Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:27: 9 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./SbSBr.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 31 25 7 1881 1389 211 Max 32 26 8 1889 1406 218 Sum 2237 1829 517 135703 100595 15349 bravais-lattice index = 14 lattice parameter (alat) = 7.4342 a.u. unit-cell volume = 2105.9580 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 244.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.434182 celldm(2)= 2.078800 celldm(3)= 2.465684 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 2.078800 0.000000 ) a(3) = ( 0.000000 0.000000 2.465684 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.481047 -0.000000 ) b(3) = ( 0.000000 0.000000 0.405567 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 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 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1213 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. # 3 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Br 7.00 79.90400 Br( 1.00) Sb 5.00 121.76000 Sb( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0394001 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.2328419 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -1.0394001 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.2328419 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion 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 [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -1.0394001 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.2328419 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0394001 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.2328419 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 320 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 3) = ( 0.0250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 4) = ( 0.0375000 -0.0000000 -0.0000000), wk = 0.0031250 k( 5) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 6) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 7) = ( 0.0750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 8) = ( 0.0875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 9) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 10) = ( 0.1125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 11) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 12) = ( 0.1375000 -0.0000000 -0.0000000), wk = 0.0031250 k( 13) = ( 0.1500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 14) = ( 0.1625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 15) = ( 0.1750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 16) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 17) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 18) = ( 0.2125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 19) = ( 0.2250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 20) = ( 0.2375000 -0.0000000 -0.0000000), wk = 0.0031250 k( 21) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 22) = ( 0.2625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 23) = ( 0.2750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 24) = ( 0.2875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 25) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 26) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 27) = ( 0.3250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 28) = ( 0.3375000 -0.0000000 -0.0000000), wk = 0.0031250 k( 29) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 30) = ( 0.3625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 31) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 32) = ( 0.3875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 33) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 34) = ( 0.4125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 35) = ( 0.4250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 36) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0031250 k( 37) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 38) = ( 0.4625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 39) = ( 0.4750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 40) = ( 0.4875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 41) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 42) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 43) = ( 0.5000000 0.0120262 -0.0000000), wk = 0.0031250 k( 44) = ( 0.5000000 0.0240523 -0.0000000), wk = 0.0031250 k( 45) = ( 0.5000000 0.0360785 -0.0000000), wk = 0.0031250 k( 46) = ( 0.5000000 0.0481047 -0.0000000), wk = 0.0031250 k( 47) = ( 0.5000000 0.0601308 -0.0000000), wk = 0.0031250 k( 48) = ( 0.5000000 0.0721570 -0.0000000), wk = 0.0031250 k( 49) = ( 0.5000000 0.0841832 -0.0000000), wk = 0.0031250 k( 50) = ( 0.5000000 0.0962093 -0.0000000), wk = 0.0031250 k( 51) = ( 0.5000000 0.1082355 -0.0000000), wk = 0.0031250 k( 52) = ( 0.5000000 0.1202617 -0.0000000), wk = 0.0031250 k( 53) = ( 0.5000000 0.1322878 -0.0000000), wk = 0.0031250 k( 54) = ( 0.5000000 0.1443140 -0.0000000), wk = 0.0031250 k( 55) = ( 0.5000000 0.1563402 -0.0000000), wk = 0.0031250 k( 56) = ( 0.5000000 0.1683663 -0.0000000), wk = 0.0031250 k( 57) = ( 0.5000000 0.1803925 -0.0000000), wk = 0.0031250 k( 58) = ( 0.5000000 0.1924187 -0.0000000), wk = 0.0031250 k( 59) = ( 0.5000000 0.2044449 -0.0000000), wk = 0.0031250 k( 60) = ( 0.5000000 0.2164710 -0.0000000), wk = 0.0031250 k( 61) = ( 0.5000000 0.2284972 -0.0000000), wk = 0.0031250 k( 62) = ( 0.5000000 0.2405234 -0.0000000), wk = 0.0031250 k( 63) = ( 0.5000000 0.2405234 -0.0000000), wk = 0.0031250 k( 64) = ( 0.4875000 0.2405234 -0.0000000), wk = 0.0031250 k( 65) = ( 0.4750000 0.2405234 -0.0000000), wk = 0.0031250 k( 66) = ( 0.4625000 0.2405234 -0.0000000), wk = 0.0031250 k( 67) = ( 0.4500000 0.2405234 -0.0000000), wk = 0.0031250 k( 68) = ( 0.4375000 0.2405234 -0.0000000), wk = 0.0031250 k( 69) = ( 0.4250000 0.2405234 -0.0000000), wk = 0.0031250 k( 70) = ( 0.4125000 0.2405234 -0.0000000), wk = 0.0031250 k( 71) = ( 0.4000000 0.2405234 -0.0000000), wk = 0.0031250 k( 72) = ( 0.3875000 0.2405234 -0.0000000), wk = 0.0031250 k( 73) = ( 0.3750000 0.2405234 -0.0000000), wk = 0.0031250 k( 74) = ( 0.3625000 0.2405234 -0.0000000), wk = 0.0031250 k( 75) = ( 0.3500000 0.2405234 -0.0000000), wk = 0.0031250 k( 76) = ( 0.3375000 0.2405234 -0.0000000), wk = 0.0031250 k( 77) = ( 0.3250000 0.2405234 -0.0000000), wk = 0.0031250 k( 78) = ( 0.3125000 0.2405234 -0.0000000), wk = 0.0031250 k( 79) = ( 0.3000000 0.2405234 -0.0000000), wk = 0.0031250 k( 80) = ( 0.2875000 0.2405234 -0.0000000), wk = 0.0031250 k( 81) = ( 0.2750000 0.2405234 -0.0000000), wk = 0.0031250 k( 82) = ( 0.2625000 0.2405234 -0.0000000), wk = 0.0031250 k( 83) = ( 0.2500000 0.2405234 -0.0000000), wk = 0.0031250 k( 84) = ( 0.2375000 0.2405234 -0.0000000), wk = 0.0031250 k( 85) = ( 0.2250000 0.2405234 -0.0000000), wk = 0.0031250 k( 86) = ( 0.2125000 0.2405234 -0.0000000), wk = 0.0031250 k( 87) = ( 0.2000000 0.2405234 -0.0000000), wk = 0.0031250 k( 88) = ( 0.1875000 0.2405234 -0.0000000), wk = 0.0031250 k( 89) = ( 0.1750000 0.2405234 -0.0000000), wk = 0.0031250 k( 90) = ( 0.1625000 0.2405234 -0.0000000), wk = 0.0031250 k( 91) = ( 0.1500000 0.2405234 -0.0000000), wk = 0.0031250 k( 92) = ( 0.1375000 0.2405234 -0.0000000), wk = 0.0031250 k( 93) = ( 0.1250000 0.2405234 -0.0000000), wk = 0.0031250 k( 94) = ( 0.1125000 0.2405234 -0.0000000), wk = 0.0031250 k( 95) = ( 0.1000000 0.2405234 -0.0000000), wk = 0.0031250 k( 96) = ( 0.0875000 0.2405234 -0.0000000), wk = 0.0031250 k( 97) = ( 0.0750000 0.2405234 -0.0000000), wk = 0.0031250 k( 98) = ( 0.0625000 0.2405234 -0.0000000), wk = 0.0031250 k( 99) = ( 0.0500000 0.2405234 -0.0000000), wk = 0.0031250 k( 100) = ( 0.0375000 0.2405234 -0.0000000), wk = 0.0031250 k( 101) = ( 0.0250000 0.2405234 -0.0000000), wk = 0.0031250 k( 102) = ( 0.0125000 0.2405234 -0.0000000), wk = 0.0031250 k( 103) = ( 0.0000000 0.2405234 -0.0000000), wk = 0.0031250 k( 104) = ( 0.0000000 0.2405234 -0.0000000), wk = 0.0031250 k( 105) = ( 0.0000000 0.2284972 -0.0000000), wk = 0.0031250 k( 106) = ( 0.0000000 0.2164710 -0.0000000), wk = 0.0031250 k( 107) = ( 0.0000000 0.2044449 -0.0000000), wk = 0.0031250 k( 108) = ( 0.0000000 0.1924187 -0.0000000), wk = 0.0031250 k( 109) = ( 0.0000000 0.1803925 -0.0000000), wk = 0.0031250 k( 110) = ( 0.0000000 0.1683663 -0.0000000), wk = 0.0031250 k( 111) = ( 0.0000000 0.1563402 -0.0000000), wk = 0.0031250 k( 112) = ( 0.0000000 0.1443140 -0.0000000), wk = 0.0031250 k( 113) = ( 0.0000000 0.1322878 -0.0000000), wk = 0.0031250 k( 114) = ( 0.0000000 0.1202617 -0.0000000), wk = 0.0031250 k( 115) = ( 0.0000000 0.1082355 -0.0000000), wk = 0.0031250 k( 116) = ( 0.0000000 0.0962093 -0.0000000), wk = 0.0031250 k( 117) = ( 0.0000000 0.0841832 -0.0000000), wk = 0.0031250 k( 118) = ( 0.0000000 0.0721570 -0.0000000), wk = 0.0031250 k( 119) = ( 0.0000000 0.0601308 -0.0000000), wk = 0.0031250 k( 120) = ( 0.0000000 0.0481047 -0.0000000), wk = 0.0031250 k( 121) = ( 0.0000000 0.0360785 -0.0000000), wk = 0.0031250 k( 122) = ( 0.0000000 0.0240523 -0.0000000), wk = 0.0031250 k( 123) = ( 0.0000000 0.0120262 -0.0000000), wk = 0.0031250 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 126) = ( 0.0000000 0.0000000 0.0119284), wk = 0.0031250 k( 127) = ( 0.0000000 0.0000000 0.0238569), wk = 0.0031250 k( 128) = ( 0.0000000 0.0000000 0.0357853), wk = 0.0031250 k( 129) = ( 0.0000000 0.0000000 0.0477138), wk = 0.0031250 k( 130) = ( 0.0000000 0.0000000 0.0596422), wk = 0.0031250 k( 131) = ( 0.0000000 0.0000000 0.0715706), wk = 0.0031250 k( 132) = ( 0.0000000 0.0000000 0.0834991), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.0954275), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.1073560), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.1192844), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.1312129), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.1431413), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.1550697), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.1669982), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.1789266), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.1908551), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.2027835), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.2027835), wk = 0.0031250 k( 144) = ( 0.0125000 -0.0000000 0.2027835), wk = 0.0031250 k( 145) = ( 0.0250000 -0.0000000 0.2027835), wk = 0.0031250 k( 146) = ( 0.0375000 -0.0000000 0.2027835), wk = 0.0031250 k( 147) = ( 0.0500000 -0.0000000 0.2027835), wk = 0.0031250 k( 148) = ( 0.0625000 -0.0000000 0.2027835), wk = 0.0031250 k( 149) = ( 0.0750000 -0.0000000 0.2027835), wk = 0.0031250 k( 150) = ( 0.0875000 -0.0000000 0.2027835), wk = 0.0031250 k( 151) = ( 0.1000000 -0.0000000 0.2027835), wk = 0.0031250 k( 152) = ( 0.1125000 -0.0000000 0.2027835), wk = 0.0031250 k( 153) = ( 0.1250000 -0.0000000 0.2027835), wk = 0.0031250 k( 154) = ( 0.1375000 -0.0000000 0.2027835), wk = 0.0031250 k( 155) = ( 0.1500000 -0.0000000 0.2027835), wk = 0.0031250 k( 156) = ( 0.1625000 -0.0000000 0.2027835), wk = 0.0031250 k( 157) = ( 0.1750000 -0.0000000 0.2027835), wk = 0.0031250 k( 158) = ( 0.1875000 -0.0000000 0.2027835), wk = 0.0031250 k( 159) = ( 0.2000000 -0.0000000 0.2027835), wk = 0.0031250 k( 160) = ( 0.2125000 -0.0000000 0.2027835), wk = 0.0031250 k( 161) = ( 0.2250000 -0.0000000 0.2027835), wk = 0.0031250 k( 162) = ( 0.2375000 -0.0000000 0.2027835), wk = 0.0031250 k( 163) = ( 0.2500000 -0.0000000 0.2027835), wk = 0.0031250 k( 164) = ( 0.2625000 -0.0000000 0.2027835), wk = 0.0031250 k( 165) = ( 0.2750000 -0.0000000 0.2027835), wk = 0.0031250 k( 166) = ( 0.2875000 -0.0000000 0.2027835), wk = 0.0031250 k( 167) = ( 0.3000000 -0.0000000 0.2027835), wk = 0.0031250 k( 168) = ( 0.3125000 -0.0000000 0.2027835), wk = 0.0031250 k( 169) = ( 0.3250000 -0.0000000 0.2027835), wk = 0.0031250 k( 170) = ( 0.3375000 -0.0000000 0.2027835), wk = 0.0031250 k( 171) = ( 0.3500000 -0.0000000 0.2027835), wk = 0.0031250 k( 172) = ( 0.3625000 -0.0000000 0.2027835), wk = 0.0031250 k( 173) = ( 0.3750000 -0.0000000 0.2027835), wk = 0.0031250 k( 174) = ( 0.3875000 -0.0000000 0.2027835), wk = 0.0031250 k( 175) = ( 0.4000000 -0.0000000 0.2027835), wk = 0.0031250 k( 176) = ( 0.4125000 -0.0000000 0.2027835), wk = 0.0031250 k( 177) = ( 0.4250000 -0.0000000 0.2027835), wk = 0.0031250 k( 178) = ( 0.4375000 -0.0000000 0.2027835), wk = 0.0031250 k( 179) = ( 0.4500000 -0.0000000 0.2027835), wk = 0.0031250 k( 180) = ( 0.4625000 -0.0000000 0.2027835), wk = 0.0031250 k( 181) = ( 0.4750000 -0.0000000 0.2027835), wk = 0.0031250 k( 182) = ( 0.4875000 -0.0000000 0.2027835), wk = 0.0031250 k( 183) = ( 0.5000000 -0.0000000 0.2027835), wk = 0.0031250 k( 184) = ( 0.5000000 -0.0000000 0.2027835), wk = 0.0031250 k( 185) = ( 0.5000000 0.0120262 0.2027835), wk = 0.0031250 k( 186) = ( 0.5000000 0.0240523 0.2027835), wk = 0.0031250 k( 187) = ( 0.5000000 0.0360785 0.2027835), wk = 0.0031250 k( 188) = ( 0.5000000 0.0481047 0.2027835), wk = 0.0031250 k( 189) = ( 0.5000000 0.0601308 0.2027835), wk = 0.0031250 k( 190) = ( 0.5000000 0.0721570 0.2027835), wk = 0.0031250 k( 191) = ( 0.5000000 0.0841832 0.2027835), wk = 0.0031250 k( 192) = ( 0.5000000 0.0962093 0.2027835), wk = 0.0031250 k( 193) = ( 0.5000000 0.1082355 0.2027835), wk = 0.0031250 k( 194) = ( 0.5000000 