.0881 4.2968 4.3037 4.8709 4.8920 4.9223 4.9290 5.1802 5.1816 7.7788 7.7798 7.8147 7.8151 7.9449 7.9461 12.5667 12.5827 13.0742 13.0953 13.1520 13.1912 17.2178 17.2339 k = 0.2857 0.2857 0.4918 ( 2446 PWs) bands (ev): -46.3923 -46.3923 -24.0559 -24.0517 -22.0564 -22.0496 -21.9388 -21.9388 -18.9929 -18.9929 -7.9844 -7.9514 -7.7716 -7.7636 -7.5906 -7.5754 -2.8235 -2.8121 -2.5890 -2.5782 -2.5216 -2.4994 3.2950 3.2972 4.1437 4.1517 4.3123 4.3189 4.9176 4.9375 4.9700 4.9757 5.2525 5.2545 7.7451 7.7461 7.7757 7.7764 7.9198 7.9207 12.4865 12.5014 13.0407 13.0626 13.1176 13.1572 17.1198 17.1374 k = 0.2768 0.2768 0.4918 ( 2446 PWs) bands (ev): -46.3924 -46.3924 -24.0543 -24.0501 -22.0552 -22.0484 -21.9348 -21.9347 -18.9937 -18.9936 -8.0194 -7.9885 -7.7964 -7.7899 -7.5933 -7.5789 -2.8148 -2.8040 -2.5797 -2.5692 -2.5106 -2.4893 3.2951 3.2975 4.2068 4.2142 4.3294 4.3353 4.9656 4.9847 5.0204 5.0255 5.3285 5.3310 7.7102 7.7114 7.7371 7.7380 7.8934 7.8940 12.4044 12.4183 13.0078 13.0303 13.0838 13.1236 17.0138 17.0328 k = 0.2679 0.2679 0.4918 ( 2444 PWs) bands (ev): -46.3925 -46.3925 -24.0527 -24.0484 -22.0541 -22.0472 -21.9307 -21.9307 -18.9944 -18.9943 -8.0548 -8.0258 -7.8215 -7.8161 -7.5956 -7.5820 -2.8061 -2.7961 -2.5704 -2.5603 -2.5000 -2.4798 3.2951 3.2976 4.2689 4.2749 4.3490 4.3534 5.0150 5.0338 5.0733 5.0783 5.4078 5.4108 7.6744 7.6757 7.6991 7.7001 7.8656 7.8660 12.3208 12.3336 12.9757 12.9984 13.0507 13.0907 16.9016 16.9219 k = 0.2589 0.2589 0.4918 ( 2448 PWs) bands (ev): -46.3927 -46.3927 -24.0511 -24.0468 -22.0529 -22.0460 -21.9266 -21.9265 -18.9951 -18.9950 -8.0904 -8.0631 -7.8468 -7.8423 -7.5974 -7.5846 -2.7976 -2.7882 -2.5612 -2.5515 -2.4901 -2.4709 3.2948 3.2974 4.3298 4.3312 4.3733 4.3733 5.0657 5.0848 5.1287 5.1339 5.4900 5.4935 7.6378 7.6392 7.6616 7.6627 7.8365 7.8366 12.2356 12.2474 12.9443 12.9671 13.0186 13.0585 16.7843 16.8058 k = 0.2500 0.2500 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0495 -24.0452 -22.0517 -22.0448 -21.9224 -21.9224 -18.9958 -18.9957 -8.1261 -8.1004 -7.8720 -7.8683 -7.5988 -7.5868 -2.7893 -2.7806 -2.5521 -2.5428 -2.4808 -2.4626 3.2944 3.2971 4.3741 4.3871 4.3972 4.4116 5.1177 5.1372 5.1869 5.1924 5.5747 5.5787 7.6005 7.6021 7.6245 7.6257 7.8059 7.8060 12.1490 12.1598 12.9138 12.9365 12.9875 13.0271 16.6632 16.6857 k = 0.2411 0.2411 0.4918 ( 2456 PWs) bands (ev): -46.3931 -46.3931 -24.0479 -24.0435 -22.0505 -22.0436 -21.9183 -21.9183 -18.9965 -18.9964 -8.1617 -8.1375 -7.8971 -7.8941 -7.5999 -7.5886 -2.7812 -2.7731 -2.5432 -2.5343 -2.4721 -2.4550 3.2939 3.2966 4.4038 4.4174 4.4488 4.4635 5.1708 5.1909 5.2479 5.2537 5.6617 5.6659 7.5626 7.5643 7.5882 7.5894 7.7740 7.7743 12.0611 12.0710 12.8844 12.9066 12.9577 12.9968 16.5389 16.5625 k = 0.2321 0.2321 0.4918 ( 2460 PWs) bands (ev): -46.3933 -46.3933 -24.0462 -24.0419 -22.0492 -22.0424 -21.9141 -21.9141 -18.9972 -18.9971 -8.1972 -8.1742 -7.9221 -7.9196 -7.6006 -7.5901 -2.7733 -2.7659 -2.5345 -2.5260 -2.4641 -2.4481 3.2934 3.2961 4.4313 4.4435 4.5051 4.5179 5.2248 5.2454 5.3118 5.3177 5.7504 5.7549 7.5240 7.5258 7.5529 7.5542 7.7407 7.7413 11.9722 11.9812 12.8561 12.8776 12.9292 12.9676 16.4122 16.4367 k = 0.2232 0.2232 0.4918 ( 2458 PWs) bands (ev): -46.3934 -46.3934 -24.0446 -24.0403 -22.0480 -22.0412 -21.9100 -21.9100 -18.9979 -18.9978 -8.2322 -8.2105 -7.9468 -7.9447 -7.6011 -7.5913 -2.7657 -2.7589 -2.5260 -2.5180 -2.4566 -2.4418 3.2928 3.2955 4.4601 4.4717 4.5600 4.5718 5.2795 5.3006 5.3782 5.3841 5.8405 5.8453 7.4845 7.4862 7.5190 7.5205 7.7063 7.7072 11.8822 11.8903 12.8291 12.8495 12.9022 12.9397 16.2836 16.3089 k = 0.2143 0.2143 0.4918 ( 2458 PWs) bands (ev): -46.3935 -46.3935 -24.0430 -24.0388 -22.0468 -22.0400 -21.9059 -21.9059 -18.9986 -18.9985 -8.2668 -8.2463 -7.9711 -7.9693 -7.6012 -7.5921 -2.7583 -2.7522 -2.5178 -2.5103 -2.4498 -2.4362 3.2922 3.2949 4.4907 4.5020 4.6135 4.6245 5.3348 5.3562 5.4468 5.4524 5.9318 5.9368 7.4438 7.4454 7.4869 7.4886 7.6707 7.6719 11.7913 11.7987 12.8033 12.8225 12.8768 12.9132 16.1537 16.1798 k = 0.2054 0.2054 0.4918 ( 2456 PWs) bands (ev): -46.3936 -46.3936 -24.0414 -24.0372 -22.0455 -22.0389 -21.9018 -21.9018 -18.9993 -18.9991 -8.3008 -8.2813 -7.9950 -7.9935 -7.6011 -7.5926 -2.7513 -2.7457 -2.5099 -2.5031 -2.4436 -2.4311 3.2916 3.2943 4.5234 4.5346 4.6657 4.6760 5.3904 5.4122 5.5170 5.5222 6.0239 6.0291 7.4020 7.4033 7.4569 7.4590 7.6342 7.6357 11.6998 11.7064 12.7790 12.7967 12.8530 12.8882 16.0229 16.0497 k = 0.1964 0.1964 0.4918 ( 2460 PWs) bands (ev): -46.3938 -46.3938 -24.0398 -24.0357 -22.0443 -22.0378 -21.8979 -21.8978 -18.9999 -18.9998 -8.3341 -8.3157 -8.0183 -8.0171 -7.6008 -7.5929 -2.7445 -2.7396 -2.5025 -2.4962 -2.4379 -2.4266 3.2910 3.2936 4.5582 4.5695 4.7166 4.7263 5.4463 5.4684 5.5881 5.5929 6.1165 6.1218 7.3590 7.3600 7.4292 7.4316 7.5968 7.5987 11.6077 11.6135 12.7560 12.7721 12.8308 12.8646 15.8917 15.9192 k = 0.1875 0.1875 0.4918 ( 2464 PWs) bands (ev): -46.3940 -46.3940 -24.0382 -24.0342 -22.0431 -22.0367 -21.8939 -21.8939 -19.0005 -19.0004 -8.3666 -8.3492 -8.0411 -8.0402 -7.6003 -7.5930 -2.7382 -2.7337 -2.4955 -2.4899 -2.4326 -2.4226 3.2905 3.2931 4.5952 4.6067 4.7664 4.7755 5.5024 5.5248 5.6595 5.6638 6.2092 6.2147 7.3148 7.3155 7.4038 7.4066 7.5587 7.5611 11.5152 11.5204 12.7346 12.7490 12.8104 12.8428 15.7605 15.7886 k = 0.1786 0.1786 0.4918 ( 2464 PWs) bands (ev): -46.3941 -46.3941 -24.0367 -24.0328 -22.0419 -22.0357 -21.8901 -21.8901 -19.0011 -19.0010 -8.3982 -8.3817 -8.0633 -8.0625 -7.5996 -7.5928 -2.7321 -2.7283 -2.4890 -2.4841 -2.4277 -2.4190 3.2900 3.2925 4.6344 4.6460 4.8151 4.8237 5.5583 5.5811 5.7303 5.7342 6.3018 6.3074 7.2697 7.2699 7.3807 7.3841 7.5205 7.5235 11.4225 11.4271 12.7148 12.7274 12.7916 12.8226 15.6298 15.6585 k = 0.1696 0.1696 0.4918 ( 2464 PWs) bands (ev): -46.3942 -46.3942 -24.0352 -24.0314 -22.0407 -22.0346 -21.8863 -21.8863 -19.0017 -19.0016 -8.4287 -8.4132 -8.0847 -8.0841 -7.5987 -7.5924 -2.7265 -2.7232 -2.4831 -2.4789 -2.4232 -2.4156 3.2896 3.2920 4.6755 4.6874 4.8630 4.8710 5.6140 5.6372 5.7999 5.8033 6.3939 6.3997 7.2233 7.2237 7.3597 7.3637 7.4827 7.4864 11.3299 11.3338 12.6966 12.7075 12.7744 12.8041 15.4999 15.5292 k = 0.1607 0.1607 0.4918 ( 2460 PWs) bands (ev): -46.3943 -46.3943 -24.0338 -24.0301 -22.0395 -22.0337 -21.8827 -21.8827 -19.0023 -19.0021 -8.4582 -8.4436 -8.1054 -8.1049 -7.5976 -7.5918 -2.7213 -2.7184 -2.4777 -2.4743 -2.4188 -2.4125 3.2892 3.2916 4.7187 4.7308 4.9100 4.9175 5.6692 5.6929 5.8675 5.8704 6.4851 6.4911 7.1758 7.1769 7.3398 7.3446 7.4468 7.4513 11.2375 11.2409 12.6801 12.6893 12.7589 12.7873 15.3714 15.4011 k = 0.1518 0.1518 0.4918 ( 2460 PWs) bands (ev): -46.3944 -46.3944 -24.0324 -24.0288 -22.0384 -22.0328 -21.8792 -21.8792 -19.0028 -19.0026 -8.4866 -8.4729 -8.1253 -8.1249 -7.5965 -7.5911 -2.7165 -2.7141 -2.4731 -2.4703 -2.4146 -2.4095 3.2890 3.2912 4.7636 4.7760 4.9562 4.9633 5.7238 5.7480 5.9322 5.9348 6.5749 6.5812 7.1276 7.1296 7.3192 7.3245 7.4152 7.4204 11.1456 11.1485 12.6653 12.6729 12.7450 12.7723 15.2446 15.2747 k = 0.1429 0.1429 0.4918 ( 2464 PWs) bands (ev): -46.3945 -46.3945 -24.0310 -24.0276 -22.0373 -22.0319 -21.8758 -21.8758 -19.0033 -19.0032 -8.5137 -8.5008 -8.1443 -8.1440 -7.5952 -7.5903 -2.7121 -2.7102 -2.4691 -2.4670 -2.4105 -2.4065 3.2888 3.2909 4.8103 4.8229 5.0016 5.0083 5.7774 5.8023 5.9935 5.9957 6.6625 6.6693 7.0792 7.0825 7.2949 7.3000 7.3920 7.3971 11.0546 11.0570 12.6522 12.6583 12.7327 12.7590 15.1201 15.1505 k = 0.1339 0.1339 0.4918 ( 2460 PWs) bands (ev): -46.3946 -46.3946 -24.0297 -24.0264 -22.0362 -22.0310 -21.8725 -21.8725 -19.0038 -19.0036 -8.5394 -8.5274 -8.1624 -8.1622 -7.5938 -7.5893 -2.7082 -2.7066 -2.4658 -2.4643 -2.4066 -2.4035 3.2886 3.2907 4.8584 4.8714 5.0462 5.0525 5.8298 5.8554 6.0506 6.0526 6.7464 6.7543 7.0315 7.0368 7.2649 7.2690 7.3796 7.3838 10.9646 10.9667 12.6408 12.6457 12.7218 12.7474 14.9982 15.0289 k = 0.1250 0.1250 0.4918 ( 2460 PWs) bands (ev): -46.3947 -46.3947 -24.0284 -24.0253 -22.0352 -22.0303 -21.8695 -21.8694 -19.0042 -19.0041 -8.5638 -8.5527 -8.1796 -8.1794 -7.5924 -7.5883 -2.7047 -2.7035 -2.4632 -2.4621 -2.4027 -2.4005 3.2885 3.2905 4.9078 4.9211 5.0900 5.0959 5.8807 5.9072 6.1030 6.1048 6.8213 6.8315 6.9889 6.9974 7.2300 7.2329 7.3770 7.3801 10.8761 10.8778 12.6312 12.6350 12.7125 12.7374 14.8796 14.9104 k = 0.1161 0.1161 0.4918 ( 2458 PWs) bands (ev): -46.3948 -46.3948 -24.0272 -24.0243 -22.0342 -22.0296 -21.8665 -21.8665 -19.0046 -19.0045 -8.5868 -8.5764 -8.1957 -8.1956 -7.5910 -7.5872 -2.7016 -2.7007 -2.4611 -2.4604 -2.3990 -2.3975 3.2885 3.2904 4.9582 4.9718 5.1328 5.1384 5.9298 5.9573 6.1503 6.1521 6.8639 6.8745 6.9777 6.9876 7.1922 7.1940 7.3819 7.3841 10.7896 10.7909 12.6232 12.6263 12.7045 12.7289 14.7648 14.7956 k = 0.1071 0.1071 0.4918 ( 2454 PWs) bands (ev): -46.3948 -46.3948 -24.0261 -24.0234 -22.0332 -22.0289 -21.8638 -21.8638 -19.0050 -19.0049 -8.6082 -8.5987 -8.2108 -8.2108 -7.5895 -7.5861 -2.6989 -2.6984 -2.4595 -2.4592 -2.3953 -2.3945 3.2886 3.2903 5.0094 5.0233 5.1746 5.1798 5.9768 6.0055 6.1923 6.1942 6.8465 6.8498 7.0310 7.0349 7.1531 7.1541 7.3927 7.3942 10.7053 10.7063 12.6170 12.6194 12.6979 12.7220 14.6542 14.6848 k = 0.0982 0.0982 0.4918 ( 2458 PWs) bands (ev): -46.3949 -46.3949 -24.0250 -24.0225 -22.0323 -22.0283 -21.8612 -21.8612 -19.0054 -19.0053 -8.6281 -8.6194 -8.2248 -8.2248 -7.5881 -7.5850 -2.6966 -2.6963 -2.4584 -2.4583 -2.3919 -2.3915 3.2886 3.2902 5.0609 5.0751 5.2150 5.2200 6.0214 6.0515 6.2290 6.2311 6.8037 6.8047 7.1016 7.1019 7.1143 7.1154 7.4082 7.4092 10.6237 10.6245 12.6123 12.6144 12.6925 12.7165 14.5486 14.5788 k = 0.0893 0.0893 0.4918 ( 2458 PWs) bands (ev): -46.3950 -46.3950 -24.0240 -24.0217 -22.0314 -22.0278 -21.8588 -21.8588 -19.0057 -19.0056 -8.6464 -8.6385 -8.2378 -8.2378 -7.5867 -7.5839 -2.6948 -2.6947 -2.4577 -2.4576 -2.3887 -2.3886 3.2887 3.2902 5.1124 5.1268 5.2541 5.2588 6.0631 6.0948 6.2605 6.2631 6.7539 6.7577 7.0743 7.0745 7.1738 7.1741 7.4275 7.4281 10.5455 10.5460 12.6091 12.6112 12.6883 12.7122 14.4485 14.4781 k = 0.0804 0.0804 0.4918 ( 2458 PWs) bands (ev): -46.3951 -46.3951 -24.0231 -24.0210 -22.0306 -22.0273 -21.8567 -21.8567 -19.0060 -19.0059 -8.6631 -8.6560 -8.2496 -8.2495 -7.5853 -7.5828 -2.6933 -2.6932 -2.4572 -2.4572 -2.3858 -2.3856 3.2888 3.2902 5.1634 5.1779 5.2913 5.2958 6.1018 6.1354 6.2872 6.2904 6.7032 6.7095 7.0363 7.0366 7.2419 7.2423 7.4496 7.4499 10.4713 10.4716 12.6072 12.6096 12.6853 12.7091 14.3547 14.3833 k = 0.0714 0.0714 0.4918 ( 2454 PWs) bands (ev): -46.3951 -46.3951 -24.0222 -24.0204 -22.0299 -22.0269 -21.8547 -21.8547 -19.0063 -19.0062 -8.6781 -8.6717 -8.2602 -8.2602 -7.5840 -7.5819 -2.6921 -2.6919 -2.4570 -2.4569 -2.3832 -2.3829 3.2890 3.2902 5.2132 5.2278 5.3266 5.3309 6.1370 6.1728 6.3096 6.3137 6.6530 6.6617 6.9998 7.0004 7.3056 7.3062 7.4736 7.4737 10.4017 10.4019 12.6066 12.6093 12.6834 12.7070 14.2678 14.2951 k = 0.0625 0.0625 0.4918 ( 2446 PWs) bands (ev): -46.3950 -46.3950 -24.0215 -24.0198 -22.0292 -22.0265 -21.8529 -21.8529 -19.0065 -19.0064 -8.6913 -8.6858 -8.2696 -8.2696 -7.5828 -7.5809 -2.6912 -2.6910 -2.4568 -2.4567 -2.3808 -2.3804 3.2892 3.2902 5.2612 5.2755 5.3597 5.3637 6.1686 6.2068 6.3279 6.3333 6.6040 6.6153 6.9656 6.9664 7.3639 7.3645 7.4985 7.4986 10.3375 10.3376 12.6069 12.6102 12.6826 12.7056 14.1887 14.2143 k = 0.0536 0.0536 0.4918 ( 2450 PWs) bands (ev): -46.3951 -46.3951 -24.0208 -24.0193 -22.0286 -22.0263 -21.8514 -21.8514 -19.0067 -19.0067 -8.7028 -8.6980 -8.2778 -8.2778 -7.5817 -7.5801 -2.6905 -2.6902 -2.4567 -2.4567 -2.3786 -2.3782 3.2893 3.2902 5.3063 5.3202 5.3902 5.3940 6.1963 6.2372 6.3427 6.3498 6.5573 6.5711 6.9342 6.9352 7.4156 7.4162 7.5235 7.5237 10.2795 10.2795 12.6080 12.6117 12.6829 12.7049 14.1181 14.1415 k = 0.0446 0.0446 0.4918 ( 2446 PWs) bands (ev): -46.3951 -46.3951 -24.0202 -24.0190 -22.0280 -22.0261 -21.8501 -21.8501 -19.0069 -19.0068 -8.7125 -8.7085 -8.2848 -8.2848 -7.5807 -7.5794 -2.6900 -2.6897 -2.4567 -2.4567 -2.3768 -2.3764 3.2895 3.2902 5.3475 5.3603 5.4180 5.4214 6.2203 6.2638 6.3541 6.3636 6.5140 6.5299 6.9063 6.9073 7.4597 7.4602 7.5480 7.5483 10.2283 10.2284 12.6096 12.6136 12.6841 12.7045 14.0569 14.0776 k = 0.0357 0.0357 0.4918 ( 2438 PWs) bands (ev): -46.3950 -46.3950 -24.0196 -24.0187 -22.0275 -22.0259 -21.8490 -21.8490 -19.0070 -19.0070 -8.7204 -8.7172 -8.2906 -8.2905 -7.5799 -7.5789 -2.6896 -2.6893 -2.4567 -2.4567 -2.3752 -2.3749 3.2896 3.2902 5.3833 5.3944 5.4430 5.4457 6.2409 6.2863 6.3621 6.3749 6.4756 6.4928 6.8824 6.8834 7.4952 7.4957 7.5712 7.5716 10.1851 10.1852 12.6115 