0.1202617 0.2027835), wk = 0.0031250 k( 195) = ( 0.5000000 0.1322878 0.2027835), wk = 0.0031250 k( 196) = ( 0.5000000 0.1443140 0.2027835), wk = 0.0031250 k( 197) = ( 0.5000000 0.1563402 0.2027835), wk = 0.0031250 k( 198) = ( 0.5000000 0.1683663 0.2027835), wk = 0.0031250 k( 199) = ( 0.5000000 0.1803925 0.2027835), wk = 0.0031250 k( 200) = ( 0.5000000 0.1924187 0.2027835), wk = 0.0031250 k( 201) = ( 0.5000000 0.2044449 0.2027835), wk = 0.0031250 k( 202) = ( 0.5000000 0.2164710 0.2027835), wk = 0.0031250 k( 203) = ( 0.5000000 0.2284972 0.2027835), wk = 0.0031250 k( 204) = ( 0.5000000 0.2405234 0.2027835), wk = 0.0031250 k( 205) = ( 0.5000000 0.2405234 0.2027835), wk = 0.0031250 k( 206) = ( 0.4875000 0.2405234 0.2027835), wk = 0.0031250 k( 207) = ( 0.4750000 0.2405234 0.2027835), wk = 0.0031250 k( 208) = ( 0.4625000 0.2405234 0.2027835), wk = 0.0031250 k( 209) = ( 0.4500000 0.2405234 0.2027835), wk = 0.0031250 k( 210) = ( 0.4375000 0.2405234 0.2027835), wk = 0.0031250 k( 211) = ( 0.4250000 0.2405234 0.2027835), wk = 0.0031250 k( 212) = ( 0.4125000 0.2405234 0.2027835), wk = 0.0031250 k( 213) = ( 0.4000000 0.2405234 0.2027835), wk = 0.0031250 k( 214) = ( 0.3875000 0.2405234 0.2027835), wk = 0.0031250 k( 215) = ( 0.3750000 0.2405234 0.2027835), wk = 0.0031250 k( 216) = ( 0.3625000 0.2405234 0.2027835), wk = 0.0031250 k( 217) = ( 0.3500000 0.2405234 0.2027835), wk = 0.0031250 k( 218) = ( 0.3375000 0.2405234 0.2027835), wk = 0.0031250 k( 219) = ( 0.3250000 0.2405234 0.2027835), wk = 0.0031250 k( 220) = ( 0.3125000 0.2405234 0.2027835), wk = 0.0031250 k( 221) = ( 0.3000000 0.2405234 0.2027835), wk = 0.0031250 k( 222) = ( 0.2875000 0.2405234 0.2027835), wk = 0.0031250 k( 223) = ( 0.2750000 0.2405234 0.2027835), wk = 0.0031250 k( 224) = ( 0.2625000 0.2405234 0.2027835), wk = 0.0031250 k( 225) = ( 0.2500000 0.2405234 0.2027835), wk = 0.0031250 k( 226) = ( 0.2375000 0.2405234 0.2027835), wk = 0.0031250 k( 227) = ( 0.2250000 0.2405234 0.2027835), wk = 0.0031250 k( 228) = ( 0.2125000 0.2405234 0.2027835), wk = 0.0031250 k( 229) = ( 0.2000000 0.2405234 0.2027835), wk = 0.0031250 k( 230) = ( 0.1875000 0.2405234 0.2027835), wk = 0.0031250 k( 231) = ( 0.1750000 0.2405234 0.2027835), wk = 0.0031250 k( 232) = ( 0.1625000 0.2405234 0.2027835), wk = 0.0031250 k( 233) = ( 0.1500000 0.2405234 0.2027835), wk = 0.0031250 k( 234) = ( 0.1375000 0.2405234 0.2027835), wk = 0.0031250 k( 235) = ( 0.1250000 0.2405234 0.2027835), wk = 0.0031250 k( 236) = ( 0.1125000 0.2405234 0.2027835), wk = 0.0031250 k( 237) = ( 0.1000000 0.2405234 0.2027835), wk = 0.0031250 k( 238) = ( 0.0875000 0.2405234 0.2027835), wk = 0.0031250 k( 239) = ( 0.0750000 0.2405234 0.2027835), wk = 0.0031250 k( 240) = ( 0.0625000 0.2405234 0.2027835), wk = 0.0031250 k( 241) = ( 0.0500000 0.2405234 0.2027835), wk = 0.0031250 k( 242) = ( 0.0375000 0.2405234 0.2027835), wk = 0.0031250 k( 243) = ( 0.0250000 0.2405234 0.2027835), wk = 0.0031250 k( 244) = ( 0.0125000 0.2405234 0.2027835), wk = 0.0031250 k( 245) = ( 0.0000000 0.2405234 0.2027835), wk = 0.0031250 k( 246) = ( 0.0000000 0.2405234 0.2027835), wk = 0.0031250 k( 247) = ( 0.0000000 0.2284972 0.2027835), wk = 0.0031250 k( 248) = ( 0.0000000 0.2164710 0.2027835), wk = 0.0031250 k( 249) = ( 0.0000000 0.2044449 0.2027835), wk = 0.0031250 k( 250) = ( 0.0000000 0.1924187 0.2027835), wk = 0.0031250 k( 251) = ( 0.0000000 0.1803925 0.2027835), wk = 0.0031250 k( 252) = ( 0.0000000 0.1683663 0.2027835), wk = 0.0031250 k( 253) = ( 0.0000000 0.1563402 0.2027835), wk = 0.0031250 k( 254) = ( 0.0000000 0.1443140 0.2027835), wk = 0.0031250 k( 255) = ( 0.0000000 0.1322878 0.2027835), wk = 0.0031250 k( 256) = ( 0.0000000 0.1202617 0.2027835), wk = 0.0031250 k( 257) = ( 0.0000000 0.1082355 0.2027835), wk = 0.0031250 k( 258) = ( 0.0000000 0.0962093 0.2027835), wk = 0.0031250 k( 259) = ( 0.0000000 0.0841832 0.2027835), wk = 0.0031250 k( 260) = ( 0.0000000 0.0721570 0.2027835), wk = 0.0031250 k( 261) = ( 0.0000000 0.0601308 0.2027835), wk = 0.0031250 k( 262) = ( 0.0000000 0.0481047 0.2027835), wk = 0.0031250 k( 263) = ( 0.0000000 0.0360785 0.2027835), wk = 0.0031250 k( 264) = ( 0.0000000 0.0240523 0.2027835), wk = 0.0031250 k( 265) = ( 0.0000000 0.0120262 0.2027835), wk = 0.0031250 k( 266) = ( 0.0000000 0.0000000 0.2027835), wk = 0.0031250 k( 267) = ( 0.0000000 0.2405234 -0.0000000), wk = 0.0031250 k( 268) = ( 0.0000000 0.2405234 0.0119284), wk = 0.0031250 k( 269) = ( 0.0000000 0.2405234 0.0238569), wk = 0.0031250 k( 270) = ( 0.0000000 0.2405234 0.0357853), wk = 0.0031250 k( 271) = ( 0.0000000 0.2405234 0.0477138), wk = 0.0031250 k( 272) = ( 0.0000000 0.2405234 0.0596422), wk = 0.0031250 k( 273) = ( 0.0000000 0.2405234 0.0715706), wk = 0.0031250 k( 274) = ( 0.0000000 0.2405234 0.0834991), wk = 0.0031250 k( 275) = ( 0.0000000 0.2405234 0.0954275), wk = 0.0031250 k( 276) = ( 0.0000000 0.2405234 0.1073560), wk = 0.0031250 k( 277) = ( 0.0000000 0.2405234 0.1192844), wk = 0.0031250 k( 278) = ( 0.0000000 0.2405234 0.1312129), wk = 0.0031250 k( 279) = ( 0.0000000 0.2405234 0.1431413), wk = 0.0031250 k( 280) = ( 0.0000000 0.2405234 0.1550697), wk = 0.0031250 k( 281) = ( 0.0000000 0.2405234 0.1669982), wk = 0.0031250 k( 282) = ( 0.0000000 0.2405234 0.1789266), wk = 0.0031250 k( 283) = ( 0.0000000 0.2405234 0.1908551), wk = 0.0031250 k( 284) = ( 0.0000000 0.2405234 0.2027835), wk = 0.0031250 k( 285) = ( 0.5000000 -0.0000000 0.2027835), wk = 0.0031250 k( 286) = ( 0.5000000 -0.0000000 0.1908551), wk = 0.0031250 k( 287) = ( 0.5000000 -0.0000000 0.1789266), wk = 0.0031250 k( 288) = ( 0.5000000 -0.0000000 0.1669982), wk = 0.0031250 k( 289) = ( 0.5000000 -0.0000000 0.1550697), wk = 0.0031250 k( 290) = ( 0.5000000 -0.0000000 0.1431413), wk = 0.0031250 k( 291) = ( 0.5000000 -0.0000000 0.1312129), wk = 0.0031250 k( 292) = ( 0.5000000 -0.0000000 0.1192844), wk = 0.0031250 k( 293) = ( 0.5000000 -0.0000000 0.1073560), wk = 0.0031250 k( 294) = ( 0.5000000 -0.0000000 0.0954275), wk = 0.0031250 k( 295) = ( 0.5000000 -0.0000000 0.0834991), wk = 0.0031250 k( 296) = ( 0.5000000 -0.0000000 0.0715706), wk = 0.0031250 k( 297) = ( 0.5000000 -0.0000000 0.0596422), wk = 0.0031250 k( 298) = ( 0.5000000 -0.0000000 0.0477138), wk = 0.0031250 k( 299) = ( 0.5000000 -0.0000000 0.0357853), wk = 0.0031250 k( 300) = ( 0.5000000 -0.0000000 0.0238569), wk = 0.0031250 k( 301) = ( 0.5000000 -0.0000000 0.0119284), wk = 0.0031250 k( 302) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 303) = ( 0.5000000 0.2405234 -0.0000000), wk = 0.0031250 k( 304) = ( 0.5000000 0.2405234 0.0119284), wk = 0.0031250 k( 305) = ( 0.5000000 0.2405234 0.0238569), wk = 0.0031250 k( 306) = ( 0.5000000 0.2405234 0.0357853), wk = 0.0031250 k( 307) = ( 0.5000000 0.2405234 0.0477138), wk = 0.0031250 k( 308) = ( 0.5000000 0.2405234 0.0596422), wk = 0.0031250 k( 309) = ( 0.5000000 0.2405234 0.0715706), wk = 0.0031250 k( 310) = ( 0.5000000 0.2405234 0.0834991), wk = 0.0031250 k( 311) = ( 0.5000000 0.2405234 0.0954275), wk = 0.0031250 k( 312) = ( 0.5000000 0.2405234 0.1073560), wk = 0.0031250 k( 313) = ( 0.5000000 0.2405234 0.1192844), wk = 0.0031250 k( 314) = ( 0.5000000 0.2405234 0.1312129), wk = 0.0031250 k( 315) = ( 0.5000000 0.2405234 0.1431413), wk = 0.0031250 k( 316) = ( 0.5000000 0.2405234 0.1550697), wk = 0.0031250 k( 317) = ( 0.5000000 0.2405234 0.1669982), wk = 0.0031250 k( 318) = ( 0.5000000 0.2405234 0.1789266), wk = 0.0031250 k( 319) = ( 0.5000000 0.2405234 0.1908551), wk = 0.0031250 k( 320) = ( 0.5000000 0.2405234 0.2027835), wk = 0.0031250 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0125000 -0.0000000 0.0000000), wk = 0.0031250 k( 3) = ( 0.0250000 -0.0000000 0.0000000), wk = 0.0031250 k( 4) = ( 0.0375000 0.0000000 0.0000000), wk = 0.0031250 k( 5) = ( 0.0500000 -0.0000000 0.0000000), wk = 0.0031250 k( 6) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 7) = ( 0.0750000 0.0000000 0.0000000), wk = 0.0031250 k( 8) = ( 0.0875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 9) = ( 0.1000000 -0.0000000 0.0000000), wk = 0.0031250 k( 10) = ( 0.1125000 -0.0000000 -0.0000000), wk = 0.0031250 k( 11) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 12) = ( 0.1375000 -0.0000000 0.0000000), wk = 0.0031250 k( 13) = ( 0.1500000 0.0000000 0.0000000), wk = 0.0031250 k( 14) = ( 0.1625000 -0.0000000 0.0000000), wk = 0.0031250 k( 15) = ( 0.1750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 16) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 17) = ( 0.2000000 -0.0000000 0.0000000), wk = 0.0031250 k( 18) = ( 0.2125000 -0.0000000 0.0000000), wk = 0.0031250 k( 19) = ( 0.2250000 -0.0000000 -0.0000000), wk = 0.0031250 k( 20) = ( 0.2375000 -0.0000000 0.0000000), wk = 0.0031250 k( 21) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 22) = ( 0.2625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 23) = ( 0.2750000 -0.0000000 0.0000000), wk = 0.0031250 k( 24) = ( 0.2875000 -0.0000000 -0.0000000), wk = 0.0031250 k( 25) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0031250 k( 26) = ( 0.3125000 -0.0000000 0.0000000), wk = 0.0031250 k( 27) = ( 0.3250000 -0.0000000 0.0000000), wk = 0.0031250 k( 28) = ( 0.3375000 -0.0000000 0.0000000), wk = 0.0031250 k( 29) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 30) = ( 0.3625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 31) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0031250 k( 32) = ( 0.3875000 -0.0000000 0.0000000), wk = 0.0031250 k( 33) = ( 0.4000000 -0.0000000 0.0000000), wk = 0.0031250 k( 34) = ( 0.4125000 -0.0000000 0.0000000), wk = 0.0031250 k( 35) = ( 0.4250000 -0.0000000 0.0000000), wk = 0.0031250 k( 36) = ( 0.4375000 0.0000000 -0.0000000), wk = 0.0031250 k( 37) = ( 0.4500000 -0.0000000 -0.0000000), wk = 0.0031250 k( 38) = ( 0.4625000 -0.0000000 -0.0000000), wk = 0.0031250 k( 39) = ( 0.4750000 -0.0000000 0.0000000), wk = 0.0031250 k( 40) = ( 0.4875000 -0.0000000 0.0000000), wk = 0.0031250 k( 41) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 42) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 43) = ( 0.5000000 0.0250000 -0.0000000), wk = 0.0031250 k( 44) = ( 0.5000000 0.0500000 -0.0000000), wk = 0.0031250 k( 45) = ( 0.5000000 0.0750000 0.0000000), wk = 0.0031250 k( 46) = ( 0.5000000 0.1000000 0.0000000), wk = 0.0031250 k( 47) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0031250 k( 48) = ( 0.5000000 0.1500000 -0.0000000), wk = 0.0031250 k( 49) = ( 0.5000000 0.1750000 -0.0000000), wk = 0.0031250 k( 50) = ( 0.5000000 0.2000000 -0.0000000), wk = 0.0031250 k( 51) = ( 0.5000000 0.2250000 0.0000000), wk = 0.0031250 k( 52) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0031250 k( 53) = ( 0.5000000 0.2750000 0.0000000), wk = 0.0031250 k( 54) = ( 0.5000000 0.3000000 -0.0000000), wk = 0.0031250 k( 55) = ( 0.5000000 0.3250000 -0.0000000), wk = 0.0031250 k( 56) = ( 0.5000000 0.3500000 -0.0000000), wk = 0.0031250 k( 57) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0031250 k( 58) = ( 0.5000000 0.4000000 0.0000000), wk = 0.0031250 k( 59) = ( 0.5000000 0.4250000 -0.0000000), wk = 0.0031250 k( 60) = ( 0.5000000 0.4500000 -0.0000000), wk = 0.0031250 k( 61) = ( 0.5000000 0.4750000 -0.0000000), wk = 0.0031250 k( 62) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 63) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 64) = ( 0.4875000 0.5000000 0.0000000), wk = 0.0031250 k( 65) = ( 0.4750000 0.5000000 -0.0000000), wk = 0.0031250 k( 66) = ( 0.4625000 0.5000000 0.0000000), wk = 0.0031250 k( 67) = ( 0.4500000 0.5000000 -0.0000000), wk = 0.0031250 k( 68) = ( 0.4375000 0.5000000 0.0000000), wk = 0.0031250 k( 69) = ( 0.4250000 0.5000000 -0.0000000), wk = 0.0031250 k( 70) = ( 0.4125000 0.5000000 0.0000000), wk = 0.0031250 k( 71) = ( 0.4000000 0.5000000 0.0000000), wk = 0.0031250 k( 72) = ( 0.3875000 0.5000000 -0.0000000), wk = 0.0031250 k( 73) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0031250 k( 74) = ( 0.3625000 0.5000000 -0.0000000), wk = 0.0031250 k( 75) = ( 0.3500000 0.5000000 -0.0000000), wk = 0.0031250 k( 76) = ( 0.3375000 0.5000000 -0.0000000), wk = 0.0031250 k( 77) = ( 0.3250000 0.5000000 0.0000000), wk = 0.0031250 k( 78) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0031250 k( 79) = ( 0.3000000 0.5000000 -0.0000000), wk = 0.0031250 k( 80) = ( 0.2875000 0.5000000 0.0000000), wk = 0.0031250 k( 81) = ( 0.2750000 0.5000000 -0.0000000), wk = 0.0031250 k( 82) = ( 0.2625000 0.5000000 -0.0000000), wk = 0.0031250 k( 83) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0031250 k( 84) = ( 0.2375000 0.5000000 0.0000000), wk = 0.0031250 k( 85) = ( 0.2250000 0.5000000 0.0000000), wk = 0.0031250 k( 86) = ( 0.2125000 0.5000000 0.0000000), wk = 0.0031250 k( 87) = ( 0.2000000 0.5000000 -0.0000000), wk = 0.0031250 k( 88) = ( 0.1875000 0.5000000 -0.0000000), wk = 0.0031250 k( 89) = ( 0.1750000 0.5000000 -0.0000000), wk = 0.0031250 k( 90) = ( 0.1625000 0.5000000 -0.0000000), wk = 0.0031250 k( 91) = ( 0.1500000 0.5000000 -0.0000000), wk = 0.0031250 k( 92) = ( 0.1375000 0.5000000 0.0000000), wk = 0.0031250 k( 93) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0031250 k( 94) = ( 0.1125000 0.5000000 0.0000000), wk = 0.0031250 k( 95) = ( 0.1000000 0.5000000 0.0000000), wk = 0.0031250 k( 96) = ( 0.0875000 0.5000000 0.0000000), wk = 0.0031250 k( 97) = ( 0.0750000 0.5000000 0.0000000), wk = 0.0031250 k( 98) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0031250 k( 99) = ( 0.0500000 0.5000000 0.0000000), wk = 0.0031250 k( 100) = ( 0.0375000 0.5000000 0.0000000), wk = 0.0031250 k( 101) = ( 0.0250000 0.5000000 0.0000000), wk = 0.0031250 k( 102) = ( 0.0125000 0.5000000 0.0000000), wk = 0.0031250 k( 103) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031250 k( 104) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031250 k( 105) = ( 0.0000000 0.4750000 0.0000000), wk = 0.0031250 k( 106) = ( 0.0000000 0.4500000 0.0000000), wk = 0.0031250 k( 107) = ( 0.0000000 0.4250000 0.0000000), wk = 0.0031250 k( 108) = ( 0.0000000 0.4000000 -0.0000000), wk = 0.0031250 k( 109) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0031250 k( 110) = ( 0.0000000 0.3500000 0.0000000), wk = 0.0031250 k( 111) = ( 0.0000000 0.3250000 -0.0000000), wk = 0.0031250 k( 112) = ( 0.0000000 0.3000000 0.0000000), wk = 0.0031250 k( 113) = ( 0.0000000 0.2750000 -0.0000000), wk = 0.0031250 k( 114) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0031250 k( 115) = ( 0.0000000 0.2250000 0.0000000), wk = 0.0031250 k( 116) = ( 0.0000000 0.2000000 -0.0000000), wk = 0.0031250 k( 117) = ( 0.0000000 0.1750000 0.0000000), wk = 0.0031250 k( 118) = ( 0.0000000 0.1500000 0.0000000), wk = 0.0031250 k( 119) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0031250 k( 120) = ( 0.0000000 0.1000000 -0.0000000), wk = 0.0031250 k( 121) = ( 0.0000000 0.0750000 0.0000000), wk = 0.0031250 k( 122) = ( 0.0000000 0.0500000 -0.0000000), wk = 0.0031250 k( 123) = ( 0.0000000 0.0250000 -0.0000000), wk = 0.0031250 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 126) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0031250 k( 127) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0031250 k( 128) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0031250 k( 129) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0031250 k( 130) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0031250 k( 131) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0031250 k( 132) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 144) = ( 0.0125000 -0.0000000 0.5000000), wk = 0.0031250 k( 145) = ( 0.0250000 -0.0000000 0.5000000), wk = 0.0031250 k( 146) = ( 0.0375000 0.0000000 0.5000000), wk = 0.0031250 k( 147) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0031250 k( 148) = ( 0.0625000 -0.0000000 0.5000000), wk = 0.0031250 k( 149) = ( 0.0750000 0.0000000 0.5000000), wk = 0.0031250 k( 150) = ( 0.0875000 -0.0000000 0.5000000), wk = 0.0031250 k( 151) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0031250 k( 152) = ( 0.1125000 -0.0000000 0.5000000), wk = 0.0031250 k( 153) = ( 0.1250000 -0.0000000 0.5000000), wk = 0.0031250 k( 154) = ( 0.1375000 -0.0000000 0.5000000), wk = 0.0031250 k( 155) = ( 0.1500000 0.0000000 0.5000000), wk = 0.0031250 k( 156) = ( 0.1625000 -0.0000000 0.5000000), wk = 0.0031250 k( 157) = ( 0.1750000 -0.0000000 0.5000000), wk = 0.0031250 k( 158) = ( 0.1875000 -0.0000000 0.5000000), wk = 0.0031250 k( 159) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0031250 k( 160) = ( 0.2125000 -0.0000000 0.5000000), wk = 0.0031250 k( 161) = ( 0.2250000 -0.0000000 0.5000000), wk = 0.0031250 k( 162) = ( 0.2375000 -0.0000000 0.5000000), wk = 0.0031250 k( 163) = ( 0.2500000 -0.0000000 0.5000000), wk = 0.0031250 k( 164) = ( 0.2625000 -0.0000000 0.5000000), wk = 0.0031250 k( 165) = ( 0.2750000 -0.0000000 0.5000000), wk = 0.0031250 k( 166) = ( 0.2875000 -0.0000000 0.5000000), wk = 0.0031250 k( 167) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0031250 k( 168) = ( 0.3125000 -0.0000000 0.5000000), wk = 0.0031250 k( 169) = ( 0.3250000 -0.0000000 0.5000000), wk = 0.0031250 k( 170) = ( 0.3375000 -0.0000000 0.5000000), wk = 0.0031250 k( 171) = ( 0.3500000 -0.0000000 0.5000000), wk = 0.0031250 k( 172) = ( 0.3625000 -0.0000000 0.5000000), wk = 0.0031250 k( 173) = ( 0.3750000 -0.0000000 0.5000000), wk = 0.0031250 k( 174) = ( 0.3875000 -0.0000000 0.5000000), wk = 0.0031250 k( 175) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0031250 k( 176) = ( 0.4125000 -0.0000000 0.5000000), wk = 0.0031250 k( 177) = ( 0.4250000 -0.0000000 0.5000000), wk = 0.0031250 k( 178) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0031250 k( 179) = ( 0.4500000 -0.0000000 0.5000000), wk = 0.0031250 k( 180) = ( 0.4625000 -0.0000000 0.5000000), wk = 0.0031250 k( 181) = ( 0.4750000 -0.0000000 0.5000000), wk = 0.0031250 k( 182) = ( 0.4875000 -0.0000000 0.5000000), wk = 0.0031250 k( 183) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0031250 k( 184) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0031250 k( 185) = ( 0.5000000 0.0250000 0.5000000), wk = 0.0031250 k( 186) = ( 0.5000000 0.0500000 0.5000000), wk = 0.0031250 k( 187) = ( 0.5000000 0.0750000 0.5000000), wk = 0.0031250 k( 188) = ( 0.5000000 0.1000000 0.5000000), wk = 0.0031250 k( 189) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0031250 k( 190) = ( 0.5000000 0.1500000 0.5000000), wk = 0.0031250 k( 191) = ( 0.5000000 0.1750000 0.5000000), wk = 0.0031250 k( 192) = ( 0.5000000 0.2000000 0.5000000), wk = 0.0031250 k( 193) = ( 0.5000000 0.2250000 0.5000000), wk = 0.0031250 k( 194) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0031250 k( 195) = ( 0.5000000 0.2750000 0.5000000), wk = 0.0031250 k( 196) = ( 0.5000000 0.3000000 0.5000000), wk = 0.0031250 k( 197) = ( 0.5000000 0.3250000 0.5000000), wk = 0.0031250 k( 198) = ( 0.5000000 0.3500000 0.5000000), wk = 0.0031250 k( 199) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0031250 k( 200) = ( 0.5000000 0.4000000 0.5000000), wk = 0.0031250 k( 201) = ( 0.5000000 0.4250000 0.5000000), wk = 0.0031250 k( 202) = ( 0.5000000 0.4500000 0.5000000), wk = 0.0031250 k( 203) = ( 0.5000000 0.4750000 0.5000000), wk = 0.0031250 k( 204) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 205) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 206) = ( 0.4875000 0.5000000 0.5000000), wk = 0.0031250 k( 207) = ( 0.4750000 0.5000000 0.5000000), wk = 0.0031250 k( 208) = ( 0.4625000 0.5000000 0.5000000), wk = 0.0031250 k( 209) = ( 0.4500000 0.5000000 0.5000000), wk = 0.0031250 k( 210) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0031250 k( 211) = ( 0.4250000 0.5000000 0.5000000), wk = 0.0031250 k( 212) = ( 0.4125000 0.5000000 0.5000000), wk = 0.0031250 k( 213) = ( 0.4000000 0.5000000 0.5000000), wk = 0.0031250 k( 214) = ( 0.3875000 0.5000000 0.5000000), wk = 0.0031250 k( 215) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0031250 k( 216) = ( 0.3625000 0.5000000 0.5000000), wk = 0.0031250 k( 217) = ( 0.3500000 0.5000000 0.5000000), wk = 0.0031250 k( 218) = ( 0.3375000 0.5000000 0.5000000), wk = 0.0031250 k( 219) = ( 0.3250000 0.5000000 0.5000000), wk = 0.0031250 k( 220) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0031250 k( 221) = ( 0.3000000 0.5000000 0.5000000), wk = 0.0031250 k( 222) = ( 0.2875000 0.5000000 0.5000000), wk = 0.0031250 k( 223) = ( 0.2750000 0.5000000 0.5000000), wk = 0.0031250 k( 224) = ( 0.2625000 0.5000000 0.5000000), wk = 0.0031250 k( 225) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0031250 k( 226) = ( 0.2375000 0.5000000 0.5000000), wk = 0.0031250 k( 227) = ( 0.2250000 0.5000000 0.5000000), wk = 0.0031250 k( 228) = ( 0.2125000 0.5000000 0.5000000), wk = 0.0031250 k( 229) = ( 0.2000000 0.5000000 0.5000000), wk = 0.0031250 k( 230) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0031250 k( 231) = ( 0.1750000 0.5000000 0.5000000), wk = 0.0031250 k( 232) = ( 0.1625000 0.5000000 0.5000000), wk = 0.0031250 k( 233) = ( 0.1500000 0.5000000 0.5000000), wk = 0.0031250 k( 234) = ( 0.1375000 0.5000000 0.5000000), wk = 0.0031250 k( 235) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0031250 k( 236) = ( 0.1125000 0.5000000 0.5000000), wk = 0.0031250 k( 237) = ( 0.1000000 0.5000000 0.5000000), wk = 0.0031250 k( 238) = ( 0.0875000 0.5000000 0.5000000), wk = 0.0031250 k( 239) = ( 0.0750000 0.5000000 0.5000000), wk = 0.0031250 k( 240) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0031250 k( 241) = ( 0.0500000 0.5000000 0.5000000), wk = 0.0031250 k( 242) = ( 0.0375000 0.5000000 0.5000000), wk = 0.0031250 k( 243) = ( 0.0250000 0.5000000 0.5000000), wk = 0.0031250 k( 244) = ( 0.0125000 0.5000000 0.5000000), wk = 0.0031250 k( 245) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 246) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 247) = ( 0.0000000 0.4750000 0.5000000), wk = 0.0031250 k( 248) = ( 0.0000000 0.4500000 0.5000000), wk = 0.0031250 k( 249) = ( 0.0000000 0.4250000 0.5000000), wk = 0.0031250 k( 250) = ( 0.0000000 0.4000000 0.5000000), wk = 0.0031250 k( 251) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0031250 k( 252) = ( 0.0000000 0.3500000 0.5000000), wk = 0.0031250 k( 253) = ( 0.0000000 0.3250000 0.5000000), wk = 0.0031250 k( 254) = ( 0.0000000 0.3000000 0.5000000), wk = 0.0031250 k( 255) = ( 0.0000000 0.2750000 0.5000000), wk = 0.0031250 k( 256) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0031250 k( 257) = ( 0.0000000 0.2250000 0.5000000), wk = 0.0031250 k( 258) = ( 0.0000000 0.2000000 0.5000000), wk = 0.0031250 k( 259) = ( 0.0000000 0.1750000 0.5000000), wk = 0.0031250 k( 260) = ( 0.0000000 0.1500000 0.5000000), wk = 0.0031250 k( 261) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0031250 k( 262) = ( 0.0000000 0.1000000 0.5000000), wk = 0.0031250 k( 263) = ( 0.0000000 0.0750000 0.5000000), wk = 0.0031250 k( 264) = ( 0.0000000 0.0500000 0.5000000), wk = 0.0031250 k( 265) = ( 0.0000000 0.0250000 0.5000000), wk = 0.0031250 k( 266) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 267) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031250 k( 268) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0031250 k( 269) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0031250 k( 270) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0031250 k( 271) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0031250 k( 272) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0031250 k( 273) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0031250 k( 274) = ( 0.0000000 0.5000000 0.2058824), wk = 0.0031250 k( 275) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0031250 k( 276) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0031250 k( 277) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0031250 k( 278) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0031250 k( 279) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0031250 k( 280) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0031250 k( 281) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0031250 k( 282) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0031250 k( 283) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0031250 k( 284) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 285) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0031250 k( 286) = ( 0.5000000 -0.0000000 0.4705882), wk = 0.0031250 k( 287) = ( 0.5000000 -0.0000000 0.4411765), wk = 0.0031250 k( 288) = ( 0.5000000 -0.0000000 0.4117647), wk = 0.0031250 k( 289) = ( 0.5000000 -0.0000000 0.3823529), wk = 0.0031250 k( 290) = ( 0.5000000 -0.0000000 0.3529412), wk = 0.0031250 k( 291) = ( 0.5000000 -0.0000000 0.3235294), wk = 0.0031250 k( 292) = ( 0.5000000 -0.0000000 0.2941177), wk = 0.0031250 k( 293) = ( 0.5000000 -0.0000000 0.2647059), wk = 0.0031250 k( 294) = ( 0.5000000 -0.0000000 0.2352941), wk = 0.0031250 k( 295) = ( 0.5000000 -0.0000000 0.2058824), wk = 0.0031250 k( 296) = ( 0.5000000 -0.0000000 0.1764706), wk = 0.0031250 k( 297) = ( 0.5000000 -0.0000000 0.1470588), wk = 0.0031250 k( 298) = ( 0.5000000 -0.0000000 0.1176471), wk = 0.0031250 k( 299) = ( 0.5000000 -0.0000000 0.0882353), wk = 0.0031250 k( 300) = ( 0.5000000 -0.0000000 0.0588235), wk = 0.0031250 k( 301) = ( 0.5000000 -0.0000000 0.0294118), wk = 0.0031250 k( 302) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0031250 k( 303) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 304) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0031250 k( 305) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0031250 k( 306) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0031250 k( 307) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0031250 k( 308) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0031250 k( 309) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0031250 k( 310) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0031250 k( 311) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0031250 k( 312) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0031250 k( 313) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0031250 k( 314) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0031250 k( 315) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0031250 k( 316) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0031250 k( 317) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0031250 k( 318) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0031250 k( 319) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0031250 k( 320) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 Dense grid: 135703 G-vectors FFT dimensions: ( 40, 80, 96) Smooth grid: 100595 G-vectors FFT dimensions: ( 36, 72, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.49 Mb ( 370, 86) NL pseudopotentials 0.93 Mb ( 185, 328) Each V/rho on FFT grid 0.10 Mb ( 6400) Each G-vector array 0.01 Mb ( 1885) G-vector shells 0.01 Mb ( 919) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.94 Mb ( 370, 344) Each subspace H/S matrix 0.05 Mb ( 57, 57) Each matrix 0.86 Mb ( 328, 2, 86) The potential is recalculated from file : ./SbSBr.