12.6154 12.6863 12.7041 14.0059 14.0233 k = 0.0268 0.0268 0.4918 ( 2438 PWs) bands (ev): -46.3951 -46.3951 -24.0192 -24.0185 -22.0270 -22.0259 -21.8482 -21.8482 -19.0071 -19.0071 -8.7264 -8.7241 -8.2950 -8.2950 -7.5792 -7.5784 -2.6893 -2.6891 -2.4567 -2.4567 -2.3739 -2.3737 3.2898 3.2902 5.4124 5.4209 5.4649 5.4665 6.2585 6.3039 6.3664 6.3839 6.4448 6.4605 6.8631 6.8640 7.5220 7.5223 7.5920 7.5923 10.1504 10.1505 12.6135 12.6169 12.6891 12.7035 13.9658 13.9795 k = 0.0179 0.0179 0.4918 ( 2430 PWs) bands (ev): -46.3950 -46.3950 -24.0189 -24.0184 -22.0267 -22.0259 -21.8476 -21.8476 -19.0072 -19.0072 -8.7307 -8.7291 -8.2982 -8.2982 -7.5787 -7.5782 -2.6891 -2.6889 -2.4567 -2.4567 -2.3730 -2.3728 3.2899 3.2902 5.4336 5.4392 5.4826 5.4831 6.2741 6.3142 6.3681 6.3900 6.4244 6.4339 6.8489 6.8496 7.5403 7.5405 7.6086 7.6088 10.1251 10.1252 12.6153 12.6178 12.6924 12.7025 13.9375 13.9469 k = 0.0089 0.0089 0.4918 ( 2424 PWs) bands (ev): -46.3949 -46.3949 -24.0186 -24.0183 -22.0264 -22.0260 -21.8472 -21.8472 -19.0072 -19.0072 -8.7331 -8.7323 -8.3002 -8.3001 -7.5783 -7.5780 -2.6890 -2.6889 -2.4568 -2.4568 -2.3724 -2.3723 3.2900 3.2901 5.4467 5.4494 5.4941 5.4941 6.2887 6.3130 6.3728 6.3910 6.4142 6.4157 6.8403 6.8407 7.5510 7.5511 7.6193 7.6194 10.1097 10.1098 12.6168 12.6182 12.6956 12.7009 13.9212 13.9260 k = 0.0000 0.0000 0.4918 ( 2432 PWs) bands (ev): -46.3950 -46.3950 -24.0184 -24.0184 -22.0261 -22.0261 -21.8471 -21.8471 -19.0073 -19.0073 -8.7336 -8.7336 -8.3008 -8.3008 -7.5781 -7.5781 -2.6889 -2.6889 -2.4568 -2.4568 -2.3722 -2.3722 3.2901 3.2901 5.4518 5.4518 5.4980 5.4980 6.3025 6.3025 6.3828 6.3828 6.4107 6.4107 6.8375 6.8375 7.5545 7.5545 7.6231 7.6231 10.1046 10.1046 12.6178 12.6178 12.6985 12.6985 13.9174 13.9174 k = 0.0000 0.5000-0.0000 ( 2460 PWs) bands (ev): -46.3950 -46.3950 -24.0197 -24.0197 -21.9990 -21.9990 -21.8949 -21.8949 -19.0046 -19.0046 -8.7647 -8.7647 -8.3254 -8.3254 -7.3972 -7.3972 -2.6873 -2.6873 -2.4498 -2.4498 -2.3865 -2.3865 3.3490 3.3490 5.6292 5.6292 5.8585 5.8585 6.1497 6.1497 6.2475 6.2475 6.3299 6.3299 6.8252 6.8252 6.8927 6.8927 7.2488 7.2488 10.7525 10.7525 12.5375 12.5375 12.6860 12.6860 13.9628 13.9628 k = 0.0000 0.5000 0.0126 ( 2460 PWs) bands (ev): -46.3950 -46.3950 -24.0197 -24.0197 -21.9991 -21.9991 -21.8950 -21.8950 -19.0046 -19.0046 -8.7638 -8.7638 -8.3249 -8.3249 -7.3973 -7.3973 -2.6873 -2.6873 -2.4498 -2.4498 -2.3867 -2.3867 3.3490 3.3490 5.6199 5.6199 5.8581 5.8581 6.1473 6.1473 6.2444 6.2444 6.3372 6.3372 6.8277 6.8277 6.8930 6.8930 7.2457 7.2457 10.7558 10.7558 12.5376 12.5376 12.6868 12.6868 13.9683 13.9683 k = 0.0000 0.5000 0.0252 ( 2460 PWs) bands (ev): -46.3949 -46.3949 -24.0198 -24.0198 -21.9994 -21.9994 -21.8951 -21.8951 -19.0046 -19.0046 -8.7609 -8.7609 -8.3235 -8.3235 -7.3976 -7.3976 -2.6874 -2.6874 -2.4498 -2.4498 -2.3872 -2.3872 3.3489 3.3489 5.5933 5.5933 5.8568 5.8568 6.1400 6.1400 6.2350 6.2350 6.3579 6.3579 6.8353 6.8353 6.8939 6.8939 7.2367 7.2367 10.7657 10.7657 12.5380 12.5380 12.6891 12.6891 13.9846 13.9846 k = 0.0000 0.5000 0.0378 ( 2460 PWs) bands (ev): -46.3949 -46.3949 -24.0201 -24.0201 -21.9998 -21.9998 -21.8952 -21.8952 -19.0045 -19.0045 -8.7562 -8.7562 -8.3210 -8.3210 -7.3980 -7.3980 -2.6875 -2.6875 -2.4497 -2.4497 -2.3881 -2.3881 3.3487 3.3487 5.5526 5.5526 5.8546 5.8546 6.1273 6.1273 6.2195 6.2195 6.3886 6.3886 6.8483 6.8483 6.8953 6.8953 7.2222 7.2222 10.7821 10.7821 12.5386 12.5386 12.6930 12.6930 14.0111 14.0111 k = 0.0000 0.5000 0.0504 ( 2452 PWs) bands (ev): -46.3948 -46.3948 -24.0204 -24.0204 -22.0004 -22.0004 -21.8955 -21.8955 -19.0044 -19.0044 -8.7496 -8.7496 -8.3175 -8.3175 -7.3986 -7.3986 -2.6877 -2.6877 -2.4495 -2.4495 -2.3893 -2.3893 3.3484 3.3484 5.5014 5.5014 5.8517 5.8517 6.1086 6.1086 6.1983 6.1983 6.4251 6.4251 6.8672 6.8672 6.8972 6.8972 7.2033 7.2033 10.8048 10.8048 12.5394 12.5394 12.6985 12.6985 14.0473 14.0473 k = 0.0000 0.5000 0.0630 ( 2444 PWs) bands (ev): -46.3947 -46.3947 -24.0207 -24.0207 -22.0012 -22.0012 -21.8957 -21.8957 -19.0043 -19.0043 -8.7414 -8.7414 -8.3129 -8.3129 -7.3994 -7.3994 -2.6880 -2.6880 -2.4493 -2.4493 -2.3908 -2.3908 3.3480 3.3480 5.4429 5.4429 5.8481 5.8481 6.0827 6.0827 6.1722 6.1722 6.4637 6.4637 6.8919 6.8919 6.9002 6.9002 7.1810 7.1810 10.8337 10.8337 12.5403 12.5403 12.7057 12.7057 14.0920 14.0920 k = 0.0000 0.5000 0.0757 ( 2438 PWs) bands (ev): -46.3945 -46.3945 -24.0212 -24.0212 -22.0022 -22.0022 -21.8961 -21.8961 -19.0041 -19.0041 -8.7316 -8.7316 -8.3071 -8.3071 -7.4003 -7.4003 -2.6883 -2.6883 -2.4491 -2.4491 -2.3926 -2.3926 3.3476 3.3476 5.3794 5.3794 5.8437 5.8437 6.0482 6.0482 6.1427 6.1427 6.5015 6.5015 6.9014 6.9014 6.9256 6.9256 7.1566 7.1566 10.8685 10.8685 12.5415 12.5415 12.7146 12.7146 14.1441 14.1441 k = 0.0000 0.5000 0.0883 ( 2438 PWs) bands (ev): -46.3945 -46.3945 -24.0218 -24.0218 -22.0034 -22.0034 -21.8965 -21.8965 -19.0040 -19.0040 -8.7204 -8.7204 -8.3001 -8.3001 -7.4014 -7.4014 -2.6887 -2.6887 -2.4489 -2.4489 -2.3948 -2.3948 3.3470 3.3470 5.3127 5.3127 5.8387 5.8387 6.0033 6.0033 6.1114 6.1114 6.5367 6.5367 6.9043 6.9043 6.9647 6.9647 7.1314 7.1314 10.9089 10.9089 12.5428 12.5428 12.7251 12.7251 14.2021 14.2021 k = 0.0000 0.5000 0.1009 ( 2438 PWs) bands (ev): -46.3944 -46.3944 -24.0224 -24.0224 -22.0047 -22.0047 -21.8969 -21.8969 -19.0038 -19.0038 -8.7079 -8.7079 -8.2917 -8.2917 -7.4027 -7.4027 -2.6892 -2.6892 -2.4486 -2.4486 -2.3972 -2.3972 3.3464 3.3464 5.2441 5.2441 5.8330 5.8330 5.9473 5.9473 6.0793 6.0793 6.5685 6.5685 6.9073 6.9073 7.0103 7.0103 7.1065 7.1065 10.9546 10.9546 12.5442 12.5442 12.7375 12.7375 14.2646 14.2646 k = 0.0000 0.5000 0.1135 ( 2450 PWs) bands (ev): -46.3945 -46.3945 -24.0231 -24.0231 -22.0062 -22.0062 -21.8974 -21.8974 -19.0036 -19.0036 -8.6945 -8.6945 -8.2820 -8.2820 -7.4041 -7.4041 -2.6897 -2.6897 -2.4483 -2.4483 -2.3998 -2.3998 3.3457 3.3457 5.1744 5.1744 5.8266 5.8266 5.8805 5.8805 6.0467 6.0467 6.5967 6.5967 6.9103 6.9103 7.0611 7.0611 7.0830 7.0830 11.0051 11.0051 12.5457 12.5457 12.7518 12.7518 14.3300 14.3300 k = 0.0000 0.5000 0.1261 ( 2452 PWs) bands (ev): -46.3945 -46.3945 -24.0239 -24.0239 -22.0079 -22.0079 -21.8978 -21.8978 -19.0034 -19.0034 -8.6803 -8.6803 -8.2706 -8.2706 -7.4056 -7.4056 -2.6903 -2.6903 -2.4480 -2.4480 -2.4027 -2.4027 3.3449 