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.8 secs Computing kpt #: 2 total cpu time spent up to now is 7.0 secs Computing kpt #: 3 total cpu time spent up to now is 9.2 secs Computing kpt #: 4 total cpu time spent up to now is 11.6 secs Computing kpt #: 5 total cpu time spent up to now is 14.1 secs Computing kpt #: 6 total cpu time spent up to now is 16.4 secs Computing kpt #: 7 total cpu time spent up to now is 18.3 secs Computing kpt #: 8 total cpu time spent up to now is 20.1 secs Computing kpt #: 9 total cpu time spent up to now is 22.0 secs Computing kpt #: 10 total cpu time spent up to now is 23.9 secs Computing kpt #: 11 total cpu time spent up to now is 25.8 secs Computing kpt #: 12 total cpu time spent up to now is 27.8 secs Computing kpt #: 13 total cpu time spent up to now is 29.7 secs Computing kpt #: 14 total cpu time spent up to now is 31.5 secs Computing kpt #: 15 total cpu time spent up to now is 33.4 secs Computing kpt #: 16 total cpu time spent up to now is 35.3 secs Computing kpt #: 17 total cpu time spent up to now is 37.2 secs Computing kpt #: 18 total cpu time spent up to now is 39.0 secs Computing kpt #: 19 total cpu time spent up to now is 40.9 secs Computing kpt #: 20 total cpu time spent up to now is 42.9 secs Computing kpt #: 21 total cpu time spent up to now is 44.8 secs Computing kpt #: 22 total cpu time spent up to now is 46.6 secs Computing kpt #: 23 total cpu time spent up to now is 48.5 secs Computing kpt #: 24 total cpu time spent up to now is 50.3 secs Computing kpt #: 25 total cpu time spent up to now is 52.1 secs Computing kpt #: 26 total cpu time spent up to now is 54.0 secs Computing kpt #: 27 total cpu time spent up to now is 55.9 secs Computing kpt #: 28 total cpu time spent up to now is 57.8 secs Computing kpt #: 29 total cpu time spent up to now is 59.9 secs Computing kpt #: 30 total cpu time spent up to now is 61.9 secs Computing kpt #: 31 total cpu time spent up to now is 64.0 secs Computing kpt #: 32 total cpu time spent up to now is 65.9 secs Computing kpt #: 33 total cpu time spent up to now is 67.8 secs Computing kpt #: 34 total cpu time spent up to now is 69.7 secs Computing kpt #: 35 total cpu time spent up to now is 71.7 secs Computing kpt #: 36 total cpu time spent up to now is 73.7 secs Computing kpt #: 37 total cpu time spent up to now is 75.7 secs Computing kpt #: 38 total cpu time spent up to now is 77.6 secs Computing kpt #: 39 total cpu time spent up to now is 79.5 secs Computing kpt #: 40 total cpu time spent up to now is 81.6 secs Computing kpt #: 41 total cpu time spent up to now is 83.5 secs Computing kpt #: 42 total cpu time spent up to now is 85.5 secs Computing kpt #: 43 total cpu time spent up to now is 87.4 secs Computing kpt #: 44 total cpu time spent up to now is 89.4 secs Computing kpt #: 45 total cpu time spent up to now is 91.2 secs Computing kpt #: 46 total cpu time spent up to now is 93.1 secs Computing kpt #: 47 total cpu time spent up to now is 95.0 secs Computing kpt #: 48 total cpu time spent up to now is 96.9 secs Computing kpt #: 49 total cpu time spent up to now is 98.9 secs Computing kpt #: 50 total cpu time spent up to now is 100.8 secs Computing kpt #: 51 total cpu time spent up to now is 102.7 secs Computing kpt #: 52 total cpu time spent up to now is 104.6 secs Computing kpt #: 53 total cpu time spent up to now is 106.7 secs Computing kpt #: 54 total cpu time spent up to now is 108.7 secs Computing kpt #: 55 total cpu time spent up to now is 110.6 secs Computing kpt #: 56 total cpu time spent up to now is 112.6 secs Computing kpt #: 57 total cpu time spent up to now is 114.4 secs Computing kpt #: 58 total cpu time spent up to now is 116.3 secs Computing kpt #: 59 total cpu time spent up to now is 118.2 secs Computing kpt #: 60 total cpu time spent up to now is 120.1 secs Computing kpt #: 61 total cpu time spent up to now is 122.0 secs Computing kpt #: 62 total cpu time spent up to now is 124.0 secs Computing kpt #: 63 total cpu time spent up to now is 126.2 secs Computing kpt #: 64 total cpu time spent up to now is 128.3 secs Computing kpt #: 65 total cpu time spent up to now is 130.4 secs Computing kpt #: 66 total cpu time spent up to now is 132.4 secs Computing kpt #: 67 total cpu time spent up to now is 134.4 secs Computing kpt #: 68 total cpu time spent up to now is 136.3 secs Computing kpt #: 69 total cpu time spent up to now is 138.2 secs Computing kpt #: 70 total cpu time spent up to now is 140.1 secs Computing kpt #: 71 total cpu time spent up to now is 142.0 secs Computing kpt #: 72 total cpu time spent up to now is 143.8 secs Computing kpt #: 73 total cpu time spent up to now is 145.8 secs Computing kpt #: 74 total cpu time spent up to now is 147.6 secs Computing kpt #: 75 total cpu time spent up to now is 149.5 secs Computing kpt #: 76 total cpu time spent up to now is 151.3 secs Computing kpt #: 77 total cpu time spent up to now is 153.1 secs Computing kpt #: 78 total cpu time spent up to now is 154.9 secs Computing kpt #: 79 total cpu time spent up to now is 156.9 secs Computing kpt #: 80 total cpu time spent up to now is 158.8 secs Computing kpt #: 81 total cpu time spent up to now is 160.6 secs Computing kpt #: 82 total cpu time spent up to now is 162.6 secs Computing kpt #: 83 total cpu time spent up to now is 164.5 secs Computing kpt #: 84 total cpu time spent up to now is 166.4 secs Computing kpt #: 85 total cpu time spent up to now is 168.2 secs Computing kpt #: 86 total cpu time spent up to now is 170.1 secs Computing kpt #: 87 total cpu time spent up to now is 172.1 secs Computing kpt #: 88 total cpu time spent up to now is 174.0 secs Computing kpt #: 89 total cpu time spent up to now is 175.9 secs Computing kpt #: 90 total cpu time spent up to now is 177.8 secs Computing kpt #: 91 total cpu time spent up to now is 179.7 secs Computing kpt #: 92 total cpu time spent up to now is 181.6 secs Computing kpt #: 93 total cpu time spent up to now is 183.5 secs Computing kpt #: 94 total cpu time spent up to now is 185.5 secs Computing kpt #: 95 total cpu time spent up to now is 187.4 secs Computing kpt #: 96 total cpu time spent up to now is 189.3 secs Computing kpt #: 97 total cpu time spent up to now is 191.4 secs Computing kpt #: 98 total cpu time spent up to now is 193.6 secs Computing kpt #: 99 total cpu time spent up to now is 195.9 secs Computing kpt #: 100 total cpu time spent up to now is 197.9 secs Computing kpt #: 101 total cpu time spent up to now is 199.7 secs Computing kpt #: 102 total cpu time spent up to now is 201.6 secs Computing kpt #: 103 total cpu time spent up to now is 203.6 secs Computing kpt #: 104 total cpu time spent up to now is 205.5 secs Computing kpt #: 105 total cpu time spent up to now is 207.7 secs Computing kpt #: 106 total cpu time spent up to now is 209.5 secs Computing kpt #: 107 total cpu time spent up to now is 212.4 secs Computing kpt #: 108 total cpu time spent up to now is 215.3 secs Computing kpt #: 109 total cpu time spent up to now is 217.4 secs Computing kpt #: 110 total cpu time spent up to now is 220.4 secs Computing kpt #: 111 total cpu time spent up to now is 223.2 secs Computing kpt #: 112 total cpu time spent up to now is 226.1 secs Computing kpt #: 113 total cpu time spent up to now is 229.0 secs Computing kpt #: 114 total cpu time spent up to now is 231.7 secs Computing kpt #: 115 total cpu time spent up to now is 234.6 secs Computing kpt #: 116 total cpu time spent up to now is 237.5 secs Computing kpt #: 117 total cpu time spent up to now is 240.5 secs Computing kpt #: 118 total cpu time spent up to now is 243.5 secs Computing kpt #: 119 total cpu time spent up to now is 246.5 secs Computing kpt #: 120 total cpu time spent up to now is 249.3 secs Computing kpt #: 121 total cpu time spent up to now is 252.1 secs Computing kpt #: 122 total cpu time spent up to now is 254.9 secs Computing kpt #: 123 total cpu time spent up to now is 257.1 secs Computing kpt #: 124 total cpu time spent up to now is 259.3 secs Computing kpt #: 125 total cpu time spent up to now is 261.4 secs Computing kpt #: 126 total cpu time spent up to now is 263.5 secs Computing kpt #: 127 total cpu time spent up to now is 265.9 secs Computing kpt #: 128 total cpu time spent up to now is 268.1 secs Computing kpt #: 129 total cpu time spent up to now is 270.3 secs Computing kpt #: 130 total cpu time spent up to now is 272.6 secs Computing kpt #: 131 total cpu time spent up to now is 275.5 secs Computing kpt #: 132 total cpu time spent up to now is 278.3 secs Computing kpt #: 133 total cpu time spent up to now is 281.2 secs Computing kpt #: 134 total cpu time spent up to now is 283.7 secs Computing kpt #: 135 total cpu time spent up to now is 286.3 secs Computing kpt #: 136 total cpu time spent up to now is 288.4 secs Computing kpt #: 137 total cpu time spent up to now is 291.3 secs Computing kpt #: 138 total cpu time spent up to now is 294.0 secs Computing kpt #: 139 total cpu time spent up to now is 296.1 secs Computing kpt #: 140 total cpu time spent up to now is 299.0 secs Computing kpt #: 141 total cpu time spent up to now is 301.9 secs Computing kpt #: 142 total cpu time spent up to now is 303.8 secs Computing kpt #: 143 total cpu time spent up to now is 305.6 secs Computing kpt #: 144 total cpu time spent up to now is 307.8 secs Computing kpt #: 145 total cpu time spent up to now is 310.8 secs Computing kpt #: 146 total cpu time spent up to now is 313.7 secs Computing kpt #: 147 total cpu time spent up to now is 315.6 secs Computing kpt #: 148 total cpu time spent up to now is 317.7 secs Computing kpt #: 149 total cpu time spent up to now is 319.7 secs Computing kpt #: 150 total cpu time spent up to now is 321.6 secs Computing kpt #: 151 total cpu time spent up to now is 323.5 secs Computing kpt #: 152 total cpu time spent up to now is 325.4 secs Computing kpt #: 153 total cpu time spent up to now is 327.5 secs Computing kpt #: 154 total cpu time spent up to now is 329.5 secs Computing kpt #: 155 total cpu time spent up to now is 331.5 secs Computing kpt #: 156 total cpu time spent up to now is 333.4 secs Computing kpt #: 157 total cpu time spent up to now is 335.5 secs Computing kpt #: 158 total cpu time spent up to now is 337.5 secs Computing kpt #: 159 total cpu time spent up to now is 339.5 secs Computing kpt #: 160 total cpu time spent up to now is 341.5 secs Computing kpt #: 161 total cpu time spent up to now is 343.4 secs Computing kpt #: 162 total cpu time spent up to now is 345.4 secs Computing kpt #: 163 total cpu time spent up to now is 347.4 secs Computing kpt #: 164 total cpu time spent up to now is 349.4 secs Computing kpt #: 165 total cpu time spent up to now is 351.4 secs Computing kpt #: 166 total cpu time spent up to now is 353.4 secs Computing kpt #: 167 total cpu time spent up to now is 355.3 secs Computing kpt #: 168 total cpu time spent up to now is 357.3 secs Computing kpt #: 169 total cpu time spent up to now is 359.2 secs Computing kpt #: 170 total cpu time spent up to now is 361.2 secs Computing kpt #: 171 total cpu time spent up to now is 363.3 secs Computing kpt #: 172 total cpu time spent up to now is 365.4 secs Computing kpt #: 173 total cpu time spent up to now is 367.5 secs Computing kpt #: 174 total cpu time spent up to now is 369.4 secs Computing kpt #: 175 total cpu time spent up to now is 371.4 secs Computing kpt #: 176 total cpu time spent up to now is 373.5 secs Computing kpt #: 177 total cpu time spent up to now is 375.5 secs Computing kpt #: 178 total cpu time spent up to now is 377.5 secs Computing kpt #: 179 total cpu time spent up to now is 379.5 secs Computing kpt #: 180 total cpu time spent up to now is 381.4 secs Computing kpt #: 181 total cpu time spent up to now is 383.7 secs Computing kpt #: 182 total cpu time spent up to now is 385.7 secs Computing kpt #: 183 total cpu time spent up to now is 387.6 secs Computing kpt #: 184 total cpu time spent up to now is 389.5 secs Computing kpt #: 185 total cpu time spent up to now is 391.3 secs Computing kpt #: 186 total cpu time spent up to now is 393.2 secs Computing kpt #: 187 total cpu time spent up to now is 395.0 secs Computing kpt #: 188 total cpu time spent up to now is 396.9 secs Computing kpt #: 189 total cpu time spent up to now is 398.7 secs Computing kpt #: 190 total cpu time spent up to now is 400.7 secs Computing kpt #: 191 total cpu time spent up to now is 402.5 secs Computing kpt #: 192 total cpu time spent up to now is 404.4 secs Computing kpt #: 193 total cpu time spent up to now is 406.3 secs Computing kpt #: 194 total cpu time spent up to now is 408.2 secs Computing kpt #: 195 total cpu time spent up to now is 410.2 secs Computing kpt #: 196 total cpu time spent up to now is 412.2 secs Computing kpt #: 197 total cpu time spent up to now is 414.1 secs Computing kpt #: 198 total cpu time spent up to now is 416.1 secs Computing kpt #: 199 total cpu time spent up to now is 418.0 secs Computing kpt #: 200 total cpu time spent up to now is 420.0 secs Computing kpt #: 201 total cpu time spent up to now is 421.9 secs Computing kpt #: 202 total cpu time spent up to now is 423.8 secs Computing kpt #: 203 total cpu time spent up to now is 425.7 secs Computing kpt #: 204 total cpu time spent up to now is 427.7 secs Computing kpt #: 205 total cpu time spent up to now is 429.8 secs Computing kpt #: 206 total cpu time spent up to now is 431.8 secs Computing kpt #: 207 total cpu time spent up to now is 433.8 secs Computing kpt #: 208 total cpu time spent up to now is 435.7 secs Computing kpt #: 209 total cpu time spent up to now is 437.6 secs Computing kpt #: 210 total cpu time spent up to now is 439.4 secs Computing kpt #: 211 total cpu time spent up to now is 441.2 secs Computing kpt #: 212 total cpu time spent up to now is 443.1 secs Computing kpt #: 213 total cpu time spent up to now is 445.1 secs Computing kpt #: 214 total cpu time spent up to now is 447.0 secs Computing kpt #: 215 total cpu time spent up to now is 448.9 secs Computing kpt #: 216 total cpu time spent up to now is 450.8 secs Computing kpt #: 217 total cpu time spent up to now is 452.7 secs Computing kpt #: 218 total cpu time spent up to now is 454.6 secs Computing kpt #: 219 total cpu time spent up to now is 456.4 secs Computing kpt #: 220 total cpu time spent up to now is 458.2 secs Computing kpt #: 221 total cpu time spent up to now is 460.1 secs Computing kpt #: 222 total cpu time spent up to now is 462.0 secs Computing kpt #: 223 total cpu time spent up to now is 463.9 secs Computing kpt #: 224 total cpu time spent up to now is 465.8 secs Computing kpt #: 225 total cpu time spent up to now is 467.6 secs Computing kpt #: 226 total cpu time spent up to now is 469.5 secs Computing kpt #: 227 total cpu time spent up to now is 471.4 secs Computing kpt #: 228 total cpu time spent up to now is 473.1 secs Computing kpt #: 229 total cpu time spent up to now is 475.0 secs Computing kpt #: 230 total cpu time spent up to now is 476.8 secs Computing kpt #: 231 total cpu time spent up to now is 478.6 secs Computing kpt #: 232 total cpu time spent up to now is 480.6 secs Computing kpt #: 233 total cpu time spent up to now is 482.4 secs Computing kpt #: 234 total cpu time spent up to now is 484.4 secs Computing kpt #: 235 total cpu time spent up to now is 486.3 secs Computing kpt #: 236 total cpu time spent up to now is 488.1 secs Computing kpt #: 237 total cpu time spent up to now is 490.0 secs Computing kpt #: 238 total cpu time spent up to now is 492.0 secs Computing kpt #: 239 total cpu time spent up to now is 494.0 secs Computing kpt #: 240 total cpu time spent up to now is 495.8 secs Computing kpt #: 241 total cpu time spent up to now is 497.7 secs Computing kpt #: 242 total cpu time spent up to now is 499.5 secs Computing kpt #: 243 total cpu time spent up to now is 501.4 secs Computing kpt #: 244 total cpu time spent up to now is 503.3 secs Computing kpt #: 245 total cpu time spent up to now is 505.1 secs Computing kpt #: 246 total cpu time spent up to now is 507.0 secs Computing kpt #: 247 total cpu time spent up to now is 508.9 secs Computing kpt #: 248 total cpu time spent up to now is 510.8 secs Computing kpt #: 249 total cpu time spent up to now is 512.7 secs Computing kpt #: 250 total cpu time spent up to now is 514.5 secs Computing kpt #: 251 total cpu time spent up to now is 516.5 secs Computing kpt #: 252 total cpu time spent up to now is 518.3 secs Computing kpt #: 253 total cpu time spent up to now is 520.2 secs Computing kpt #: 254 total cpu time spent up to now is 522.1 secs Computing kpt #: 255 total cpu time spent up to now is 523.9 secs Computing kpt #: 256 total cpu time spent up to now is 525.8 secs Computing kpt #: 257 total cpu time spent up to now is 527.6 secs Computing kpt #: 258 total cpu time spent up to now is 529.5 secs Computing kpt #: 259 total cpu time spent up to now is 531.4 secs Computing kpt #: 260 total cpu time spent up to now is 533.2 secs Computing kpt #: 261 total cpu time spent up to now is 535.1 secs Computing kpt #: 262 total cpu time spent up to now is 536.9 secs Computing kpt #: 263 total cpu time spent up to now is 538.8 secs Computing kpt #: 264 total cpu time spent up to now is 540.7 secs Computing kpt #: 265 total cpu time spent up to now is 542.7 secs Computing kpt #: 266 total cpu time spent up to now is 544.6 secs Computing kpt #: 267 total cpu time spent up to now is 546.6 secs Computing kpt #: 268 total cpu time spent up to now is 548.6 secs Computing kpt #: 269 total cpu time spent up to now is 550.4 secs Computing kpt #: 270 total cpu time spent up to now is 552.2 secs Computing kpt #: 271 total cpu time spent up to now is 554.0 secs Computing kpt #: 272 total cpu time spent up to now is 555.7 secs Computing kpt #: 273 total cpu time spent up to now is 557.4 secs Computing kpt #: 274 total cpu time spent up to now is 559.2 secs Computing kpt #: 275 total cpu time spent up to now is 560.9 secs Computing kpt #: 276 total cpu time spent up to now is 562.6 secs Computing kpt #: 277 total cpu time spent up to now is 564.3 secs Computing kpt #: 278 total cpu time spent up to now is 566.1 secs Computing kpt #: 279 total cpu time spent up to now is 567.9 secs Computing kpt #: 280 total cpu time spent up to now is 569.6 secs Computing kpt #: 281 total cpu time spent up to now is 571.4 secs Computing kpt #: 282 total cpu time spent up to now is 573.3 secs Computing kpt #: 283 total cpu time spent up to now is 575.1 secs Computing kpt #: 284 total cpu time spent up to now is 576.9 secs Computing kpt #: 285 total cpu time spent up to now is 578.6 secs Computing kpt #: 286 total cpu time spent up to now is 580.6 secs Computing kpt #: 287 total cpu time spent up to now is 582.6 secs Computing kpt #: 288 total cpu time spent up to now is 584.5 secs Computing kpt #: 289 total cpu time spent up to now is 586.5 secs Computing kpt #: 290 total cpu time spent up to now is 588.4 secs Computing kpt #: 291 total cpu time spent up to now is 590.4 secs Computing kpt #: 292 total cpu time spent up to now is 592.3 secs Computing kpt #: 293 total cpu time spent up to now is 594.2 secs Computing kpt #: 294 total cpu time spent up to now is 596.1 secs Computing kpt #: 295 total cpu time spent up to now is 598.1 secs Computing kpt #: 296 total cpu time spent up to now is 600.1 secs Computing kpt #: 297 total cpu time spent up to now is 602.0 secs Computing kpt #: 298 total cpu time spent up to now is 603.9 secs Computing kpt #: 299 total cpu time spent up to now is 605.7 secs Computing kpt #: 300 total cpu time spent up to now is 607.7 secs Computing kpt #: 301 total cpu time spent up to now is 609.7 secs Computing kpt #: 302 total cpu time spent up to now is 611.5 secs Computing kpt #: 303 total cpu time spent up to now is 613.3 secs Computing kpt #: 304 total cpu time spent up to now is 615.2 secs Computing kpt #: 305 total cpu time spent up to now is 617.1 secs Computing kpt #: 306 total cpu time spent up to now is 619.0 secs Computing kpt #: 307 total cpu time spent up to now is 620.9 secs Computing kpt #: 308 total cpu time spent up to now is 622.8 secs Computing kpt #: 309 total cpu time spent up to now is 624.9 secs Computing kpt #: 310 total cpu time spent up to now is 627.0 secs Computing kpt #: 311 total cpu time spent up to now is 629.0 secs Computing kpt #: 312 total cpu time spent up to now is 630.9 secs Computing kpt #: 313 total cpu time spent up to now is 632.9 secs Computing kpt #: 314 total cpu time spent up to now is 634.9 secs Computing kpt #: 315 total cpu time spent up to now is 637.0 secs Computing kpt #: 316 total cpu time spent up to now is 638.9 secs Computing kpt #: 317 total cpu time spent up to now is 641.2 secs Computing kpt #: 318 total cpu time spent up to now is 643.1 secs Computing kpt #: 319 total cpu time spent up to now is 645.1 secs Computing kpt #: 320 total cpu time spent up to now is 647.0 secs ethr = 1.39E-08, avg # of iterations = 20.1 total cpu time spent up to now is 647.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12611 PWs) bands (ev): -9.8416 -9.8416 -9.3981 -9.3981 -9.3263 -9.3263 -9.1589 -9.1589 -8.7628 -8.7628 -8.3660 -8.3660 -7.1486 -7.1486 -7.0642 -7.0642 -4.0669 -4.0669 -3.9061 -3.9061 -2.4826 -2.4826 -1.7197 -1.7197 0.6074 0.6074 0.6221 0.6221 1.2554 1.2554 1.4693 1.4693 1.6168 1.6168 1.6733 1.6733 1.8149 1.8149 1.9418 1.9418 2.7388 2.7388 3.0375 3.0375 3.1200 3.1200 3.1413 3.1413 3.1919 3.1919 3.2194 3.2194 3.4189 3.4189 3.4438 3.4438 3.4443 3.4443 3.6087 3.6087 3.6610 3.6610 3.6988 3.6988 3.8032 3.8032 4.4460 4.4460 4.5321 4.5321 4.6595 4.6595 6.5255 6.5255 6.9127 6.9127 7.4351 7.4351 7.4672 7.4672 7.7192 7.7192 7.7753 7.7753 8.0590 8.0590 k = 0.0125-0.0000-0.0000 ( 12609 PWs) bands (ev): -9.8407 -9.8407 -9.3974 -9.3974 -9.3258 -9.3258 -9.1585 -9.1585 -8.7620 -8.7620 -8.3655 -8.3655 -7.1482 -7.1482 -7.0640 -7.0640 -4.0672 -4.0672 -3.9069 -3.9069 -2.4828 -2.4828 -1.7209 -1.7209 0.6080 0.6080 0.6213 0.6213 1.2503 1.2503 1.4655 1.4655 1.6140 1.6140 1.6699 1.6699 1.8145 1.8145 1.9446 1.9446 2.7339 2.7339 3.0324 3.0324 3.0802 3.0802 3.1643 3.1643 3.1866 3.1866 3.2247 3.2247 3.3874 3.3874 3.4324 3.4324 3.4882 3.4882 3.5951 3.5951 3.6711 3.6711 3.7157 3.7157 3.8071 3.8071 4.4478 4.4478 4.5311 4.5311 4.6607 4.6607 6.5294 6.5294 6.9162 6.9162 7.4267 7.4267 7.4778 7.4778 7.7181 7.7181 7.7779 7.7779 8.0551 8.0551 k = 0.0250-0.0000-0.0000 ( 12611 PWs) bands (ev): -9.8382 -9.8382 -9.3954 -9.3954 -9.3245 -9.3245 -9.1575 -9.1575 -8.7598 -8.7598 -8.3641 -8.3641 -7.1471 -7.1471 -7.0634 -7.0634 -4.0683 -4.0683 -3.9093 -3.9093 -2.4834 -2.4834 -1.7244 -1.7244 0.6097 0.6097 0.6188 0.6188 1.2352 1.2352 1.4536 1.4536 1.6026 1.6026 1.6639 1.6639 1.8136 1.8136 1.9525 1.9525 2.7179 2.7179 3.0054 3.0054 3.0376 3.0376 3.1604 3.1604 3.1768 3.1768 3.2446 3.2446 3.3531 3.3531 3.4225 3.4225 3.5216 3.5216 3.5848 3.5848 3.6992 3.6992 3.7509 3.7509 3.8186 3.8186 4.4527 4.4527 4.5283 4.5283 4.6643 4.6643 6.5410 6.5410 6.9263 6.9263 7.4134 7.4134 7.4977 7.4977 7.7155 7.7155 7.7849 7.7849 8.0444 8.0444 k = 0.0375-0.0000-0.0000 ( 12625 PWs) bands (ev): -9.8339 -9.8339 -9.3921 -9.3921 -9.3223 -9.3223 -9.1558 -9.1558 -8.7561 -8.7561 -8.3618 -8.3618 -7.1453 -7.1453 -7.0624 -7.0624 -4.0699 -4.0699 -3.9132 -3.9132 -2.4844 -2.4844 -1.7302 -1.7302 0.6119 0.6119 0.6153 0.6153 1.2109 1.2109 1.4323 1.4323 1.5787 1.5787 1.6625 1.6625 1.8131 1.8131 1.9640 1.9640 2.6882 2.6882 2.9449 2.9449 3.0160 3.0160 3.1200 3.1200 3.1814 3.1814 3.2640 3.2640 3.3284 3.3284 3.4091 3.4091 3.5069 3.5069 3.6218 3.6218 3.7383 3.7383 3.7929 3.7929 3.8373 3.8373 4.4589 4.4589 4.5245 4.5245 4.6702 4.6702 6.5601 6.5601 6.9432 6.9432 7.4015 7.4015 7.5187 7.5187 7.7136 7.7136 7.7938 7.7938 8.0291 8.0291 k = 0.0500-0.0000-0.0000 ( 12621 PWs) bands (ev): -9.8279 -9.8279 -9.3875 -9.3875 -9.3192 -9.3192 -9.1534 -9.1534 -8.7509 -8.7509 -8.3585 -8.3585 -7.1428 -7.1428 -7.0610 -7.0610 -4.0723 -4.0723 -3.9187 -3.9187 -2.4859 -2.4859 -1.7385 -1.7385 0.6076 0.6076 0.6177 0.6177 1.1787 1.1787 1.3992 1.3992 1.5458 1.5458 1.6668 1.6668 1.8137 1.8137 1.9778 1.9778 2.6445 2.6445 2.8736 2.8736 2.9931 2.9931 3.0725 3.0725 3.1833 3.1833 3.2715 3.2715 3.3148 3.3148 3.3965 3.3965 3.4795 3.4795 3.6755 3.6755 3.7771 3.7771 3.8350 3.8350 3.8691 3.8691 4.4630 4.4630 4.5220 4.5220 4.6784 4.6784 6.5864 6.5864 6.9665 6.9665 7.3926 7.3926 7.5369 7.5369 7.7156 7.7156 7.8016 7.8016 8.0112 8.0112 k = 0.0625-0.0000-0.0000 ( 12601 PWs) bands (ev): -9.8202 -9.8202 -9.3817 -9.3817 -9.3152 -9.3152 -9.1504 -9.1504 -8.7441 -8.7441 -8.3543 -8.3543 -7.1397 -7.1397 -7.0593 -7.0593 -4.0753 -4.0753 -3.9256 -3.9256 -2.4879 -2.4879 -1.7493 -1.7493 0.5997 0.5997 0.6230 0.6230 1.1398 1.1398 1.3528 1.3528 1.5098 1.5098 1.6753 1.6753 1.8160 1.8160 1.9924 1.9924 2.5899 2.5899 2.7963 2.7963 2.9635 2.9635 3.0211 3.0211 3.1811 3.1811 3.2589 3.2589 3.3132 3.3132 3.3927 3.3927 3.4572 3.4572 3.7311 3.7311 3.8084 3.8084 3.8656 3.8656 3.9241 3.9241 4.4602 4.4602 4.5240 4.5240 4.6888 4.6888 6.6194 6.6194 6.9961 6.9961 7.3871 7.3871 7.5482 7.5482 7.7244 7.7244 7.8060 7.8060 7.9920 7.9920 k = 0.0750-0.0000-0.0000 ( 12601 PWs) bands (ev): -9.8109 -9.8109 -9.3746 -9.3746 -9.3104 -9.3104 -9.1467 -9.1467 -8.7359 -8.7359 -8.3491 -8.3491 -7.1361 -7.1361 -7.0574 -7.0574 -4.0789 -4.0789 -3.9339 -3.9339 -2.4906 -2.4906 -1.7626 -1.7626 0.5897 0.5897 0.6294 0.6294 1.0958 1.0958 1.2937 1.2937 1.4733 1.4733 1.6866 1.6866 1.8198 1.8198 2.0068 2.0068 2.5283 2.5283 2.7150 2.7150 2.9251 2.9251 2.9671 2.9671 3.1707 3.1707 3.2395 3.2395 3.3064 3.3064 3.3997 3.3997 3.4503 3.4503 3.7848 3.7848 3.8314 3.8314 3.8914 3.8914 3.9907 3.9907 4.4487 4.4487 4.5310 4.5310 4.7012 4.7012 6.6587 6.6587 7.0314 7.0314 7.3853 7.3853 7.5503 7.5503 7.7396 7.7396 7.8080 7.8080 7.9729 7.9729 k = 0.0875-0.0000-0.0000 ( 12601 PWs) bands (ev): -9.7999 -9.7999 -9.3663 -9.3663 -9.3048 -9.3048 -9.1424 -9.1424 -8.7262 -8.7262 -8.3431 -8.3431 -7.1319 -7.1319 -7.0553 -7.0553 -4.0831 -4.0831 -3.9435 -3.9435 -2.4941 -2.4941 -1.7786 -1.7786 0.5777 0.5777 0.6369 0.6369 1.0479 1.0479 1.2251 1.2251 1.4359 1.4359 1.7004 1.7004 1.8253 1.8253 2.0203 2.0203 2.4631 2.4631 2.6322 2.6322 2.8760 2.8760 2.9130 