3.3449 5.1044 5.1044 5.8033 5.8033 5.8199 5.8199 6.0134 6.0134 6.6218 6.6218 6.9133 6.9133 7.0609 7.0609 7.1167 7.1167 11.0602 11.0602 12.5473 12.5473 12.7680 12.7680 14.3968 14.3968 k = 0.0000 0.5000 0.1387 ( 2452 PWs) bands (ev): -46.3945 -46.3945 -24.0248 -24.0248 -22.0097 -22.0097 -21.8983 -21.8983 -19.0032 -19.0032 -8.6655 -8.6655 -8.2576 -8.2576 -7.4072 -7.4072 -2.6910 -2.6910 -2.4477 -2.4477 -2.4056 -2.4056 3.3440 3.3440 5.0346 5.0346 5.7177 5.7177 5.8123 5.8123 5.9794 5.9794 6.6444 6.6444 6.9163 6.9163 7.0415 7.0415 7.1748 7.1748 11.1195 11.1195 12.5489 12.5489 12.7861 12.7861 14.4637 14.4637 k = 0.0000 0.5000 0.1513 ( 2460 PWs) bands (ev): -46.3945 -46.3945 -24.0257 -24.0257 -22.0117 -22.0117 -21.8988 -21.8988 -19.0029 -19.0029 -8.6505 -8.6505 -8.2429 -8.2429 -7.4089 -7.4089 -2.6918 -2.6918 -2.4475 -2.4475 -2.4087 -2.4087 3.3430 3.3430 4.9653 4.9653 5.6241 5.6241 5.8043 5.8043 5.9447 5.9447 6.6650 6.6650 6.9192 6.9192 7.0245 7.0245 7.2348 7.2348 11.1824 11.1824 12.5506 12.5506 12.8062 12.8062 14.5293 14.5293 k = 0.0000 0.5000 0.1639 ( 2460 PWs) bands (ev): -46.3945 -46.3945 -24.0266 -24.0266 -22.0138 -22.0138 -21.8993 -21.8993 -19.0027 -19.0027 -8.6354 -8.6354 -8.2262 -8.2262 -7.4108 -7.4108 -2.6927 -2.6927 -2.4473 -2.4473 -2.4119 -2.4119 3.3419 3.3419 4.8969 4.8969 5.5240 5.5240 5.7958 5.7958 5.9093 5.9093 6.6842 6.6842 6.9219 6.9219 7.0099 7.0099 7.2957 7.2957 11.2486 11.2486 12.5524 12.5524 12.8284 12.8284 14.5925 14.5925 k = 0.0000 0.5000 0.1765 ( 2464 PWs) bands (ev): -46.3945 -46.3945 -24.0276 -24.0276 -22.0160 -22.0160 -21.8998 -21.8998 -19.0024 -19.0024 -8.6205 -8.6205 -8.2076 -8.2076 -7.4127 -7.4127 -2.6936 -2.6936 -2.4472 -2.4472 -2.4150 -2.4150 3.3407 3.3407 4.8297 4.8297 5.4185 5.4185 5.7870 5.7870 5.8735 5.8735 6.7023 6.7023 6.9246 6.9246 6.9977 6.9977 7.3567 7.3567 11.3177 11.3177 12.5542 12.5542 12.8525 12.8525 14.6526 14.6526 k = 0.0000 0.5000 0.1891 ( 2476 PWs) bands (ev): -46.3946 -46.3946 -24.0287 -24.0287 -22.0183 -22.0183 -21.9002 -21.9002 -19.0021 -19.0021 -8.6061 -8.6061 -8.1871 -8.1871 -7.4146 -7.4146 -2.6946 -2.6946 -2.4473 -2.4473 -2.4180 -2.4180 3.3393 3.3393 4.7639 4.7639 5.3088 5.3088 5.7777 5.7777 5.8374 5.8374 6.7196 6.7196 6.9271 6.9271 6.9875 6.9875 7.4171 7.4171 11.3891 11.3891 12.5560 12.5560 12.8785 12.8785 14.7087 14.7087 k = 0.0000 0.5000 0.2017 ( 2468 PWs) bands (ev): -46.3944 -46.3944 -24.0298 -24.0298 -22.0207 -22.0207 -21.9007 -21.9007 -19.0018 -19.0018 -8.5922 -8.5922 -8.1646 -8.1646 -7.4167 -7.4167 -2.6957 -2.6957 -2.4476 -2.4476 -2.4207 -2.4207 3.3378 3.3378 4.6998 4.6998 5.1962 5.1962 5.7678 5.7678 5.8017 5.8017 6.7363 6.7363 6.9295 6.9295 6.9793 6.9793 7.4764 7.4764 11.4625 11.4625 12.5579 12.5579 12.9066 12.9066 14.7609 14.7609 k = 0.0000 0.5000 0.2144 ( 2476 PWs) bands (ev): -46.3944 -46.3944 -24.0309 -24.0309 -22.0232 -22.0232 -21.9011 -21.9011 -19.0015 -19.0015 -8.5791 -8.5791 -8.1403 -8.1403 -7.4187 -7.4187 -2.6969 -2.6969 -2.4483 -2.4483 -2.4231 -2.4231 3.3360 3.3360 4.6374 4.6374 5.0815 5.0815 5.7553 5.7553 5.7684 5.7684 6.7525 6.7525 6.9316 6.9316 6.9728 6.9728 7.5342 7.5342 11.5373 11.5373 12.5597 12.5597 12.9365 12.9365 14.8085 14.8085 k = 0.0000 0.5000 0.2270 ( 2476 PWs) bands (ev): -46.3943 -46.3943 -24.0320 -24.0320 -22.0258 -22.0258 -21.9015 -21.9015 -19.0012 -19.0012 -8.5668 -8.5668 -8.1143 -8.1143 -7.4208 -7.4208 -2.6981 -2.6981 -2.4494 -2.4494 -2.4250 -2.4250 3.3341 3.3341 4.5769 4.5769 4.9659 4.9659 5.7269 5.7269 5.7513 5.7513 6.7683 6.7683 6.9335 6.9335 6.9679 6.9679 7.5903 7.5903 11.6132 11.6132 12.5616 12.5616 12.9681 12.9681 14.8519 14.8519 k = 0.0000 0.5000 0.2396 ( 2480 PWs) bands (ev): -46.3943 -46.3943 -24.0332 -24.0332 -22.0284 -22.0284 -21.9019 -21.9019 -19.0009 -19.0009 -8.5553 -8.5553 -8.0867 -8.0867 -7.4228 -7.4228 -2.6994 -2.6994 -2.4511 -2.4511 -2.4264 -2.4264 3.3320 3.3320 4.5185 4.5185 4.8502 4.8502 5.6924 5.6924 5.7407 5.7407 6.7838 6.7838 6.9353 6.9353 6.9642 6.9642 7.6442 7.6442 11.6897 11.6897 12.5634 12.5634 13.0012 13.0012 14.8910 14.8910 k = 0.0000 0.5000 0.2522 ( 2488 PWs) bands (ev): -46.3944 -46.3944 -24.0343 -24.0343 -22.0311 -22.0311 -21.9022 -21.9022 -19.0006 -19.0006 -8.5446 -8.5446 -8.0578 -8.0578 -7.4249 -7.4249 -2.7007 -2.7007 -2.4532 -2.4532 -2.4273 -2.4273 3.3295 3.3295 4.4622 4.4622 4.7355 4.7355 5.6580 5.6580 5.7307 5.7307 6.7988 6.7988 6.9368 6.9368 6.9617 6.9617 7.6958 7.6958 11.7662 11.7662 12.5652 12.5652 13.0358 13.0358 14.9262 14.9262 k = 0.0000 0.5000 0.2648 ( 2480 PWs) bands (ev): -46.3942 -46.3942 -24.0355 -24.0355 -22.0337 -22.0337 -21.9025 -21.9025 -19.0003 -19.0003 -8.5349 -8.5349 -8.0280 -8.0280 -7.4269 -7.4269 -2.7021 -2.7021 -2.4556 -2.4556 -2.4276 -2.4276 3.3268 3.3268 4.4083 4.4083 4.6225 4.6225 5.6243 5.6243 5.7208 5.7208 6.8135 6.8135 6.9381 6.9381 6.9601 6.9601 7.7450 7.7450 11.8424 11.8424 12.5671 12.5671 13.0716 13.0716 14.9577 14.9577 k = 0.0000 0.5000 0.2774 ( 2472 PWs) bands (ev): -46.3940 -46.3940 -24.0366 -24.0366 -22.0363 -22.0363 -21.9028 -21.9028 -19.0000 -19.0000 -8.5259 -8.5259 -7.9973 -7.9973 -7.4288 -7.4288 -2.7035 -2.7035 -2.4583 -2.4583 -2.4276 -2.4276 3.3236 3.3236 4.3566 4.3566 4.5121 4.5121 5.5916 5.5916 5.7111 5.7111 6.8277 6.8277 6.9393 6.9393 6.9593 6.9593 7.7916 7.7916 11.9178 11.9178 12.5689 12.5689 13.1084 13.1084 14.9858 14.9858 k = 0.0000 0.5000 0.2900 ( 2458 PWs) bands (ev): -46.3937 -46.3937 -24.0377 -24.0377 -22.0389 -22.0389 -21.9030 -21.9030 -18.9997 -18.9997 -8.5177 -8.5177 -7.9663 -7.9663 -7.4306 -7.4306 -2.7049 -2.7049 -2.4611 -2.4611 -2.4272 -2.4272 3.3200 3.3200 4.3073 4.3073 4.4051 4.4051 5.5601 5.5601 5.7016 5.7016 6.8415 6.8415 6.9404 6.9404 6.9591 6.9591 7.8355 7.8355 11.9920 11.9920 12.5708 12.5708 13.1459 13.1459 15.0109 15.0109 k = 0.0000 0.5000 0.3026 ( 2458 PWs) bands (ev): -46.3936 -46.3936 -24.0388 -24.0388 -22.0415 -22.0415 -21.9033 -21.9033 -18.9994 -18.9994 -8.5102 -8.5102 -7.9351 -7.9351 -7.4324 -7.4324 -2.7064 -2.7064 -2.4640 -2.4640 -2.4267 -2.4267 3.3158 3.3158 4.2598 4.2598 4.3030 4.3030 5.5298 5.5298 5.6923 5.6923 6.8547 6.8547 6.9415 6.9415 6.9594 6.9594 7.8766 7.8766 12.0645 12.0645 12.5727 12.5727 13.1838 13.1838 15.0331 15.0331 k = 0.0000 0.5000 0.3152 ( 2460 PWs) bands (ev): -46.3936 -46.3936 -24.0399 -24.0399 -22.0440 -22.0440 -21.9035 -21.9035 -18.9991 -18.9991 -8.5034 -8.5034 -7.9042 -7.9042 -7.4340 -7.4340 -2.7079 -2.7079 -2.4669 -2.4669 -2.4261 -2.4261 3.3109 3.3109 4.1983 4.1983 4.2221 4.2221 5.5010 5.5010 5.6834 5.6834 6.8672 6.8672 6.9427 6.9427 6.9600 6.9600 7.9150 7.9150 12.1347 12.1347 12.5745 12.5745 13.2217 13.2217 15.0528 15.0528 k = 0.0000 0.5000 0.3278 ( 2464 PWs) bands (ev): -46.3936 -46.3936 -24.0409 -24.0409 -22.0464 -22.0464 -21.9037 -21.9037 -18.9988 -18.9988 -8.4973 -8.4973 -7.8738 -7.8738 -7.4355 -7.4355 -2.7094 -2.7094 -2.4697 -2.4697 -2.4254 -2.4254 3.3051 3.3051 4.1082 4.1082 4.1781 4.1781 5.4737 5.4737 5.6748 5.6748 6.8791 6.8791 6.9440 6.9440 6.9608 6.9608 7.9505 7.9505 12.2022 12.2022 12.5764 12.5764 13.2593 13.2593 15.0703 15.0703 k = 0.0000 0.5000 0.3404 ( 2464 PWs) bands (ev): -46.3935 -46.3935 -24.0419 -24.0419 -22.0487 -22.0487 -21.9038 -21.9038 -18.9985 -18.9985 -8.4917 -8.4917 -7.8443 -7.8443 -7.4368 -7.4368 -2.7108 -2.7108 -2.4724 -2.4724 -2.4247 -2.4247 3.2984 3.2984 4.0217 4.0217 4.1394 4.1394 5.4480 5.4480 5.6666 5.6666 6.8901 6.8901 6.9454 6.9454 6.9617 6.9617 7.9832 7.9832 12.2666 12.2666 12.5784 12.5784 13.2963 13.2963 15.0857 15.0857 k = 0.0000 0.5000 0.3531 ( 2462 PWs) bands (ev): -46.3934 -46.3934 -24.0428 -24.0428 -22.0509 -22.0509 -21.9039 -21.9039 -18.9983 -18.9983 -8.4867 -8.4867 -7.8160 -7.8160 -7.4379 -7.4379 -2.7122 -2.7122 -2.4749 -2.4749 -2.4239 -2.4239 3.2904 3.2904 3.9417 3.9417 4.1038 4.1038 5.4240 5.4240 5.6589 5.6589 6.9002 6.9002 6.9471 6.9471 6.9627 6.9627 8.0131 8.0131 12.3274 12.3274 12.5806 12.5806 13.3323 13.3323 15.0993 15.0993 k = 0.0000 0.5000 0.3657 ( 2462 PWs) bands (ev): -46.3934 -46.3934 -24.0437 -24.0437 -22.0529 -22.0529 -21.9041 -21.9041 -18.9980 -18.9980 -8.4822 -8.4822 -7.7891 -7.7891 -7.4389 -7.4389 -2.7135 -2.7135 -2.4773 -2.4773 -2.4231 -2.4231 3.2811 3.2811 3.8691 3.8691 4.0712 4.0712 5.4019 5.4019 5.6516 5.6516 6.9092 6.9092 6.9491 6.9491 6.9637 6.9637 8.0402 8.0402 12.3838 12.3838 12.5831 12.5831 13.3668 13.3668 15.1112 15.1112 k = 0.0000 0.5000 0.3783 ( 2462 PWs) bands (ev): -46.3933 -46.3933 -24.0445 -24.0445 -22.0548 -22.0548 -21.9042 -21.9042 -18.9978 -18.9978 -8.4782 -8.4782 -7.7640 -7.7640 -7.4396 -7.4396 -2.7148 -2.7148 -2.4795 -2.4795 -2.4224 -2.4224 3.2704 3.2704 3.8043 3.8043 4.0416 4.0416 5.3817 5.3817 5.6449 5.6449 6.9170 6.9170 6.9516 6.9516 6.9647 6.9647 8.0645 8.0645 12.4353 12.4353 12.5864 12.5864 13.3996 13.3996 15.1215 15.1215 k = 0.0000 0.5000 0.3909 ( 2458 PWs) bands (ev): -46.3932 -46.3932 -24.0453 -24.0453 -22.0566 -22.0566 -21.9042 -21.9042 -18.9976 -18.9976 -8.4747 -8.4747 -7.7410 -7.7410 -7.4401 -7.4401 -2.7159 -2.7159 -2.4814 -2.4814 -2.4217 -2.4217 3.2582 3.2582 3.7479 3.7479 4.0150 4.0150 5.3634 5.3634 5.6389 5.6389 6.9234 6.9234 6.9545 6.9545 6.9657 6.9657 8.0862 8.0862 12.4807 12.4807 12.5912 12.5912 13.4300 13.4300 15.1305 15.1305 k = 0.0000 0.5000 0.4035 ( 2454 PWs) bands (ev): -46.3931 -46.3931 -24.0459 -24.0459 -22.0581 -22.0581 -21.9043 -21.9043 -18.9974 -18.9974 -8.4716 -8.4716 -7.7202 -7.7202 -7.4404 -7.4404 -2.7170 -2.7170 -2.4832 -2.4832 -2.4210 -2.4210 3.2447 3.2447 3.6999 3.6999 3.9914 3.9914 5.3471 5.3471 5.6334 5.6334 6.9283 6.9283 6.9578 6.9578 6.9666 6.9666 8.1051 8.1051 12.5178 12.5178 12.5992 12.5992 13.4580 13.4580 15.1382 15.1382 k = 0.0000 0.5000 0.4161 ( 2454 PWs) bands (ev): -46.3931 -46.3931 -24.0465 -24.0465 -22.0595 -22.0595 -21.9044 -21.9044 -18.9973 -18.9973 -8.4689 -8.4689 -7.7018 -7.7018 -7.4405 -7.4405 -2.7179 -2.7179 -2.4847 -2.4847 -2.4204 -2.4204 3.2305 3.2305 3.6602 3.6602 3.9710 3.9710 5.3329 5.3329 5.6286 5.6286 6.9320 6.9320 6.9613 6.9613 6.9676 6.9676 8.1215 8.1215 12.5437 12.5437 12.6131 12.6131 13.4830 13.4830 15.1447 15.1447 k = 0.0000 0.5000 0.4287 ( 2458 PWs) bands (ev): -46.3931 -46.3931 -24.0470 -24.0470 -22.0607 -22.0607 -21.9044 -21.9044 -18.9972 -18.9972 -8.4667 -8.4667 -7.6861 -7.6861 -7.4405 -7.4405 -2.7188 -2.7188 -2.4860 -2.4860 -2.4199 -2.4199 3.2161 3.2161 3.6285 3.6285 3.9536 3.9536 5.3209 5.3209 5.6245 5.6245 6.9347 6.9347 6.9646 6.9646 6.9686 6.9686 8.1352 8.1352 12.5581 12.5581 12.6329 12.6329 13.5048 13.5048 15.1501 15.1501 k = 0.0000 0.5000 0.4413 ( 2458 PWs) bands (ev): -46.3931 -46.3931 -24.0475 -24.0475 -22.0616 -22.0616 -21.9045 -21.9045 -18.9970 -18.9970 -8.4649 -8.4649 -7.6731 -7.6731 -7.4404 -7.4404 -2.7195 -2.7195 -2.4871 -2.4871 -2.4195 -2.4195 3.2025 3.2025 3.6040 3.6040 3.9393 3.9393 5.3109 5.3109 5.6211 5.6211 6.9366 6.9366 6.9669 6.9669 6.9702 6.9702 8.1464 8.1464 12.5652 12.5652 12.6540 12.6540 13.5230 13.5230 15.1544 15.1544 k = 0.0000 0.5000 0.4539 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0478 -24.0478 -22.0624 -22.0624 -21.9045 -21.9045 -18.9970 -18.9970 -8.4635 -8.4635 -7.6629 -7.6629 -7.4402 -7.4402 -2.7200 -2.7200 -2.4879 -2.4879 -2.4191 -2.4191 3.1907 3.1907 3.5860 3.5860 3.9282 3.9282 5.3032 5.3032 5.6184 5.6184 6.9379 6.9379 6.9681 6.9681 6.9724 6.9724 8.1551 8.1551 12.5690 12.5690 12.6725 12.6725 13.5374 13.5374 15.1577 15.1577 k = 0.0000 0.5000 0.4665 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0480 -24.0480 -22.0630 -22.0630 -21.9045 -21.9045 -18.9969 -18.9969 -8.4626 -8.4626 -7.6556 -7.6556 -7.4400 -7.4400 -2.7204 -2.7204 -2.4885 -2.4885 -2.4189 -2.4189 3.1816 3.1816 3.5737 3.5737 3.9203 3.9203 5.2976 5.2976 5.6165 5.6165 6.9387 6.9387 6.9686 6.9686 6.9742 6.9742 8.1612 8.1612 12.5711 12.5711 12.6865 12.6865 13.5479 13.5479 15.1600 15.1600 k = 0.0000 0.5000 0.4791 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0482 -24.0482 -22.0633 -22.0633 -21.9045 -21.9045 -18.9968 -18.9968 -8.4620 -8.4620 -7.6512 -7.6512 -7.4398 -7.4398 -2.7206 -2.7206 -2.4889 -2.4889 -2.4187 -2.4187 3.1758 3.1758 3.5666 3.5666 3.9155 3.9155 5.2943 5.2943 5.6153 5.6153 6.9392 6.9392 6.9689 6.9689 6.9754 6.9754 8.1649 8.1649 12.5721 12.5721 12.6951 12.6951 13.5542 13.5542 15.1614 15.1614 k = 0.0000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3930 -46.3930 -24.0482 -24.0482 -22.0634 -22.0634 -21.9045 -21.9045 -18.9968 -18.9968 -8.4618 -8.4618 -7.6497 -7.6497 -7.4398 -7.4398 -2.7207 -2.7207 -2.4890 -2.4890 -2.4187 -2.4187 3.1738 3.1738 3.5642 3.5642 3.9139 3.9139 5.2931 5.2931 5.6149 5.6149 6.9394 6.9394 6.9690 6.9690 6.9758 