2.9130 3.1466 3.1466 3.2253 3.2253 3.2921 3.2921 3.4001 3.4001 3.4720 3.4720 3.8342 3.8342 3.8477 3.8477 3.9155 3.9155 4.0604 4.0604 4.4299 4.4299 4.5402 4.5402 4.7157 4.7157 6.7036 6.7036 7.0719 7.0719 7.3874 7.3874 7.5449 7.5449 7.7512 7.7512 7.8149 7.8149 7.9565 7.9565 k = 0.1000-0.0000-0.0000 ( 12605 PWs) bands (ev): -9.7874 -9.7874 -9.3568 -9.3568 -9.2984 -9.2984 -9.1376 -9.1376 -8.7149 -8.7149 -8.3361 -8.3361 -7.1273 -7.1273 -7.0531 -7.0531 -4.0879 -4.0879 -3.9543 -3.9543 -2.4984 -2.4984 -1.7975 -1.7975 0.5637 0.5637 0.6451 0.6451 0.9976 0.9976 1.1501 1.1501 1.3962 1.3962 1.7163 1.7163 1.8320 1.8320 2.0322 2.0322 2.3958 2.3958 2.5509 2.5509 2.8160 2.8160 2.8611 2.8611 3.1107 3.1107 3.2150 3.2150 3.2768 3.2768 3.3967 3.3967 3.5105 3.5105 3.8588 3.8588 3.8775 3.8775 3.9374 3.9374 4.1298 4.1298 4.4054 4.4054 4.5491 4.5491 4.7318 4.7318 6.7536 6.7536 7.1169 7.1169 7.3931 7.3931 7.5355 7.5355 7.7477 7.7477 7.8318 7.8318 7.9498 7.9498 k = 0.1125-0.0000-0.0000 ( 12605 PWs) bands (ev): -9.7732 -9.7732 -9.3463 -9.3463 -9.2912 -9.2912 -9.1321 -9.1321 -8.7021 -8.7021 -8.3282 -8.3282 -7.1223 -7.1223 -7.0509 -7.0509 -4.0932 -4.0932 -3.9662 -3.9662 -2.5039 -2.5039 -1.8192 -1.8192 0.5476 0.5476 0.6536 0.6536 0.9461 0.9461 1.0715 1.0715 1.3532 1.3532 1.7340 1.7340 1.8395 1.8395 2.0421 2.0421 2.3267 2.3267 2.4739 2.4739 2.7486 2.7486 2.8107 2.8107 3.0692 3.0692 3.2008 3.2008 3.2670 3.2670 3.3957 3.3957 3.5529 3.5529 3.8654 3.8654 3.9136 3.9136 3.9569 3.9569 4.1968 4.1968 4.3761 4.3761 4.5563 4.5563 4.7493 4.7493 6.8079 6.8079 7.1647 7.1647 7.4020 7.4020 7.5266 7.5266 7.7329 7.7329 7.8450 7.8450 7.9635 7.9635 k = 0.1250-0.0000-0.0000 ( 12587 PWs) bands (ev): -9.7576 -9.7576 -9.3348 -9.3348 -9.2834 -9.2834 -9.1261 -9.1261 -8.6877 -8.6877 -8.3195 -8.3195 -7.1171 -7.1171 -7.0489 -7.0489 -4.0990 -4.0990 -3.9789 -3.9789 -2.5105 -2.5105 -1.8440 -1.8440 0.5294 0.5294 0.6617 0.6617 0.8951 0.8951 0.9913 0.9913 1.3065 1.3065 1.7531 1.7531 1.8471 1.8471 2.0494 2.0494 2.2555 2.2555 2.4044 2.4044 2.6770 2.6770 2.7614 2.7614 3.0261 3.0261 3.1797 3.1797 3.2650 3.2650 3.3975 3.3975 3.5937 3.5937 3.8681 3.8681 3.9412 3.9412 3.9743 3.9743 4.2599 4.2599 4.3425 4.3425 4.5610 4.5610 4.7677 4.7677 6.8659 6.8659 7.2130 7.2130 7.4130 7.4130 7.5228 7.5228 7.7121 7.7121 7.8486 7.8486 7.9991 7.9991 k = 0.1375-0.0000-0.0000 ( 12589 PWs) bands (ev): -9.7405 -9.7405 -9.3223 -9.3223 -9.2748 -9.2748 -9.1196 -9.1196 -8.6718 -8.6718 -8.3098 -8.3098 -7.1118 -7.1118 -7.0471 -7.0471 -4.1052 -4.1052 -3.9925 -3.9925 -2.5186 -2.5186 -1.8719 -1.8719 0.5093 0.5093 0.6675 0.6675 0.8468 0.8468 0.9110 0.9110 1.2561 1.2561 1.7731 1.7731 1.8540 1.8540 2.0528 2.0528 2.1839 2.1839 2.3442 2.3442 2.6029 2.6029 2.7137 2.7137 2.9835 2.9835 3.1545 3.1545 3.2681 3.2681 3.4014 3.4014 3.6294 3.6294 3.8671 3.8671 3.9594 3.9594 3.9905 3.9905 4.3050 4.3050 4.3178 4.3178 4.5632 4.5632 4.7865 4.7865 6.9266 6.9266 7.2567 7.2567 7.4274 7.4274 7.5289 7.5289 7.6878 7.6878 7.8507 7.8507 8.0468 8.0468 k = 0.1500-0.0000-0.0000 ( 12575 PWs) bands (ev): -9.7219 -9.7219 -9.3089 -9.3089 -9.2657 -9.2657 -9.1127 -9.1127 -8.6543 -8.6543 -8.2993 -8.2993 -7.1066 -7.1066 -7.0456 -7.0456 -4.1117 -4.1117 -4.0065 -4.0065 -2.5283 -2.5283 -1.9030 -1.9030 0.4872 0.4872 0.6668 0.6668 0.8042 0.8042 0.8334 0.8334 1.2025 1.2025 1.7920 1.7920 1.8589 1.8589 2.0465 2.0465 2.1204 2.1204 2.2934 2.2934 2.5279 2.5279 2.6686 2.6686 2.9429 2.9429 3.1282 3.1282 3.2740 3.2740 3.4066 3.4066 3.6574 3.6574 3.8624 3.8624 3.9687 3.9687 4.0057 4.0057 4.2644 4.2644 4.3694 4.3694 4.5629 4.5629 4.8050 4.8050 6.9894 6.9894 7.2876 7.2876 7.4511 7.4511 7.5464 7.5464 7.6631 7.6631 7.8569 7.8569 8.0992 8.0992 k = 0.1625-0.0000-0.0000 ( 12563 PWs) bands (ev): -9.7020 -9.7020 -9.2948 -9.2948 -9.2559 -9.2559 -9.1053 -9.1053 -8.6351 -8.6351 -8.2879 -8.2879 -7.1015 -7.1015 -7.0448 -7.0448 -4.1185 -4.1185 -4.0209 -4.0209 -2.5398 -2.5398 -1.9374 -1.9374 0.4633 0.4633 0.6524 0.6524 0.7480 0.7480 0.7863 0.7863 1.1466 1.1466 1.8033 1.8033 1.8624 1.8624 2.0130 2.0130 2.0893 2.0893 2.2509 2.2509 2.4529 2.4529 2.6269 2.6269 2.9052 2.9052 3.1027 3.1027 3.2815 3.2815 3.4123 3.4123 3.6755 3.6755 3.8542 3.8542 3.9702 3.9702 4.0196 4.0196 4.2213 4.2213 4.4135 4.4135 4.5607 4.5607 4.8224 4.8224 7.0532 7.0532 7.3010 7.3010 7.4886 7.4886 7.5720 7.5720 7.6436 7.6436 7.8694 7.8694 8.1524 8.1524 k = 0.1750-0.0000-0.0000 ( 12571 PWs) bands (ev): -9.6808 -9.6808 -9.2799 -9.2799 -9.2457 -9.2457 -9.0976 -9.0976 -8.6144 -8.6144 -8.2757 -8.2757 -7.0967 -7.0967 -7.0446 -7.0446 -4.1253 -4.1253 -4.0354 -4.0354 -2.5534 -2.5534 -1.9752 -1.9752 0.4378 0.4378 0.6213 0.6213 0.6739 0.6739 0.7771 0.7771 1.0896 1.0896 1.7889 1.7889 1.8720 1.8720 1.9696 1.9696 2.0837 2.0837 2.2156 2.2156 2.3794 2.3794 2.5893 2.5893 2.8711 2.8711 3.0790 3.0790 3.2900 3.2900 3.4179 3.4179 3.6826 3.6826 3.8423 3.8423 3.9643 3.9643 4.0321 4.0321 4.1769 4.1769 4.4490 4.4490 4.5573 4.5573 4.8379 4.8379 7.1162 7.1162 7.3026 7.3026 7.5271 7.5271 7.5978 7.5978 7.6463 7.6463 7.8882 7.8882 8.2039 8.2039 k = 0.1875-0.0000-0.0000 ( 12579 PWs) bands (ev): -9.6584 -9.6584 -9.2645 -9.2645 -9.2349 -9.2349 -9.0895 -9.0895 -8.5920 -8.5920 -8.2626 -8.2626 -7.0925 -7.0925 -7.0453 -7.0453 -4.1321 -4.1321 -4.0497 -4.0497 -2.5692 -2.5692 -2.0164 -2.0164 0.4109 0.4109 0.5799 0.5799 0.6015 0.6015 0.7797 0.7797 1.0336 1.0336 1.7409 1.7409 1.8898 1.8898 1.9414 1.9414 2.0840 2.0840 2.1873 2.1873 2.3088 2.3088 2.5563 2.5563 2.8412 2.8412 3.0578 3.0578 3.2989 3.2989 3.4228 3.4228 3.6780 3.6780 3.8267 3.8267 3.9514 3.9514 4.0426 4.0426 4.1335 4.1335 4.4743 4.4743 4.5542 4.5542 4.8509 4.8509 7.1753 7.1753 7.3023 7.3023 7.5367 7.5367 7.6368 7.6368 7.6820 7.6820 7.9131 7.9131 8.2518 8.2518 k = 0.2000-0.0000-0.0000 ( 12577 PWs) bands (ev): -9.6349 -9.6349 -9.2485 -9.2485 -9.2238 -9.2238 -9.0811 -9.0811 -8.5679 -8.5679 -8.2486 -8.2486 -7.0889 -7.0889 -7.0470 -7.0470 -4.1386 -4.1386 -4.0635 -4.0635 -2.5875 -2.5875 -2.0610 -2.0610 0.3827 0.3827 0.5287 0.5287 0.5386 0.5386 0.7834 0.7834 0.9824 0.9824 1.6731 1.6731 1.9052 1.9052 1.9267 1.9267 2.0852 2.0852 2.1671 2.1671 2.2434 2.2434 2.5282 2.5282 2.8156 2.8156 3.0395 3.0395 3.3080 3.3080 3.4264 3.4264 3.6625 3.6625 3.8074 3.8074 3.9320 3.9320 4.0445 4.0445 4.0981 4.0981 4.4878 4.4878 4.5529 4.5529 4.8605 4.8605 7.2211 7.2211 7.3124 7.3124 7.5260 7.5260 7.6923 7.6923 7.7349 7.7349 7.9436 7.9436 8.2946 8.2946 k = 0.2125-0.0000-0.0000 ( 12583 PWs) bands (ev): -9.6103 -9.6103 -9.2322 -9.2322 -9.2124 -9.2124 -9.0726 -9.0726 -8.5422 -8.5422 -8.2338 -8.2338 -7.0862 -7.0862 -7.0500 -7.0500 -4.1448 -4.1448 -4.0766 -4.0766 -2.6085 -2.6085 -2.1088 -2.1088 0.3533 0.3533 0.4643 0.4643 0.4921 0.4921 0.7782 0.7782 0.9438 0.9438 1.5978 1.5978 1.8990 1.8990 1.9288 1.9288 2.0855 2.0855 2.1579 2.1579 2.1869 2.1869 2.5050 2.5050 2.7942 2.7942 3.0245 3.0245 3.3170 3.3170 3.4280 3.4280 3.6373 3.6373 3.7841 3.7841 3.9073 3.9073 4.0210 4.0210 4.0881 4.0881 4.4893 4.4893 4.5537 4.5537 4.8664 4.8664 7.2405 7.2405 7.3462 7.3462 7.5152 7.5152 7.7506 7.7506 7.7975 7.7975 7.9790 7.9790 8.3312 8.3312 k = 0.2250-0.0000-0.0000 ( 12563 PWs) bands (ev): -9.5848 -9.5848 -9.2156 -9.2156 -9.2007 -9.2007 -9.0638 -9.0638 -8.5148 -8.5148 -8.2181 -8.2181 -7.0846 -7.0846 -7.0544 -7.0544 -4.1504 -4.1504 -4.0885 -4.0885 -2.6322 -2.6322 -2.1599 -2.1599 0.3222 0.3222 0.4033 0.4033 0.4479 0.4479 0.7536 0.7536 0.9276 0.9276 1.5204 1.5204 1.8808 1.8808 1.9243 1.9243 2.0882 2.0882 2.1412 2.1412 2.1632 2.1632 2.4868 2.4868 2.7767 2.7767 3.0129 3.0129 3.3250 3.3250 3.4265 3.4265 3.6047 3.6047 3.7568 3.7568 3.8787 3.8787 3.9826 3.9826 4.0929 4.0929 4.4818 4.4818 4.5536 4.5536 4.8680 4.8680 7.2427 7.2427 7.3912 7.3912 7.5136 7.5136 7.8089 7.8089 7.8651 7.8651 8.0186 8.0186 8.3609 8.3609 k = 0.2375-0.0000-0.0000 ( 12559 PWs) bands (ev): -9.5584 -9.5584 -9.1988 -9.1988 -9.1889 -9.1889 -9.0549 -9.0549 -8.4858 -8.4858 -8.2016 -8.2016 -7.0844 -7.0844 -7.0603 -7.0603 -4.1551 -4.1551 -4.0991 -4.0991 -2.6589 -2.6589 -2.2141 -2.2141 0.2884 0.2884 0.3484 0.3484 0.4056 0.4056 0.7106 0.7106 0.9329 0.9329 1.4437 1.4437 1.8575 1.8575 1.8995 1.8995 2.0958 2.0958 2.1159 2.1159 2.1765 2.1765 2.4732 2.4732 2.7626 2.7626 3.0047 3.0047 3.3307 3.3307 3.4207 3.4207 3.5682 3.5682 3.7256 3.7256 3.8477 3.8477 3.9425 3.9425 4.0988 4.0988 4.4686 4.4686 4.5499 4.5499 4.8650 4.8650 7.2402 7.2402 7.4270 7.4270 7.5307 7.5307 7.8672 7.8672 7.9339 7.9339 8.0617 8.0617 8.3836 8.3836 k = 0.2500-0.0000-0.0000 ( 12573 PWs) bands (ev): -9.5314 -9.5314 -9.1819 -9.1819 -9.1769 -9.1769 -9.0460 -9.0460 -8.4551 -8.4551 -8.1842 -8.1842 -7.0856 -7.0856 -7.0680 -7.0680 -4.1588 -4.1588 -4.1079 -4.1079 -2.6887 -2.6887 -2.2712 -2.2712 0.2501 0.2501 0.3016 0.3016 0.3656 0.3656 0.6581 0.6581 0.9508 0.9508 1.3690 1.3690 1.8261 1.8261 1.8640 1.8640 2.0803 2.0803 2.1336 2.1336 2.1960 2.1960 2.4638 2.4638 2.7513 2.7513 2.9999 2.9999 3.3304 3.3304 3.4102 3.4102 3.5325 3.5325 3.6905 3.6905 3.8161 3.8161 3.9034 3.9034 4.1029 4.1029 4.4515 4.4515 4.5412 4.5412 4.8574 4.8574 7.2366 7.2366 7.4469 7.4469 7.5702 7.5702 7.9253 7.9253 8.0014 8.0014 8.1074 8.1074 8.3999 8.3999 k = 0.2625-0.0000-0.0000 ( 12555 PWs) bands (ev): -9.5038 -9.5038 -9.1656 -9.1656 -9.1644 -9.1644 -9.0371 -9.0371 -8.4227 -8.4227 -8.1659 -8.1659 -7.0885 -7.0885 -7.0775 -7.0775 -4.1611 -4.1611 -4.1147 -4.1147 -2.7216 -2.7216 -2.3310 -2.3310 0.2074 0.2074 0.2629 0.2629 0.3281 0.3281 0.6022 0.6022 0.9753 0.9753 1.2973 1.2973 1.7818 1.7818 1.8326 1.8326 2.0621 2.0621 2.1663 2.1663 2.2193 2.2193 2.4582 2.4582 2.7419 2.7419 2.9982 2.9982 3.3156 3.3156 3.3996 3.3996 3.5025 3.5025 3.6522 3.6522 3.7856 3.7856 3.8657 3.8657 4.1042 4.1042 4.4310 4.4310 4.5276 4.5276 4.8451 4.8451 7.2332 7.2332 7.4603 7.4603 7.6215 7.6215 7.9826 7.9826 8.0660 8.0660 8.1540 8.1540 8.4113 8.4113 k = 0.2750-0.0000-0.0000 ( 12559 PWs) bands (ev): -9.4757 -9.4757 -9.1533 -9.1533 -9.1481 -9.1481 -9.0283 -9.0283 -8.3888 -8.3888 -8.1467 -8.1467 -7.0934 -7.0934 -7.0890 -7.0890 -4.1618 -4.1618 -4.1192 -4.1192 -2.7576 -2.7576 -2.3934 -2.3934 0.1635 0.1635 0.2291 0.2291 0.2936 0.2936 0.5456 0.5456 1.0038 1.0038 1.2298 1.2298 1.7293 1.7293 1.8068 1.8068 2.0466 2.0466 2.2040 2.2040 2.2450 2.2450 2.4561 2.4561 2.7336 2.7336 2.9995 2.9995 3.2794 3.2794 3.3949 3.3949 3.4797 3.4797 3.6116 3.6116 3.7574 3.7574 3.8292 3.8292 4.1025 4.1025 4.4075 4.4075 4.5096 4.5096 4.8283 4.8283 7.2306 7.2306 7.4742 7.4742 7.6762 7.6762 8.0383 8.0383 8.1267 8.1267 8.1991 8.1991 8.4205 8.4205 k = 0.2875-0.0000-0.0000 ( 12565 PWs) bands (ev): -9.4473 -9.4473 -9.1416 -9.1416 -9.1316 -9.1316 -9.0196 -9.0196 -8.3533 -8.3533 -8.1265 -8.1265 -7.1031 -7.1031 -7.1000 -7.1000 -4.1607 -4.1607 -4.1210 -4.1210 -2.7966 -2.7966 -2.4579 -2.4579 0.1213 0.1213 0.1973 0.1973 0.2620 0.2620 0.4898 0.4898 1.0341 1.0341 1.1679 1.1679 1.6748 1.6748 1.7839 1.7839 2.0332 2.0332 2.2444 2.2444 2.2722 2.2722 2.4571 2.4571 2.7256 2.7256 3.0037 3.0037 3.2269 3.2269 3.3934 3.3934 3.4628 3.4628 3.5697 3.5697 3.7323 3.7323 3.7936 3.7936 4.0978 4.0978 4.3811 4.3811 4.4879 4.4879 4.8072 4.8072 7.2292 7.2292 7.4907 7.4907 7.7314 7.7314 8.0909 8.0909 8.1831 8.1831 8.2390 8.2390 8.4315 8.4315 k = 0.3000-0.0000-0.0000 ( 12583 PWs) bands (ev): -9.4188 -9.4188 -9.1303 -9.1303 -9.1153 -9.1153 -9.0111 -9.0111 -8.3162 -8.3162 -8.1054 -8.1054 -7.1190 -7.1190 -7.1093 -7.1093 -4.1575 -4.1575 -4.1198 -4.1198 -2.8386 -2.8386 -2.5245 -2.5245 0.0818 0.0818 0.1664 0.1664 0.2332 0.2332 0.4356 0.4356 1.0595 1.0595 1.1185 1.1185 1.6209 1.6209 1.7633 1.7633 2.0215 2.0215 2.2862 2.2862 2.3000 2.3000 2.4612 2.4612 2.7171 2.7171 3.0105 3.0105 3.1657 3.1657 3.3881 3.3881 3.4525 3.4525 3.5278 3.5278 3.7102 3.7102 3.7591 3.7591 4.0901 4.0901 4.3519 4.3519 4.4634 4.4634 4.7821 4.7821 7.2293 7.2293 7.5099 7.5099 7.7859 7.7859 8.1383 8.1383 8.2344 8.2344 8.2708 8.2708 8.4492 8.4492 k = 0.3125-0.0000-0.0000 ( 12581 PWs) bands (ev): -9.3903 -9.3903 -9.1194 -9.1194 -9.0995 -9.0995 -9.0028 -9.0028 -8.2776 -8.2776 -8.0833 -8.0833 -7.1372 -7.1372 -7.1210 -7.1210 -4.1519 -4.1519 -4.1155 -4.1155 -2.8835 -2.8835 -2.5927 -2.5927 0.0456 0.0456 0.1362 0.1362 0.2066 0.2066 0.3833 0.3833 1.0407 1.0407 1.1210 1.1210 1.5689 1.5689 1.7451 1.7451 2.0112 2.0112 2.3239 2.3239 2.3319 2.3319 2.4684 2.4684 2.7076 2.7076 3.0195 3.0195 3.1002 3.1002 3.3754 3.3754 3.4489 3.4489 3.4878 3.4878 3.6894 3.6894 3.7271 3.7271 4.0797 4.0797 4.3202 4.3202 4.4370 4.4370 4.7535 4.7535 7.2311 7.2311 7.5309 7.5309 7.8392 7.8392 8.1756 8.1756 8.2764 8.2764 8.3006 8.3006 8.4751 8.4751 k = 0.3250-0.0000-0.0000 ( 12571 PWs) bands (ev): -9.3620 -9.3620 -9.1089 -9.1089 -9.0841 -9.0841 -8.9949 -8.9949 -8.2376 -8.2376 -8.0602 -8.0602 -7.1577 -7.1577 -7.1352 -7.1352 -4.1437 -4.1437 -4.1079 -4.1079 -2.9310 -2.9310 -2.6623 -2.6623 0.0129 0.0129 0.1069 0.1069 0.1815 0.1815 0.3336 0.3336 0.9982 0.9982 1.1552 1.1552 1.5192 1.5192 1.7294 1.7294 2.0020 2.0020 2.3494 2.3494 2.3731 2.3731 2.4796 2.4796 2.6968 2.6968 3.0301 3.0301 3.0336 3.0336 3.3568 3.3568 3.4385 3.4385 3.4623 3.4623 3.6653 3.6653 3.7014 3.7014 4.0669 4.0669 4.2860 4.2860 4.4094 4.4094 4.7219 4.7219 7.2348 7.2348 7.5527 7.5527 7.8911 7.8911 8.1960 8.1960 8.3072 8.3072 8.3398 8.3398 8.5053 8.5053 k = 0.3375-0.0000-0.0000 ( 12545 PWs) bands (ev): -9.3340 -9.3340 -9.0991 -9.0991 -9.0693 -9.0693 -8.9874 -8.9874 -8.1963 -8.1963 -8.0360 -8.0360 -7.1805 -7.1805 -7.1520 -7.1520 -4.1327 -4.1327 -4.0967 -4.0967 -2.9809 -2.9809 -2.7330 -2.7330 -0.0163 -0.0163 0.0788 0.0788 0.1570 0.1570 0.2868 0.2868 0.9589 0.9589 1.1943 1.1943 1.4725 1.4725 1.7166 1.7166 1.9936 1.9936 2.3695 2.3695 2.4133 2.4133 2.4955 2.4955 2.6853 2.6853 2.9659 2.9659 3.0438 3.0438 3.3360 3.3360 3.4056 3.4056 3.4647 3.4647 3.6348 3.6348 3.6844 3.6844 4.0520 4.0520 4.2496 4.2496 4.3815 4.3815 4.6876 4.6876 7.2405 7.2405 7.5743 7.5743 7.9413 7.9413 8.1983 8.1983 8.3393 8.3393 8.3813 8.3813 8.5323 8.5323 k = 0.3500-0.0000-0.0000 ( 12567 PWs) bands (ev): -9.3067 -9.3067 -9.0900 -9.0900 -9.0551 -9.0551 -8.9803 -8.9803 -8.1538 -8.1538 -8.0107 -8.0107 -7.2055 -7.2055 -7.1715 -7.1715 -4.1187 -4.1187 -4.0819 -4.0819 -3.0329 -3.0329 -2.8044 -2.8044 -0.0420 -0.0420 0.0522 0.0522 0.1325 0.1325 0.2431 0.2431 0.9259 0.9259 1.2346 1.2346 1.4295 1.4295 1.7067 1.7067 1.9858 1.9858 2.3835 2.3835 2.4486 2.4486 2.5166 2.5166 2.6752 2.6752 2.9006 2.9006 3.0583 3.0583 3.3155 3.3155 3.3721 3.3721 3.4719 3.4719 3.6005 3.6005 3.6728 3.6728 4.0352 4.0352 4.2113 4.2113 4.3540 4.3540 4.6514 4.6514 7.2481 7.2481 7.5942 7.5942 7.9897 7.9897 8.1901 8.1901 8.3727 8.3727 8.4214 8.4214 8.5487 8.5487 k = 0.3625-0.0000-0.0000 ( 12567 PWs) bands (ev): -9.2800 -9.2800 -9.0817 -9.0817 -9.0416 -9.0416 -8.9738 -8.9738 -8.1100 -8.1100 -7.9843 -7.9843 -7.2326 -7.2326 -7.1938 -7.1938 -4.1016 -4.1016 -4.0633 -4.0633 -3.0868 -3.0868 -2.8764 -2.8764 -0.0644 -0.0644 0.0273 0.0273 0.1074 0.1074 0.2028 0.2028 0.9000 0.9000 1.2729 1.2729 1.3927 1.3927 1.6998 1.6998 1.9785 1.9785 2.3913 2.3913 2.4732 2.4732 2.5420 2.5420 2.6710 2.6710 2.8394 2.8394 3.0740 3.0740 3.2965 3.2965 3.3417 3.3417 3.4795 3.4795 3.5652 3.5652 3.6637 3.6637 4.0170 4.0170 4.1715 4.1715 4.3276 4.3276 4.6137 4.6137 7.2576 7.2576 7.6110 7.6110 8.0359 8.0359 8.1788 8.1788 8.4028 8.4028 8.4595 8.4595 8.5550 8.5550 k = 0.3750-0.0000-0.0000 ( 12562 PWs) bands (ev): -9.2542 -9.2542 -9.0744 -9.0744 -9.0288 -9.0288 -8.9678 -8.9678 -8.0653 -8.0653 -7.9567 -7.9567 -7.2618 -7.2618 -7.2188 -7.2188 -4.0813 -4.0813 -4.0409 -4.0409 -3.1422 -3.1422 -2.9484 -2.9484 -0.0834 -0.0834 0.0043 0.0043 0.0815 0.0815 0.1659 0.1659 0.8814 0.8814 1.2959 1.2959 1.3748 1.3748 1.6958 1.6958 1.9715 1.9715 2.3937 2.3937 2.4796 2.4796 2.5705 2.5705 2.6753 2.6753 2.7874 2.7874 3.0906 3.0906 3.2796 3.2796 3.3150 3.3150 3.4849 3.4849 3.5320 3.5320 3.6557 3.6557 3.9977 3.9977 4.1308 4.1308 4.3030 4.3030 4.5752 4.5752 7.2689 7.2689 7.6235 7.6235 8.0790 8.0790 8.1696 8.1696 8.4271 8.4271 8.4939 8.4939 8.5585 8.5585 k = 0.3875-0.0000-0.0000 ( 12558 PWs) bands (ev): -9.2295 -9.2295 -9.0681 -9.0681 -9.0169 -9.0169 -8.9625 -8.9625 -8.0197 -8.0197 -7.9279 -7.9279 -7.2928 -7.2928 -7.2465 -7.2465 -4.0577 -4.0577 -4.0146 -4.0146 -3.1988 -3.1988 -3.0204 -3.0204 -0.0993 -0.0993 -0.0165 -0.0165 0.0552 0.0552 0.1323 0.1323 0.8700 0.8700 1.2823 1.2823 1.3965 1.3965 1.6947 1.6947 1.9649 1.9649 2.3915 2.3915 2.4666 2.4666 2.5968 2.5968 2.6770 2.6770 2.7620 2.7620 3.1076 3.1076 3.2649 3.2649 3.2922 3.2922 3.4762 3.4762 3.5134 3.5134 3.6482 3.6482 3.9776 3.9776 4.0897 4.0897 4.2807 4.2807 4.5362 4.5362 7.2821 7.2821 7.6303 7.6303 8.1157 8.1157 8.1685 8.1685 8.4445 8.4445 8.5181 8.5181 8.5689 8.5689 k = 0.4000-0.0000-0.0000 ( 12562 PWs) bands (ev): -9.2060 -9.2060 -9.0631 -9.0631 -9.0058 -9.0058 -8.9578 -8.9578 -7.9732 -7.9732 -7.8979 -7.8979 -7.3255 -7.3255 -7.2767 -7.2767 -4.0308 -4.0308 -3.9846 -3.9846 -3.2562 -3.2562 -3.0920 -3.0920 -0.1120 -0.1120 -0.0350 -0.0350 0.0290 0.0290 0.1015 0.1015 0.8655 0.8655 1.2523 1.2523 1.4368 1.4368 1.6963 1.6963 1.9588 1.9588 2.3849 2.3849 2.4405 2.4405 2.5989 2.5989 2.6777 2.6777 2.7779 2.7779 3.1247 3.1247 3.2516 3.2516 3.2732 3.2732 3.4470 3.4470 3.5160 3.5160 3.6408 3.6408 3.9569 3.9569 4.0490 4.0490 4.2613 4.2613 4.4975 4.4975 7.2970 7.2970 7.6306 7.6306 8.1373 8.1373 8.1856 8.1856 8.4548 8.4548 8.5261 8.5261 8.5932 8.5932 k = 0.4125-0.0000-0.0000 ( 12562 PWs) bands (ev): -9.1839 -9.1839 -9.0593 -9.0593 -8.9955 -8.9955 -8.9539 -8.9539 -7.9262 -7.9262 -7.8668 -7.8668 -7.3596 -7.3596 -7.3095 -7.3095 -4.0005 -4.0005 -3.9508 -3.9508 -3.3141 -3.3141 -3.1629 -3.1629 -0.1218 -0.1218 -0.0510 -0.0510 0.0038 0.0038 0.0732 0.0732 0.8675 0.8675 1.2196 1.2196 1.4810 1.4810 1.7001 1.7001 1.9538 1.9538 2.3716 2.3716 2.4099 2.4099 2.5664 2.5664 2.7043 2.7043 2.8132 2.8132 3.1410 3.1410 3.2386 3.2386 3.2581 3.2581 3.4146 3.4146 3.5237 3.5237 3.6333 3.6333 3.9360 3.9360 4.0095 4.0095 4.2454 4.2454 4.4596 4.4596 7.3136 7.3136 7.6243 7.6243 8.1482 8.1482 8.2166 8.2166 8.4585 8.4585 8.5257 8.5257 8.6235 8.6235 k = 0.4250-0.0000-0.0000 ( 12554 PWs) bands (ev): -9.1634 -9.1634 -9.0569 -9.0569 -8.9862 -8.9862 -8.9508 -8.9508 -7.8787 -7.8787 -7.8345 -7.8345 -7.3950 -7.3950 -7.3447 -7.3447 -3.9670 -3.9670 -3.9134 -3.9134 -3.3721 -3.3721 -3.2328 -3.2328 -0.1288 -0.1288 -0.0645 -0.0645 -0.0197 -0.0197 0.0469 0.0469 0.8753 0.8753 1.1869 1.1869 1.5253 1.5253 1.7056 1.7056 1.9507 1.9507 2.3429 2.3429 2.3878 2.3878 2.5258 2.5258 2.7409 2.7409 2.8539 2.8539 3.1555 3.1555 3.2240 3.2240 3.2472 3.2472 3.3839 3.3839 3.5324 3.5324 3.6257 3.6257 3.9152 3.9152 3.9723 3.9723 4.2334 4.2334 4.4229 4.4229 7.3318 7.3318 7.6119 7.6119 8.1603 8.1603 8.2490 8.2490 8.4567 8.4567 8.5224 8.5224 8.6535 8.6535 k = 0.4375-0.0000-0.0000 ( 12556 PWs) bands (ev): -9.1444 -9.1444 -9.0560 -9.0560 -8.9779 -8.9779 -8.9486 -8.9486 -7.8310 -7.8310 -7.8010 -7.8010 -7.4314 -7.4314 -7.3820 -7.3820 -3.9304 -3.9304 -3.8723 -3.8723 -3.4300 -3.4300 -3.3016 -3.3016 -0.1332 -0.1332 -0.0754 -0.0754 -0.0406 -0.0406 0.0226 0.0226 0.8881 0.8881 1.1548 1.1548 1.5678 1.5678 1.7121 1.7121 1.9509 1.9509 2.3004 2.3004 2.3758 2.3758 2.4869 2.4869 2.7804 2.7804 2.8951 2.8951 3.1664 3.1664 3.2071 3.2071 3.2409 3.2409 3.3570 3.3570 3.5413 3.5413 3.6178 3.6178 3.8952 3.8952 3.9383 3.9383 4.2257 4.2257 4.3880 4.3880 7.3516 7.3516 7.5943 7.5943 8.1762 8.1762 8.2780 8.2780 8.4513 8.4513 8.5176 8.5176 8.6811 8.6811 k = 0.4500-0.0000-0.0000 ( 12570 PWs) bands (ev): -9.1272 -9.1272 -9.0567 -9.0567 -8.9705 -8.9705 -8.9472 -8.9472 -7.7831 -7.7831 -7.7665 -7.7665 -7.4686 -7.4686 -7.4213 -7.4213 -3.8907 -3.8907 -3.8279 -3.8279 -3.4873 -3.4873 -3.3689 -3.3689 -0.1351 -0.1351 -0.0844 -0.0844 -0.0577 -0.0577 0.0004 0.0004 0.9053 0.9053 1.1232 1.1232 1.6067 1.6067 1.7182 1.7182 1.9562 1.9562 2.2526 2.2526 2.3677 2.3677 2.4524 2.4524 2.8208 2.8208 2.9336 2.9336 3.1687 3.1687 3.1907 3.1907 3.2397 3.2397 3.3344 3.3344 3.5499 3.5499 3.6100 3.6100 3.8767 3.8767 3.9085 3.9085 4.2225 4.2225 4.3553 4.3553 7.3729 7.3729 7.5729 7.5729 8.1956 8.1956 8.3007 8.3007 8.4452 8.4452 8.5113 8.5113 8.7056 8.7056 k = 0.4625-0.0000-0.0000 ( 12574 PWs) bands (ev): -9.1118 -9.1118 -9.0591 -9.0591 -8.9641 -8.9641 -8.9467 -8.9467 -7.7354 -7.7354 -7.7311 -7.7311 -7.5063 -7.5063 -7.4625 -7.4625 -3.8481 -3.8481 -3.7801 -3.7801 -3.5438 -3.5438 -3.4345 -3.4345 -0.1348 -0.1348 -0.0932 -0.0932 -0.0688 -0.0688 -0.0195 -0.0195 0.9260 0.9260 1.0921 1.0921 1.6407 1.6407 1.7223 1.7223 1.9690 1.9690 2.2029 2.2029 2.3626 2.3626 2.4233 2.4233 2.8610 2.8610 2.9656 2.9656 3.1567 3.1567 3.1812 3.1812 3.2439 3.2439 3.3159 3.3159 3.5583 3.5583 3.6022 3.6022 3.8609 3.8609 3.8839 3.8839 4.2240 4.2240 4.3254 4.3254 7.3957 7.3957 7.5489 7.5489 8.2175 8.2175 8.3136 8.3136 8.4424 8.4424 8.5033 8.5033 8.7263 8.7263 k = 0.4750-0.0000-0.0000 ( 12560 PWs) bands (ev): -9.0983 -9.0983 -9.0632 -9.0632 -8.9587 -8.9587 -8.9471 -8.9471 -7.6948 -7.6948 -7.6879 -7.6879 -7.5443 -7.5443 -7.5052 -7.5052 -3.8028 -3.8028 -3.7293 -3.7293 -3.5991 -3.5991 -3.4981 -3.4981 -0.1323 -0.1323 -0.1031 -0.1031 -0.0724 -0.0724 -0.0368 -0.0368 0.9496 0.9496 1.0616 1.0616 1.6689 1.6689 1.7225 1.7225 1.9908 1.9908 2.1532 2.1532 2.3609 2.3609 2.3999 2.3999 2.9001 2.9001 2.9853 2.9853 3.1427 3.1427 3.1723 3.1723 3.2523 3.2523 3.3004 3.3004 3.5661 3.5661 3.5948 3.5948 3.8495 3.8495 3.8647 3.8647 4.2301 4.2301 4.2986 4.2986 7.4197 7.4197 7.5233 7.5233 8.2407 8.2407 8.3141 8.3141 8.4464 8.4464 8.4934 8.4934 8.7429 8.7429 k = 0.4875-0.0000-0.0000 ( 12558 PWs) bands (ev): -9.0867 -9.0867 -9.0692 -9.0692 -8.9543 -8.9543 -8.9485 -8.9485 -7.6578 -7.6578 -7.6409 -7.6409 -7.5824 -7.5824 -7.5494 -7.5494 -3.7550 -3.7550 -3.6754 -3.6754 -3.6529 -3.6529 -3.5597 -3.5597 -0.1279 -0.1279 -0.1130 -0.1130 -0.0697 -0.0697 -0.0513 -0.0513 0.9755 0.9755 1.0319 1.0319 1.6909 1.6909 1.7176 1.7176 2.0218 2.0218 2.1052 2.1052 2.3632 2.3632 2.3823 2.3823 2.9364 2.9364 2.9856 2.9856 3.1393 3.1393 3.1604 3.1604 3.2628 3.2628 3.2868 3.2868 3.5735 3.5735 3.5876 3.5876 3.8437 3.8437 3.8514 3.8514 4.2409 4.2409 4.2754 4.2754 7.4448 7.4448 7.4970 7.4970 8.2639 8.2639 8.3034 8.3034 8.4563 8.4563 8.4818 8.4818 8.7555 8.7555 k = 0.5000-0.0000-0.0000 ( 12548 PWs) bands (ev): -9.0770 -9.0770 -9.0770 -9.0770 -8.9509 -8.9509 -8.9509 -8.9509 -7.6203 -7.6203 -7.6203 -7.6203 -7.5947 -7.5947 -7.5947 -7.5947 -3.7050 -3.7050 -3.7050 -3.7050 -3.6188 -3.6188 -3.6188 -3.6188 -0.1214 -0.1214 -0.1214 -0.1214 -0.0624 -0.0624 -0.0624 -0.0624 1.0030 1.0030 1.0030 1.0030 1.7071 1.7071 1.7071 1.7071 2.0607 2.0607 2.0607 2.0607 2.3701 2.3701 2.3701 2.3701 2.9669 2.9669 2.9669 2.9669 3.1476 3.1476 3.1476 3.1476 3.2744 3.2744 3.2744 3.2744 3.5805 3.5805 3.5805 3.5805 3.8443 3.8443 3.8443 3.8443 4.2560 4.2560 4.2560 4.2560 7.4707 7.4707 7.4707 7.4707 8.2856 8.2856 8.2856 8.2856 8.4690 8.4690 8.4690 8.4690 8.7641 8.7641 k = 0.5000-0.0000-0.0000 ( 12548 PWs) bands (ev): -9.0770 -9.0770 -9.0770 -9.0770 -8.9509 -8.9509 -8.9509 -8.9509 -7.6203 -7.6203 -7.6203 -7.6203 -7.5947 -7.5947 -7.5947 -7.5947 -3.7050 -3.7050 -3.7050 -3.7050 -3.6188 -3.6188 -3.6188 -3.6188 -0.1214 -0.1214 -0.1214 -0.1214 -0.0624 -0.0624 -0.0624 -0.0624 1.0030 1.0030 1.0030 1.0030 1.7071 1.7071 1.7071 1.7071 2.0607 2.0607 2.0607 2.0607 2.3701 2.3701 2.3701 2.3701 2.9669 2.9669 2.9669 2.9669 3.1476 3.1476 3.1476 3.1476 3.2744 3.2744 3.2744 3.2744 3.5805 3.5805 3.5805 3.5805 3.8443 3.8443 3.8443 3.8443 4.2560 4.2560 4.2560 4.2560 7.4707 7.4707 7.4707 7.4707 8.2856 8.2856 8.2856 8.2856 8.4690 8.4690 8.4690 8.4690 8.7641 8.7641 k = 0.5000 0.0120-0.0000 ( 12556 PWs) bands (ev): -9.0768 -9.0768 -9.0768 -9.0768 -8.9511 -8.9511 -8.9511 -8.9511 -7.6202 -7.6202 -7.6202 -7.6202 -7.5947 -7.5947 -7.5947 -7.5947 -3.7049 -3.7049 -3.7049 -3.7049 -3.6190 -3.6190 -3.6190 -3.6190 -0.1211 -0.1211 -0.1211 -0.1211 -0.0622 -0.0622 -0.0622 -0.0622 1.0051 1.0051 1.0051 1.0051 1.7049 1.7049 1.7049 1.7049 2.0618 2.0618 2.0618 2.0618 2.3701 2.3701 2.3701 2.3701 2.9587 2.9587 2.9587 2.9587 3.1523 3.1523 3.1523 3.1523 3.2784 3.2784 3.2784 3.2784 3.5798 3.5798 3.5798 3.5798 3.8443 3.8443 3.8443 3.8443 4.2531 4.2531 4.2531 4.2531 7.4736 7.4736 7.4736 7.4736 8.2837 8.2837 8.2837 8.2837 8.4665 8.4665 8.4665 8.4665 8.7632 8.7632 k = 0.5000 0.0241-0.0000 ( 12550 PWs) bands (ev): -9.0762 -9.0762 -9.0762 -9.0762 -8.9517 -8.9517 -8.9517 -8.9517 -7.6201 -7.6201 -7.6201 -7.6201 -7.5949 -7.5949 -7.5949 -7.5949 -3.7047 -3.7047 -3.7047 -3.7047 -3.6197 -3.6197 -3.6197 -3.6197 -0.1203 -0.1203 -0.1203 -0.1203 -0.0614 -0.0614 -0.0614 -0.0614 1.0111 1.0111 1.0111 1.0111 1.6982 1.6982 1.6982 1.6982 2.0649 2.0649 2.0649 2.0649 2.3699 2.3699 2.3699 2.3699 2.9373 2.9373 2.9373 2.9373 3.1639 3.1639 3.1639 3.1639 3.2899 3.2899 3.2899 3.2899 3.5777 3.5777 3.5777 3.5777 3.8443 3.8443 3.8443 3.8443 4.2444 4.2444 4.2444 4.2444 7.4823 7.4823 7.4823 7.4823 8.2779 8.2779 8.2779 8.2779 8.4594 8.4594 8.4594 8.4594 8.7603 8.7603 k = 0.5000 0.0361-0.0000 ( 12550 PWs) bands (ev): -9.0753 -9.0753 -9.0753 -9.0753 -8.9527 -8.9527 -8.9527 -8.9527 -7.6200 -7.6200 -7.6200 -7.6200 -7.5951 -7.5951 -7.5951 -7.5951 -3.7043 -3.7043 -3.7043 -3.7043 -3.6207 -3.6207 -3.6207 -3.6207 -0.1189 -0.1189 -0.1189 -0.1189 -0.0601 -0.0601 -0.0601 -0.0601 1.0210 1.0210 1.0210 1.0210 1.6875 1.6875 1.6875 1.6875 2.0698 2.0698 2.0698 2.0698 2.3693 2.3693 2.3693 2.3693 2.9086 2.9086 2.9086 2.9086 3.1778 3.1778 3.1778 3.1778 3.3071 3.3071 3.3071 3.3071 3.5744 3.5744 3.5744 3.5744 3.8447 3.8447 3.8447 3.8447 4.2304 4.2304 4.2304 4.2304 7.4965 7.4965 7.4965 7.4965 8.2685 8.2685 8.2685 8.2685 8.4481 8.4481 8.4481 8.4481 8.7558 8.7558 k = 0.5000 0.0481-0.0000 ( 12550 PWs) bands (ev): -9.0739 -9.0739 -9.0739 -9.0739 -8.9541 -8.9541 -8.9541 -8.9541 -7.6197 -7.6197 -7.6197 -7.6197 -7.5954 -7.5954 -7.5954 -7.5954 -3.7038 -3.7038 -3.7038 -3.7038 -3.6221 -3.6221 -3.6221 -3.6221 -0.1170 -0.1170 -0.1170 -0.1170 -0.0582 -0.0582 -0.0582 -0.0582 1.0346 1.0346 1.0346 1.0346 1.6737 1.6737 1.6737 1.6737 2.0758 2.0758 2.0758 2.0758 2.3679 2.3679 2.3679 2.3679 2.8773 2.8773 2.8773 2.8773 3.1917 3.1917 3.1917 3.1917 3.3271 3.3271 3.3271 3.3271 3.5703 3.5703 3.5703 3.5703 3.8456 3.8456 3.8456 3.8456 4.2117 4.2117 4.2117 4.2117 7.5157 7.5157 7.5157 7.5157 8.2556 8.2556 8.2556 8.2556 8.4333 8.4333 8.4333 8.4333 8.7496 8.7496 k = 0.5000 0.0601-0.0000 ( 12550 PWs) bands (ev): -9.0722 -9.0722 -9.0722 -9.0722 -8.9558 -8.9558 -8.9558 -8.9558 -7.6194 -7.6194 -7.6194 -7.6194 -7.5958 -7.5958 -7.5958 -7.5958 -3.7031 -3.7031 -3.7031 -3.7031 -3.6238 -3.6238 -3.6238 -3.6238 -0.1148 -0.1148 -0.1148 -0.1148 -0.0558 -0.0558 -0.0558 -0.0558 1.0517 1.0517 1.0517 1.0517 1.6573 1.6573 1.6573 1.6573 2.0825 2.0825 2.0825 2.0825 2.3652 2.3652 2.3652 2.3652 2.8466 2.8466 2.8466 2.8466 3.2048 3.2048 3.2048 