6.9758 8.1662 8.1662 12.5724 12.5724 12.6980 12.6980 13.5563 13.5563 15.1619 15.1619 k = 0.5000 0.5000-0.0000 ( 2464 PWs) bands (ev): -46.3926 -46.3926 -24.0495 -24.0495 -22.0004 -22.0004 -21.9881 -21.9881 -18.9943 -18.9943 -8.5167 -8.5167 -7.5022 -7.5022 -7.3959 -7.3959 -2.7357 -2.7357 -2.5091 -2.5091 -2.4237 -2.4237 3.1412 3.1412 3.5625 3.5625 3.9366 3.9366 5.4685 5.4685 5.4898 5.4898 6.7784 6.7784 6.8162 6.8162 6.8296 6.8296 8.3805 8.3805 12.6550 12.6550 12.7272 12.7272 13.6131 13.6131 14.6561 14.6561 k = 0.5000 0.5000 0.0126 ( 2464 PWs) bands (ev): -46.3926 -46.3926 -24.0495 -24.0495 -22.0004 -22.0004 -21.9882 -21.9882 -18.9943 -18.9943 -8.5153 -8.5153 -7.5021 -7.5021 -7.3958 -7.3958 -2.7361 -2.7361 -2.5095 -2.5095 -2.4242 -2.4242 3.1412 3.1412 3.5625 3.5625 3.9376 3.9376 5.4653 5.4653 5.4865 5.4865 6.7718 6.7718 6.8199 6.8199 6.8337 6.8337 8.3806 8.3806 12.6561 12.6561 12.7283 12.7283 13.6132 13.6132 14.6639 14.6639 k = 0.5000 0.5000 0.0252 ( 2460 PWs) bands (ev): -46.3926 -46.3926 -24.0496 -24.0496 -22.0004 -22.0004 -21.9886 -21.9886 -18.9942 -18.9942 -8.5112 -8.5112 -7.5018 -7.5018 -7.3955 -7.3955 -2.7372 -2.7372 -2.5106 -2.5106 -2.4257 -2.4257 3.1413 3.1413 3.5625 3.5625 3.9404 3.9404 5.4556 5.4556 5.4766 5.4766 6.7515 6.7515 6.8314 6.8314 6.8456 6.8456 8.3807 8.3807 12.6595 12.6595 12.7316 12.7316 13.6136 13.6136 14.6871 14.6871 k = 0.5000 0.5000 0.0378 ( 2460 PWs) bands (ev): -46.3925 -46.3925 -24.0499 -24.0499 -22.0003 -22.0003 -21.9893 -21.9893 -18.9941 -18.9941 -8.5043 -8.5043 -7.5012 -7.5012 -7.3949 -7.3949 -2.7390 -2.7390 -2.5124 -2.5124 -2.4282 -2.4282 3.1414 3.1414 3.5624 3.5624 3.9450 3.9450 5.4400 5.4400 5.4607 5.4607 6.7178 6.7178 6.8504 6.8504 6.8650 6.8650 8.3810 8.3810 12.6650 12.6650 12.7372 12.7372 13.6142 13.6142 14.7253 14.7253 k = 0.5000 0.5000 0.0504 ( 2468 PWs) bands (ev): -46.3926 -46.3926 -24.0502 -24.0502 -22.0003 -22.0003 -21.9902 -21.9902 -18.9940 -18.9940 -8.4948 -8.4948 -7.5004 -7.5004 -7.3942 -7.3942 -2.7416 -2.7416 -2.5149 -2.5149 -2.4317 -2.4317 3.1415 3.1415 3.5622 3.5622 3.9515 3.9515 5.4189 5.4189 5.4392 5.4392 6.6711 6.6711 6.8764 6.8764 6.8913 6.8913 8.3814 8.3814 12.6728 12.6728 12.7449 12.7449 13.6150 13.6150 14.7779 14.7779 k = 0.5000 0.5000 0.0630 ( 2460 PWs) bands (ev): -46.3925 -46.3925 -24.0505 -24.0505 -22.0002 -22.0002 -21.9914 -21.9914 -18.9938 -18.9938 -8.4826 -8.4826 -7.4994 -7.4994 -7.3932 -7.3932 -2.7449 -2.7449 -2.5180 -2.5180 -2.4361 -2.4361 3.1417 3.1417 3.5620 3.5620 3.9598 3.9598 5.3932 5.3932 5.4129 5.4129 6.6123 6.6123 6.9085 6.9085 6.9237 6.9237 8.3819 8.3819 12.6828 12.6828 12.7549 12.7549 13.6160 13.6160 14.8443 14.8443 k = 0.5000 0.5000 0.0757 ( 2468 PWs) bands (ev): -46.3926 -46.3926 -24.0510 -24.0510 -22.0001 -22.0001 -21.9929 -21.9929 -18.9936 -18.9936 -8.4679 -8.4679 -7.4981 -7.4981 -7.3920 -7.3920 -2.7489 -2.7489 -2.5219 -2.5219 -2.4414 -2.4414 3.1419 3.1419 3.5617 3.5617 3.9698 3.9698 5.3634 5.3634 5.3826 5.3826 6.5422 6.5422 6.9459 6.9459 6.9614 6.9614 8.3824 8.3824 12.6950 12.6950 12.7670 12.7670 13.6173 13.6173 14.9231 14.9231 k = 0.5000 0.5000 0.0883 ( 2476 PWs) bands (ev): -46.3927 -46.3927 -24.0515 -24.0515 -22.0000 -22.0000 -21.9946 -21.9946 -18.9934 -18.9934 -8.4506 -8.4506 -7.4966 -7.4966 -7.3907 -7.3907 -2.7536 -2.7536 -2.5263 -2.5263 -2.4476 -2.4476 3.1421 3.1421 3.5614 3.5614 3.9814 3.9814 5.3304 5.3304 5.3491 5.3491 6.4620 6.4620 6.9878 6.9878 7.0035 7.0035 8.3831 8.3831 12.7093 12.7093 12.7813 12.7813 13.6188 13.6188 15.0134 15.0134 k = 0.5000 0.5000 0.1009 ( 2476 PWs) bands (ev): -46.3926 -46.3926 -24.0521 -24.0521 -21.9999 -21.9999 -21.9965 -21.9965 -18.9931 -18.9931 -8.4309 -8.4309 -7.4950 -7.4950 -7.3891 -7.3891 -2.7588 -2.7588 -2.5314 -2.5314 -2.4546 -2.4546 3.1424 3.1424 3.5609 3.5609 3.9946 3.9946 5.2949 5.2949 5.3129 5.3129 6.3726 6.3726 7.0334 7.0334 7.0494 7.0494 8.3839 8.3839 12.7257 12.7257 12.7978 12.7978 13.6204 13.6204 15.1140 15.1140 k = 0.5000 0.5000 0.1135 ( 2468 PWs) bands (ev): -46.3925 -46.3925 -24.0528 -24.0528 -21.9997 -21.9997 -21.9986 -21.9986 -18.9927 -18.9927 -8.4088 -8.4088 -7.4931 -7.4931 -7.3874 -7.3874 -2.7647 -2.7647 -2.5371 -2.5371 -2.4623 -2.4623 3.1427 3.1427 3.5603 3.5603 4.0092 4.0092 5.2575 5.2575 5.2749 5.2749 6.2751 6.2751 7.0821 7.0821 7.0982 7.0982 8.3847 8.3847 12.7443 12.7443 12.8164 12.8164 13.6223 13.6223 15.2234 15.2234 k = 0.5000 0.5000 0.1261 ( 2468 PWs) bands (ev): -46.3924 -46.3924 -24.0535 -24.0535 -22.0010 -22.0010 -21.9996 -21.9996 -18.9924 -18.9924 -8.3846 -8.3846 -7.4910 -7.4910 -7.3855 -7.3855 -2.7711 -2.7711 -2.5433 -2.5433 -2.4708 -2.4708 3.1431 3.1431 3.5595 3.5595 4.0253 4.0253 5.2188 5.2188 5.2354 5.2354 6.1707 6.1707 7.1331 7.1331 7.1494 7.1494 8.3857 8.3857 12.7649 12.7649 12.8371 12.8371 13.6243 13.6243 15.3403 15.3403 k = 0.5000 0.5000 0.1387 ( 2468 PWs) bands (ev): -46.3923 -46.3923 -24.0544 -24.0544 -22.0035 -22.0035 -21.9994 -21.9994 -18.9920 -18.9920 -8.3582 -8.3582 -7.4888 -7.4888 -7.3834 -7.3834 -2.7780 -2.7780 -2.5499 -2.5499 -2.4799 -2.4799 3.1435 3.1435 3.5586 3.5586 4.0426 4.0426 5.1792 5.1792 5.1952 5.1952 6.0604 6.0604 7.1859 7.1859 7.2023 7.2023 8.3867 8.3867 12.7876 12.7876 12.8598 12.8598 13.6265 13.6265 15.4631 15.4631 k = 0.5000 0.5000 0.1513 ( 2468 PWs) bands (ev): -46.3923 -46.3923 -24.0552 -24.0552 -22.0061 -22.0061 -21.9993 -21.9993 -18.9916 -18.9916 -8.3299 -8.3299 -7.4863 -7.4863 -7.3812 -7.3812 -2.7855 -2.7855 -2.5571 -2.5571 -2.4895 -2.4895 3.1439 3.1439 3.5574 3.5574 4.0610 4.0610 5.1391 5.1391 5.1544 5.1544 5.9454 5.9454 7.2400 7.2400 7.2565 7.2565 8.3878 8.3878 12.8122 12.8122 12.8845 12.8845 13.6289 13.6289 15.5904 15.5904 k = 0.5000 0.5000 0.1639 ( 2468 PWs) bands (ev): -46.3922 -46.3922 -24.0561 -24.0561 -22.0090 -22.0090 -21.9991 -21.9991 -18.9912 -18.9912 -8.2998 -8.2998 -7.4838 -7.4838 -7.3789 -7.3789 -2.7933 -2.7933 -2.5646 -2.5646 -2.4997 -2.4997 3.1443 3.1443 3.5558 3.5558 4.0805 4.0805 5.0989 5.0989 5.1136 5.1136 5.8267 5.8267 7.2949 7.2949 7.3114 7.3114 8.3889 8.3889 12.8387 12.8387 12.9111 12.9111 13.6314 13.6314 15.7205 15.7205 k = 0.5000 0.5000 0.1765 ( 2460 PWs) bands (ev): -46.3920 -46.3920 -24.0571 -24.0571 -22.0119 -22.0119 -21.9989 -21.9989 -18.9908 -18.9908 -8.2680 -8.2680 -7.4810 -7.4810 -7.3765 -7.3765 -2.8015 -2.8015 -2.5725 -2.5725 -2.5103 -2.5103 3.1447 3.1447 3.5540 3.5540 4.1009 4.1009 5.0590 5.0590 5.0730 5.0730 5.7054 5.7054 7.3502 7.3502 7.3667 7.3667 8.3901 8.3901 12.8671 12.8671 12.9395 12.9395 13.6339 13.6339 15.8518 15.8518 k = 0.5000 0.5000 0.1891 ( 2460 PWs) bands (ev): -46.3919 -46.3919 -24.0581 -24.0581 -22.0150 -22.0150 -21.9987 -21.9987 -18.9903 -18.9903 -8.2348 -8.2348 -7.4781 -7.4781 -7.3739 -7.3739 -2.8100 -2.8100 -2.5807 -2.5807 -2.5213 -2.5213 3.1452 3.1452 3.5517 3.5517 4.1220 4.1220 5.0194 5.0194 5.0328 5.0328 5.5823 5.5823 7.4056 7.4056 7.4220 7.4220 8.3914 8.3914 12.8972 12.8972 12.9697 12.9697 13.6366 13.6366 15.9825 15.9825 k = 0.5000 0.5000 0.2017 ( 2460 PWs) bands (ev): -46.3919 -46.3919 -24.0591 -24.0591 -22.0181 -22.0181 -21.9985 -21.9985 -18.9899 -18.9899 -8.2002 -8.2002 -7.4751 -7.4751 -7.3713 -7.3713 -2.8189 -2.8189 -2.5892 -2.5892 -2.5325 -2.5325 3.1457 3.1457 3.5489 3.5489 4.1438 4.1438 4.9806 4.9806 4.9933 4.9933 5.4585 5.4585 7.4606 7.4606 7.4769 7.4769 8.3927 8.3927 12.9290 12.9290 13.0016 13.0016 13.6394 13.6394 16.1108 16.1108 k = 0.5000 0.5000 0.2144 ( 2460 PWs) bands (ev): -46.3918 -46.3918 -24.0601 -24.0601 -22.0213 -22.0213 -21.9983 -21.9983 -18.9894 -18.9894 -8.1646 -8.1646 -7.4720 -7.4720 -7.3686 -7.3686 -2.8279 -2.8279 -2.5979 -2.5979 -2.5439 -2.5439 3.1461 3.1461 3.5455 3.5455 4.1660 4.1660 4.9426 4.9426 4.9548 4.9548 5.3349 5.3349 7.5151 7.5151 7.5313 7.5313 8.3940 8.3940 12.9623 12.9623 13.0349 13.0349 13.6422 13.6422 16.2346 16.2346 k = 0.5000 0.5000 0.2270 ( 2460 PWs) bands (ev): -46.3917 -46.3917 -24.0612 -24.0612 -22.0246 -22.0246 -21.9981 -21.9981 -18.9889 -18.9889 -8.1282 -8.1282 -7.4687 -7.4687 -7.3658 -7.3658 -2.8370 -2.8370 -2.6067 -2.6067 -2.5555 -2.5555 3.1466 3.1466 3.5414 3.5414 4.1886 4.1886 4.9055 4.9055 4.9172 4.9172 5.2123 5.2123 7.5687 7.5687 7.5847 7.5847 8.3954 8.3954 12.9970 12.9970 13.0697 13.0697 13.6451 13.6451 16.3520 16.3520 k = 0.5000 0.5000 0.2396 ( 2460 PWs) bands (ev): -46.3916 -46.3916 -24.0623 -24.0623 -22.0279 -22.0279 -21.9979 -21.9979 -18.9884 -18.9884 -8.0911 -8.0911 -7.4654 -7.4654 -7.3631 -7.3631 -2.8463 -2.8463 -2.6156 -2.6156 -2.5671 -2.5671 3.1471 3.1471 3.5365 3.5365 4.2113 4.2113 4.8696 4.8696 4.8808 4.8808 5.0917 5.0917 7.6211 7.6211 7.6369 7.6369 8.3967 8.3967 13.0330 13.0330 13.1057 13.1057 13.6480 13.6480 16.4611 16.4611 k = 0.5000 0.5000 0.2522 ( 2452 PWs) bands (ev): -46.3915 -46.3915 -24.0634 -24.0634 -22.0311 -22.0311 -21.9977 -21.9977 -18.9879 -18.9879 -8.0536 -8.0536 -7.4619 -7.4619 -7.3602 -7.3602 -2.8556 -2.8556 -2.6245 -2.6245 -2.5787 -2.5787 3.1476 3.1476 3.5305 3.5305 4.2341 4.2341 4.8346 4.8346 4.8457 4.8457 4.9741 4.9741 7.6722 7.6722 7.6878 7.6878 8.3981 8.3981 13.0701 13.0701 13.1427 13.1427 13.6510 13.6510 16.5601 16.5601 k = 0.5000 0.5000 0.2648 ( 2436 PWs) bands (ev): -46.3912 -46.3912 -24.0644 -24.0644 -22.0343 -22.0343 -21.9974 -21.9974 -18.9874 -18.9874 -8.0159 -8.0159 -7.4584 -7.4584 -7.3574 -7.3574 -2.8648 -2.8648 -2.6334 -2.6334 -2.5901 -2.5901 3.1481 3.1481 3.5234 3.5234 4.2568 4.2568 4.8000 4.8000 4.8120 4.8120 4.8611 4.8611 7.7217 7.7217 7.7371 7.7371 8.3995 8.3995 13.1081 13.1081 13.1806 13.1806 13.6541 13.6541 16.6476 16.6476 k = 0.5000 0.5000 0.2774 ( 2436 PWs) bands (ev): -46.3911 -46.3911 -24.0655 -24.0655 -22.0376 -22.0376 -21.9972 -21.9972 -18.9869 -18.9869 -7.9784 -7.9784 -7.4548 -7.4548 -7.3546 -7.3546 -2.8740 -2.8740 -2.6422 -2.6422 -2.6014 -2.6014 3.1486 3.1486 3.5148 3.5148 4.2793 4.2793 4.7425 4.7425 4.7766 4.7766 4.7798 4.7798 7.7695 7.7695 7.7847 7.7847 8.4008 8.4008 13.1467 13.1467 13.2191 13.2191 13.6571 13.6571 16.7228 16.7228 k = 0.5000 0.5000 0.2900 ( 2436 PWs) bands (ev): -46.3910 -46.3910 -24.0666 -24.0666 -22.0407 -22.0407 -21.9970 -21.9970 -18.9864 -18.9864 -7.9413 -7.9413 -7.4511 -7.4511 -7.3519 -7.3519 -2.8830 -2.8830 -2.6509 -2.6509 -2.6125 -2.6125 3.1491 3.1491 3.5046 3.5046 4.3013 4.3013 4.6415 4.6415 4.7425 4.7425 4.7491 4.7491 7.8153 7.8153 7.8303 7.8303 8.4022 8.4022 13.1858 13.1858 13.2578 13.2578 13.6603 13.6603 16.7854 16.7854 k = 0.5000 0.5000 0.3026 ( 2436 PWs) bands (ev): -46.3910 -46.3910 -24.0676 -24.0676 -22.0438 -22.0438 -21.9968 -21.9968 -18.9860 -18.9860 -7.9048 -7.9048 -7.4473 -7.4473 -7.3492 -7.3492 -2.8918 -2.8918 -2.6593 -2.6593 -2.6232 -2.6232 3.1496 3.1496 3.4924 3.4924 4.3228 4.3228 4.5430 4.5430 4.7133 4.7133 4.7201 4.7201 7.8591 7.8591 7.8737 7.8737 8.4035 8.4035 13.2250 13.2250 13.2966 13.2966 13.6635 13.6635 16.8362 16.8362 k = 0.5000 0.5000 0.3152 ( 2428 PWs) bands (ev): -46.3908 -46.3908 -24.0686 -24.0686 -22.0467 -22.0467 -21.9966 -21.9966 -18.9855 -18.9855 -7.8692 -7.8692 -7.4435 -7.4435 -7.3466 -7.3466 -2.9004 -2.9004 -2.6675 -2.6675 -2.6336 -2.6336 3.1500 3.1500 3.4782 3.4782 4.3437 4.3437 4.4509 4.4509 4.6861 4.6861 4.6927 4.6927 7.9006 7.9006 7.9150 7.9150 8.4047 8.4047 13.2642 13.2642 13.3350 13.3350 13.6668 13.6668 16.8762 16.8762 k = 0.5000 0.5000 0.3278 ( 2428 PWs) bands (ev): -46.3907 -46.3907 -24.0696 -24.0696 -22.0496 -22.0496 -21.9965 -21.9965 -18.9851 -18.9851 -7.8348 -7.8348 -7.4396 -7.4396 -7.3441 -7.3441 -2.9086 -2.9086 -2.6755 -2.6755 -2.6435 -2.6435 3.1505 3.1505 3.4615 3.4615 4.3637 4.3637 4.3661 4.3661 4.6608 4.6608 4.6670 4.6670 7.9398 7.9398 7.9539 7.9539 8.4060 8.4060 13.3029 13.3029 13.3728 13.3728 13.6702 13.6702 16.9068 16.9068 k = 0.5000 0.5000 0.3404 ( 2456 PWs) bands (ev): -46.3910 -46.3910 -24.0706 -24.0706 -22.0523 -22.0523 -21.9963 -21.9963 -18.9847 -18.9847 -7.8020 -7.8020 -7.4356 -7.4356 -7.3417 -7.3417 -2.9165 -2.9165 -2.6831 -2.6831 -2.6531 -2.6531 3.1509 3.1509 3.4423 3.4423 4.2893 4.2893 4.3828 4.3828 4.6372 4.6372 4.6431 4.6431 7.9764 7.9764 7.9903 7.9903 8.4071 8.4071 13.3408 13.3408 13.4093 13.4093 13.6738 13.6738 16.9295 16.9295 k = 0.5000 0.5000 0.3531 ( 2456 PWs) bands (ev): -46.3909 -46.3909 -24.0715 -24.0715 -22.0549 -22.0549 -21.9961 -21.9961 -18.9843 -18.9843 -7.7709 -7.7709 -7.4315 -7.4315 -7.3394 -7.3394 -2.9239 -2.9239 -2.6902 -2.6902 -2.6620 -2.6620 3.1513 3.1513 3.4207 3.4207 4.2209 4.2209 4.4008 4.4008 4.6155 4.6155 4.6211 4.6211 8.0105 8.0105 8.0241 8.0241 8.4082 8.4082 13.3776 13.3776 13.4444 13.4444 13.6778 13.6778 16.9459 16.9459 k = 0.5000 0.5000 0.3657 ( 2464 PWs) bands (ev): -46.3910 -46.3910 -24.0723 -24.0723 -22.0573 -22.0573 -21.9960 -21.9960 -18.9839 -18.9839 -7.7418 -7.7418 -7.4274 -7.4274 -7.3372 -7.3372 -2.9309 -2.9309 -2.6969 -2.6969 -2.6703 -2.6703 3.1517 3.1517 3.3968 3.3968 4.1610 4.1610 4.4177 4.4177 4.5956 4.5956 4.6008 4.6008 8.0419 8.0419 8.0553 8.0553 8.4093 8.4093 13.4130 13.4130 13.4774 13.4774 13.6822 13.6822 16.9574 16.9574 k = 0.5000 0.5000 0.3783 ( 2464 PWs) bands (ev): -46.3909 -46.3909 -24.0731 -24.0731 -22.0595 -22.0595 -21.9958 -21.9958 -18.9836 -18.9836 -7.7151 -7.7151 -7.4232 -7.4232 -7.3352 -7.3352 -2.9374 -2.9374 -2.7031 -2.7031 -2.6779 -2.6779 3.1520 3.1520 3.3711 3.3711 4.1097 4.1097 4.4333 4.4333 4.5775 4.5775 4.5824 4.5824 8.0705 8.0705 8.0837 8.0837 8.4102 8.4102 13.4466 13.4466 13.5079 13.5079 13.6873 13.6873 16.9649 16.9649 k = 0.5000 0.5000 0.3909 ( 2464 PWs) bands (ev): -46.3909 -46.3909 -24.0738 -24.0738 -22.0615 -22.0615 -21.9957 -21.9957 -18.9833 -18.9833 -7.6908 -7.6908 -7.4190 -7.4190 -7.3334 -7.3334 -2.9432 -2.9432 -2.7087 -2.7087 -2.6849 -2.6849 3.1523 3.1523 3.3444 3.3444 4.0665 4.0665 4.4475 4.4475 4.5612 4.5612 4.5659 4.5659 8.0963 8.0963 8.1093 8.1093 8.4111 8.4111 13.4780 13.4780 13.5351 13.5351 13.6932 13.6932 16.9696 16.9696 k = 0.5000 0.5000 0.4035 ( 2464 PWs) bands (ev): -46.3908 -46.3908 -24.0745 -24.0745 -22.0633 -22.0633 -21.9956 -21.9956 -18.9830 -18.9830 -7.6692 -7.6692 -7.4149 -7.4149 -7.3318 -7.3318 -2.9485 -2.9485 -2.7138 -2.7138 -2.6912 -2.6912 3.1526 3.1526 3.3177 3.3177 4.0307 4.0307 4.4603 4.4603 4.5469 4.5469 4.5513 4.5513 8.1192 8.1192 8.1320 8.1320 8.4119 8.4119 13.5068 13.5068 13.5587 13.5587 13.7001 13.7001 16.9722 16.9722 k = 0.5000 0.5000 0.4161 ( 2456 PWs) bands (ev): -46.3907 -46.3907 -24.0750 -24.0750 -22.0649 -22.0649 -21.9955 -21.9955 -18.9828 -18.9828 -7.6505 -7.6505 -7.4109 -7.4109 -7.3303 -7.3303 -2.9531 -2.9531 -2.7183 -2.7183 -2.6966 -2.6966 3.1529 3.1529 3.2918 3.2918 4.0018 4.0018 4.4716 4.4716 4.5344 4.5344 4.5386 4.5386 8.1391 8.1391 8.1517 8.1517 8.4126 8.4126 13.5327 13.5327 13.5782 13.5782 13.7079 13.7079 16.9734 16.9734 k = 0.5000 0.5000 0.4287 ( 2452 PWs) bands (ev): -46.3906 -46.3906 -24.0755 -24.0755 -22.0662 -22.0662 -21.9954 -21.9954 -18.9825 -18.9825 -7.6346 -7.6346 -7.4071 -7.4071 -7.3291 -7.3291 -2.9571 -2.9571 -2.7221 -2.7221 -2.7013 -2.7013 3.1531 3.1531 3.2680 3.2680 3.9788 3.9788 4.4812 4.4812 4.5239 4.5239 4.5278 4.5278 8.1561 8.1561 8.1685 8.1685 8.4132 8.4132 13.5553 13.5553 13.5935 13.5935 13.7163 13.7163 16.9736 16.9736 k = 0.5000 0.5000 0.4413 ( 2452 PWs) bands (ev): -46.3905 -46.3905 -24.0759 -24.0759 -22.0674 -22.0674 -21.9953 -21.9953 -18.9824 -18.9824 -7.6217 -7.6217 -7.4037 -7.4037 -7.3281 -7.3281 -2.9604 -2.9604 -2.7253 -2.7253 -2.7052 -2.7052 3.1533 3.1533 3.2471 3.2471 3.9611 3.9611 4.4892 4.4892 4.5152 4.5152 4.5190 4.5190 8.1700 8.1700 8.1823 8.1823 8.4138 8.4138 13.5742 13.5742 13.6049 13.6049 13.7248 13.7248 16.9732 16.9732 k = 0.5000 0.5000 0.4539 ( 2448 PWs) bands (ev): -46.3905 -46.3905 -24.0762 -24.0762 -22.0682 -22.0682 -21.9952 -21.9952 -18.9822 -18.9822 -7.6117 -7.6117 -7.4008 -7.4008 -7.3272 -7.3272 -2.9630 -2.9630 -2.7277 -2.7277 -2.7082 -2.7082 3.1534 3.1534 3.2300 3.2300 3.9480 3.9480 4.4954 4.4954 4.5085 4.5085 4.5121 4.5121 8.1808 8.1808 8.1931 8.1931 8.4142 8.4142 13.5893 13.5893 13.6130 13.6130 13.7325 13.7325 16.9726 16.9726 k = 0.5000 0.5000 0.4665 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0764 -24.0764 -22.0689 -22.0689 -21.9952 -21.9952 -18.9821 -18.9821 -7.6047 -7.6047 -7.3987 -7.3987 -7.3267 -7.3267 -2.9649 -2.9649 -2.7295 -2.7295 -2.7104 -2.7104 3.1535 3.1535 3.2173 3.2173 3.9390 3.9390 4.4999 4.4999 4.5036 4.5036 4.5072 4.5072 8.1886 8.1886 8.2008 8.2008 8.4144 8.4144 13.6002 13.6002 13.6183 13.6183 13.7387 13.7387 16.9720 16.9720 k = 0.5000 0.5000 0.4791 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0766 -24.0766 -22.0693 -22.0693 -21.9952 -21.9952 -18.9821 -18.9821 -7.6004 -7.6004 -7.3973 -7.3973 -7.3263 -7.3263 -2.9660 -2.9660 -2.7306 -2.7306 -2.7117 -2.7117 3.1536 3.1536 3.2095 3.2095 3.9338 3.9338 4.5007 4.5007 4.5026 4.5026 4.5043 4.5043 8.1932 8.1932 8.2054 8.2054 8.4146 8.4146 13.6068 13.6068 13.6213 13.6213 13.7426 13.7426 16.9715 16.9715 k = 0.5000 0.5000 0.4918 ( 2456 PWs) bands (ev): -46.3905 -46.3905 -24.0766 -24.0766 -22.0694 -22.0694 -21.9952 -21.9952 -18.9821 -18.9821 -7.5990 -7.5990 -7.3968 -7.3968 -7.3262 -7.3262 -2.9664 -2.9664 -2.7310 -2.7310 -2.7121 -2.7121 3.1536 3.1536 3.2068 3.2068 3.9320 3.9320 4.4998 4.4998 4.5032 4.5032 4.5036 4.5036 8.1948 8.1948 8.2070 8.2070 8.4147 8.4147 13.6090 13.6090 13.6223 13.6223 13.7440 13.7440 16.9714 16.9714 Writing output data file KNbO3.save init_run : 8.87s CPU 9.37s WALL ( 1 calls) electrons : 288.12s CPU 293.75s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.17s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 288.11s CPU 293.73s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.07s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.03s WALL ( 398 calls) cegterg : 255.02s CPU 259.35s WALL ( 712 calls) Called by sum_band: Called by *egterg: h_psi : 115.95s CPU 118.98s WALL ( 12606 calls) s_psi : 15.79s CPU 15.72s WALL ( 12606 calls) g_psi : 0.29s CPU 0.29s WALL ( 11496 calls) cdiaghg : 101.53s CPU 102.94s WALL ( 11894 calls) cegterg:over : 13.26s CPU 13.25s WALL ( 11496 calls) cegterg:upda : 9.85s CPU 9.82s WALL ( 11496 calls) cegterg:last : 6.38s CPU 6.46s WALL ( 2104 calls) cdiaghg:chol : 4.84s CPU 4.97s WALL ( 11894 calls) cdiaghg:inve : 3.84s CPU 3.78s WALL ( 11894 calls) cdiaghg:para : 8.35s CPU 8.60s WALL ( 23788 calls) Called by h_psi: h_psi:vloc : 97.13s CPU 99.62s WALL ( 12606 calls) h_psi:vnl : 18.59s CPU 19.10s WALL ( 12606 calls) add_vuspsi : 9.12s CPU 9.34s WALL ( 12606 calls) General routines calbec : 9.39s CPU 9.70s WALL ( 12606 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.01s CPU 0.01s WALL ( 4 calls) fftw : 91.13s CPU 93.42s WALL ( 1247372 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.16s CPU 0.14s WALL ( 796 calls) Parallel routines fft_scatter : 45.20s CPU 46.10s WALL ( 1247395 calls) PWSCF : 5m30.03s CPU 15m55.49s WALL This run was terminated on: 17:44:10 3Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=