3.2048 3.3469 3.3469 3.3469 3.3469 3.5661 3.5661 3.5661 3.5661 3.8477 3.8477 3.8477 3.8477 4.1891 4.1891 4.1891 4.1891 7.5392 7.5392 7.5392 7.5392 8.2394 8.2394 8.2394 8.2394 8.4161 8.4161 8.4161 8.4161 8.7418 8.7418 k = 0.5000 0.0722-0.0000 ( 12546 PWs) bands (ev): -9.0702 -9.0702 -9.0702 -9.0702 -8.9579 -8.9579 -8.9579 -8.9579 -7.6190 -7.6190 -7.6190 -7.6190 -7.5962 -7.5962 -7.5962 -7.5962 -3.7023 -3.7023 -3.7023 -3.7023 -3.6260 -3.6260 -3.6260 -3.6260 -0.1121 -0.1121 -0.1121 -0.1121 -0.0529 -0.0529 -0.0529 -0.0529 1.0719 1.0719 1.0719 1.0719 1.6393 1.6393 1.6393 1.6393 2.0894 2.0894 2.0894 2.0894 2.3603 2.3603 2.3603 2.3603 2.8187 2.8187 2.8187 2.8187 3.2168 3.2168 3.2168 3.2168 3.3636 3.3636 3.3636 3.3636 3.5621 3.5621 3.5621 3.5621 3.8513 3.8513 3.8513 3.8513 4.1636 4.1636 4.1636 4.1636 7.5663 7.5663 7.5663 7.5663 8.2201 8.2201 8.2201 8.2201 8.3976 8.3976 8.3976 8.3976 8.7325 8.7325 k = 0.5000 0.0842-0.0000 ( 12542 PWs) bands (ev): -9.0678 -9.0678 -9.0678 -9.0678 -8.9603 -8.9603 -8.9603 -8.9603 -7.6185 -7.6185 -7.6185 -7.6185 -7.5968 -7.5968 -7.5968 -7.5968 -3.7013 -3.7013 -3.7013 -3.7013 -3.6284 -3.6284 -3.6284 -3.6284 -0.1090 -0.1090 -0.1090 -0.1090 -0.0496 -0.0496 -0.0496 -0.0496 1.0948 1.0948 1.0948 1.0948 1.6202 1.6202 1.6202 1.6202 2.0960 2.0960 2.0960 2.0960 2.3528 2.3528 2.3528 2.3528 2.7954 2.7954 2.7954 2.7954 3.2274 3.2274 3.2274 3.2274 3.3752 3.3752 3.3752 3.3752 3.5588 3.5588 3.5588 3.5588 3.8570 3.8570 3.8570 3.8570 4.1366 4.1366 4.1366 4.1366 7.5961 7.5961 7.5961 7.5961 8.1983 8.1983 8.1983 8.1983 8.3787 8.3787 8.3787 8.3787 8.7215 8.7215 k = 0.5000 0.0962-0.0000 ( 12542 PWs) bands (ev): -9.0651 -9.0651 -9.0651 -9.0651 -8.9631 -8.9631 -8.9631 -8.9631 -7.6180 -7.6180 -7.6180 -7.6180 -7.5974 -7.5974 -7.5974 -7.5974 -3.7001 -3.7001 -3.7001 -3.7001 -3.6311 -3.6311 -3.6311 -3.6311 -0.1056 -0.1056 -0.1056 -0.1056 -0.0459 -0.0459 -0.0459 -0.0459 1.1199 1.1199 1.1199 1.1199 1.6007 1.6007 1.6007 1.6007 2.1020 2.1020 2.1020 2.1020 2.3420 2.3420 2.3420 2.3420 2.7781 2.7781 2.7781 2.7781 3.2359 3.2359 3.2359 3.2359 3.3810 3.3810 3.3810 3.3810 3.5558 3.5558 3.5558 3.5558 3.8650 3.8650 3.8650 3.8650 4.1095 4.1095 4.1095 4.1095 7.6276 7.6276 7.6276 7.6276 8.1744 8.1744 8.1744 8.1744 8.3607 8.3607 8.3607 8.3607 8.7089 8.7089 k = 0.5000 0.1082-0.0000 ( 12544 PWs) bands (ev): -9.0621 -9.0621 -9.0621 -9.0621 -8.9662 -8.9662 -8.9662 -8.9662 -7.6174 -7.6174 -7.6174 -7.6174 -7.5981 -7.5981 -7.5981 -7.5981 -3.6988 -3.6988 -3.6988 -3.6988 -3.6340 -3.6340 -3.6340 -3.6340 -0.1019 -0.1019 -0.1019 -0.1019 -0.0420 -0.0420 -0.0420 -0.0420 1.1469 1.1469 1.1469 1.1469 1.5814 1.5814 1.5814 1.5814 2.1071 2.1071 2.1071 2.1071 2.3277 2.3277 2.3277 2.3277 2.7676 2.7676 2.7676 2.7676 3.2415 3.2415 3.2415 3.2415 3.3814 3.3814 3.3814 3.3814 3.5522 3.5522 3.5522 3.5522 3.8755 3.8755 3.8755 3.8755 4.0836 4.0836 4.0836 4.0836 7.6598 7.6598 7.6598 7.6598 8.1491 8.1491 8.1491 8.1491 8.3444 8.3444 8.3444 8.3444 8.6946 8.6946 k = 0.5000 0.1203-0.0000 ( 12560 PWs) bands (ev): -9.0587 -9.0587 -9.0587 -9.0587 -8.9696 -8.9696 -8.9696 -8.9696 -7.6168 -7.6168 -7.6168 -7.6168 -7.5988 -7.5988 -7.5988 -7.5988 -3.6973 -3.6973 -3.6973 -3.6973 -3.6372 -3.6372 -3.6372 -3.6372 -0.0978 -0.0978 -0.0978 -0.0978 -0.0382 -0.0382 -0.0382 -0.0382 1.1752 1.1752 1.1752 1.1752 1.5627 1.5627 1.5627 1.5627 2.1111 2.1111 2.1111 2.1111 2.3104 2.3104 2.3104 2.3104 2.7641 2.7641 2.7641 2.7641 3.2434 3.2434 3.2434 3.2434 3.3778 3.3778 3.3778 3.3778 3.5468 3.5468 3.5468 3.5468 3.8880 3.8880 3.8880 3.8880 4.0604 4.0604 4.0604 4.0604 7.6915 7.6915 7.6915 7.6915 8.1230 8.1230 8.1230 8.1230 8.3308 8.3308 8.3308 8.3308 8.6785 8.6785 k = 0.5000 0.1323-0.0000 ( 12568 PWs) bands (ev): -9.0551 -9.0551 -9.0551 -9.0551 -8.9733 -8.9733 -8.9733 -8.9733 -7.6161 -7.6161 -7.6161 -7.6161 -7.5996 -7.5996 -7.5996 -7.5996 -3.6956 -3.6956 -3.6956 -3.6956 -3.6405 -3.6405 -3.6405 -3.6405 -0.0933 -0.0933 -0.0933 -0.0933 -0.0345 -0.0345 -0.0345 -0.0345 1.2042 1.2042 1.2042 1.2042 1.5449 1.5449 1.5449 1.5449 2.1139 2.1139 2.1139 2.1139 2.2907 2.2907 2.2907 2.2907 2.7674 2.7674 2.7674 2.7674 3.2407 3.2407 3.2407 3.2407 3.3722 3.3722 3.3722 3.3722 3.5385 3.5385 3.5385 3.5385 3.9020 3.9020 3.9020 3.9020 4.0412 4.0412 4.0412 4.0412 7.7216 7.7216 7.7216 7.7216 8.0968 8.0968 8.0968 8.0968 8.3207 8.3207 8.3207 8.3207 8.6607 8.6607 k = 0.5000 0.1443-0.0000 ( 12574 PWs) bands (ev): -9.0513 -9.0513 -9.0513 -9.0513 -8.9772 -8.9772 -8.9772 -8.9772 -7.6154 -7.6154 -7.6154 -7.6154 -7.6004 -7.6004 -7.6004 -7.6004 -3.6938 -3.6938 -3.6938 -3.6938 -3.6440 -3.6440 -3.6440 -3.6440 -0.0886 -0.0886 -0.0886 -0.0886 -0.0312 -0.0312 -0.0312 -0.0312 1.2333 1.2333 1.2333 1.2333 1.5282 1.5282 1.5282 1.5282 2.1157 2.1157 2.1157 2.1157 2.2696 2.2696 2.2696 2.2696 2.7767 2.7767 2.7767 2.7767 3.2325 3.2325 3.2325 3.2325 3.3664 3.3664 3.3664 3.3664 3.5268 3.5268 3.5268 3.5268 3.9166 3.9166 3.9166 3.9166 4.0268 4.0268 4.0268 4.0268 7.7491 7.7491 7.7491 7.7491 8.0715 8.0715 8.0715 8.0715 8.3150 8.3150 8.3150 8.3150 8.6411 8.6411 k = 0.5000 0.1563-0.0000 ( 12594 PWs) bands (ev): -9.0472 -9.0472 -9.0472 -9.0472 -8.9813 -8.9813 -8.9813 -8.9813 -7.6146 -7.6146 -7.6146 -7.6146 -7.6013 -7.6013 -7.6013 -7.6013 -3.6918 -3.6918 -3.6918 -3.6918 -3.6476 -3.6476 -3.6476 -3.6476 -0.0836 -0.0836 -0.0836 -0.0836 -0.0284 -0.0284 -0.0284 -0.0284 1.2620 1.2620 1.2620 1.2620 1.5127 1.5127 1.5127 1.5127 2.1164 2.1164 2.1164 2.1164 2.2481 2.2481 2.2481 2.2481 2.7913 2.7913 2.7913 2.7913 3.2186 3.2186 3.2186 3.2186 3.3617 3.3617 3.3617 3.3617 3.5119 3.5119 3.5119 3.5119 3.9309 3.9309 3.9309 3.9309 4.0173 4.0173 4.0173 4.0173 7.7731 7.7731 7.7731 7.7731 8.0476 8.0476 8.0476 8.0476 8.3142 8.3142 8.3142 8.3142 8.6198 8.6198 k = 0.5000 0.1684-0.0000 ( 12592 PWs) bands (ev): -9.0429 -9.0429 -9.0429 -9.0429 -8.9857 -8.9857 -8.9857 -8.9857 -7.6138 -7.6138 -7.6138 -7.6138 -7.6022 -7.6022 -7.6022 -7.6022 -3.6896 -3.6896 -3.6896 -3.6896 -3.6512 -3.6512 -3.6512 -3.6512 -0.0785 -0.0785 -0.0785 -0.0785 -0.0263 -0.0263 -0.0263 -0.0263 1.2898 1.2898 1.2898 1.2898 1.4984 1.4984 1.4984 1.4984 2.1165 2.1165 2.1165 2.1165 2.2272 2.2272 2.2272 2.2272 2.8104 2.8104 2.8104 2.8104 3.1993 3.1993 3.1993 3.1993 3.3589 3.3589 3.3589 3.3589 3.4945 3.4945 3.4945 3.4945 3.9442 3.9442 3.9442 3.9442 4.0124 4.0124 4.0124 4.0124 7.7928 7.7928 7.7928 7.7928 8.0258 8.0258 8.0258 8.0258 8.3186 8.3186 8.3186 8.3186 8.5971 8.5971 k = 0.5000 0.1804-0.0000 ( 12586 PWs) bands (ev): -9.0385 -9.0385 -9.0385 -9.0385 -8.9902 -8.9902 -8.9902 -8.9902 -7.6129 -7.6129 -7.6129 -7.6129 -7.6032 -7.6032 -7.6032 -7.6032 -3.6872 -3.6872 -3.6872 -3.6872 -3.6548 -3.6548 -3.6548 -3.6548 -0.0734 -0.0734 -0.0734 -0.0734 -0.0248 -0.0248 -0.0248 -0.0248 1.3161 1.3161 1.3161 1.3161 1.4851 1.4851 1.4851 1.4851 2.1165 2.1165 2.1165 2.1165 2.2075 2.2075 2.2075 2.2075 2.8330 2.8330 2.8330 2.8330 3.1756 3.1756 3.1756 3.1756 3.3583 3.3583 3.3583 3.3583 3.4756 3.4756 3.4756 3.4756 3.9560 3.9560 3.9560 3.9560 4.0112 4.0112 4.0112 4.0112 7.8080 7.8080 7.8080 7.8080 8.0068 8.0068 8.0068 8.0068 8.3284 8.3284 8.3284 8.3284 8.5729 8.5729 k = 0.5000 0.1924-0.0000 ( 12582 PWs) bands (ev): -9.0338 -9.0338 -9.0338 -9.0338 -8.9949 -8.9949 -8.9949 -8.9949 -7.6120 -7.6120 -7.6120 -7.6120 -7.6041 -7.6041 -7.6041 -7.6041 -3.6847 -3.6847 -3.6847 -3.6847 -3.6584 -3.6584 -3.6584 -3.6584 -0.0685 -0.0685 -0.0685 -0.0685 -0.0241 -0.0241 -0.0241 -0.0241 1.3405 1.3405 1.3405 1.3405 1.4725 1.4725 1.4725 1.4725 2.1169 2.1169 2.1169 2.1169 2.1894 2.1894 2.1894 2.1894 2.8583 2.8583 2.8583 2.8583 3.1486 3.1486 3.1486 3.1486 3.3599 3.3599 3.3599 3.3599 3.4562 3.4562 3.4562 3.4562 3.9658 3.9658 3.9658 3.9658 4.0124 4.0124 4.0124 4.0124 7.8190 7.8190 7.8190 7.8190 7.9909 7.9909 7.9909 7.9909 8.3430 8.3430 8.3430 8.3430 8.5476 8.5476 k = 0.5000 0.2044-0.0000 ( 12576 PWs) bands (ev): -9.0291 -9.0291 -9.0291 -9.0291 -8.9997 -8.9997 -8.9997 -8.9997 -7.6110 -7.6110 -7.6110 -7.6110 -7.6051 -7.6051 -7.6051 -7.6051 -3.6820 -3.6820 -3.6820 -3.6820 -3.6620 -3.6620 -3.6620 -3.6620 -0.0640 -0.0640 -0.0640 -0.0640 -0.0240 -0.0240 -0.0240 -0.0240 1.3627 1.3627 1.3627 1.3627 1.4603 1.4603 1.4603 1.4603 2.1183 2.1183 2.1183 2.1183 2.1733 2.1733 2.1733 2.1733 2.8852 2.8852 2.8852 2.8852 3.1199 3.1199 3.1199 3.1199 3.3638 3.3638 3.3638 3.3638 3.4373 3.4373 3.4373 3.4373 3.9737 3.9737 3.9737 3.9737 4.0147 4.0147 4.0147 4.0147 7.8263 7.8263 7.8263 7.8263 7.9784 7.9784 7.9784 7.9784 8.3618 8.3618 8.3618 8.3618 8.5214 8.5214 k = 0.5000 0.2165-0.0000 ( 12564 PWs) bands (ev): -9.0242 -9.0242 -9.0242 -9.0242 -9.0045 -9.0045 -9.0045 -9.0045 -7.6101 -7.6101 -7.6101 -7.6101 -7.6061 -7.6061 -7.6061 -7.6061 -3.6792 -3.6792 -3.6792 -3.6792 -3.6654 -3.6654 -3.6654 -3.6654 -0.0604 -0.0604 -0.0604 -0.0604 -0.0243 -0.0243 -0.0243 -0.0243 1.3825 1.3825 1.3825 1.3825 1.4481 1.4481 1.4481 1.4481 2.1211 2.1211 2.1211 2.1211 2.1594 2.1594 2.1594 2.1594 2.9118 2.9118 2.9118 2.9118 3.0917 3.0917 3.0917 3.0917 3.3702 3.3702 3.3702 3.3702 3.4197 3.4197 3.4197 3.4197 3.9795 3.9795 3.9795 3.9795 4.0171 4.0171 4.0171 4.0171 7.8307 7.8307 7.8307 7.8307 7.9695 7.9695 7.9695 7.9695 8.3837 8.3837 8.3837 8.3837 8.4948 8.4948 k = 0.5000 0.2285-0.0000 ( 12560 PWs) bands (ev): -9.0193 -9.0193 -9.0193 -9.0193 -9.0094 -9.0094 -9.0094 -9.0094 -7.6091 -7.6091 -7.6091 -7.6091 -7.6071 -7.6071 -7.6071 -7.6071 -3.6765 -3.6765 -3.6765 -3.6765 -3.6685 -3.6685 -3.6685 -3.6685 -0.0579 -0.0579 -0.0579 -0.0579 -0.0247 -0.0247 -0.0247 -0.0247 1.3993 1.3993 1.3993 1.3993 1.4361 1.4361 1.4361 1.4361 2.1254 2.1254 2.1254 2.1254 2.1483 2.1483 2.1483 2.1483 2.9342 2.9342 2.9342 2.9342 3.0681 3.0681 3.0681 3.0681 3.3790 3.3790 3.3790 3.3790 3.4039 3.4039 3.4039 3.4039 3.9831 3.9831 3.9831 3.9831 4.0188 4.0188 4.0188 4.0188 7.8329 7.8329 7.8329 7.8329 7.9642 7.9642 7.9642 7.9642 8.4067 8.4067 8.4067 8.4067 8.4692 8.4692 k = 0.5000 0.2405-0.0000 ( 12568 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -7.6084 -7.6084 -7.6084 -7.6084 -7.6079 -7.6079 -7.6079 -7.6079 -3.6748 -3.6748 -3.6748 -3.6748 -3.6703 -3.6703 -3.6703 -3.6703 -0.0571 -0.0571 -0.0571 -0.0571 -0.0248 -0.0248 -0.0248 -0.0248 1.4085 1.4085 1.4085 1.4085 1.4285 1.4285 1.4285 1.4285 2.1284 2.1284 2.1284 2.1284 2.1429 2.1429 2.1429 2.1429 2.9440 2.9440 2.9440 2.9440 3.0580 3.0580 3.0580 3.0580 3.3896 3.3896 3.3896 3.3896 3.3910 3.3910 3.3910 3.3910 3.9843 3.9843 3.9843 3.9843 4.0194 4.0194 4.0194 4.0194 7.8336 7.8336 7.8336 7.8336 7.9624 7.9624 7.9624 7.9624 8.4218 8.4218 8.4218 8.4218 8.4533 8.4533 k = 0.5000 0.2405-0.0000 ( 12568 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -7.6084 -7.6084 -7.6084 -7.6084 -7.6079 -7.6079 -7.6079 -7.6079 -3.6748 -3.6748 -3.6748 -3.6748 -3.6703 -3.6703 -3.6703 -3.6703 -0.0571 -0.0571 -0.0571 -0.0571 -0.0248 -0.0248 -0.0248 -0.0248 1.4085 1.4085 1.4085 1.4085 1.4285 1.4285 1.4285 1.4285 2.1284 2.1284 2.1284 2.1284 2.1429 2.1429 2.1429 2.1429 2.9440 2.9440 2.9440 2.9440 3.0580 3.0580 3.0580 3.0580 3.3896 3.3896 3.3896 3.3896 3.3910 3.3910 3.3910 3.3910 3.9843 3.9843 3.9843 3.9843 4.0194 4.0194 4.0194 4.0194 7.8336 7.8336 7.8336 7.8336 7.9624 7.9624 7.9624 7.9624 8.4218 8.4218 8.4218 8.4218 8.4533 8.4533 k = 0.4875 0.2405-0.0000 ( 12584 PWs) bands (ev): -9.0208 -9.0208 -9.0208 -9.0208 -9.0094 -9.0094 -9.0094 -9.0094 -7.6519 -7.6519 -7.6514 -7.6514 -7.5651 -7.5651 -7.5647 -7.5647 -3.7272 -3.7272 -3.7230 -3.7230 -3.6201 -3.6201 -3.6153 -3.6153 -0.0704 -0.0704 -0.0407 -0.0407 -0.0384 -0.0384 -0.0082 -0.0082 1.3944 1.3944 1.4097 1.4097 1.4206 1.4206 1.4456 1.4456 2.0853 2.0853 2.1033 2.1033 2.1714 2.1714 2.1813 2.1813 2.9301 2.9301 2.9628 2.9628 3.0445 3.0445 3.0754 3.0754 3.3633 3.3633 3.3682 3.3682 3.4169 3.4169 3.4191 3.4191 3.9812 3.9812 3.9879 3.9879 4.0187 4.0187 4.0207 4.0207 7.7933 7.7933 7.8700 7.8700 7.9077 7.9077 8.0151 8.0151 8.4185 8.4185 8.4251 8.4251 8.4319 8.4319 k = 0.4750 0.2405-0.0000 ( 12576 PWs) bands (ev): -9.0287 -9.0287 -9.0287 -9.0287 -9.0059 -9.0059 -9.0058 -9.0058 -7.6955 -7.6955 -7.6949 -7.6949 -7.5224 -7.5224 -7.5219 -7.5219 -3.7770 -3.7770 -3.7730 -3.7730 -3.5631 -3.5631 -3.5581 -3.5581 -0.0806 -0.0806 -0.0490 -0.0490 -0.0211 -0.0211 0.0115 0.0115 1.3783 1.3783 1.3892 1.3892 1.4308 1.4308 1.4611 1.4611 2.0433 2.0433 2.0637 2.0637 2.2133 2.2133 2.2172 2.2172 2.9221 2.9221 2.9859 2.9859 3.0351 3.0351 3.0963 3.0963 3.3415 3.3415 3.3491 3.3491 3.4450 3.4450 3.4512 3.4512 3.9786 3.9786 3.9919 3.9919 4.0188 4.0188 4.0226 4.0226 7.7494 7.7494 7.8515 7.8515 7.9020 7.9020 8.0651 8.0651 8.4126 8.4126 8.4154 8.4154 8.4287 8.4287 k = 0.4625 0.2405-0.0000 ( 12580 PWs) bands (ev): -9.0381 -9.0381 -9.0381 -9.0381 -9.0037 -9.0037 -9.0036 -9.0036 -7.7389 -7.7389 -7.7383 -7.7383 -7.4804 -7.4804 -7.4799 -7.4799 -3.8241 -3.8241 -3.8204 -3.8204 -3.5042 -3.5042 -3.4990 -3.4990 -0.0877 -0.0877 -0.0566 -0.0566 0.0015 0.0015 0.0342 0.0342 1.3600 1.3600 1.3668 1.3668 1.4393 1.4393 1.4752 1.4752 2.0035 2.0035 2.0253 2.0253 2.2491 2.2491 2.2528 2.2528 2.9204 2.9204 3.0124 3.0124 3.0300 3.0300 3.1199 3.1199 3.3252 3.3252 3.3346 3.3346 3.4747 3.4747 3.4848 3.4848 3.9764 3.9764 3.9965 3.9965 4.0198 4.0198 4.0252 4.0252 7.7023 7.7023 7.7942 7.7942 7.9295 7.9295 8.1115 8.1115 8.3955 8.3955 8.4126 8.4126 8.4329 8.4329 k = 0.4500 0.2405-0.0000 ( 12574 PWs) bands (ev): -9.0489 -9.0489 -9.0489 -9.0489 -9.0028 -9.0028 -9.0027 -9.0027 -7.7821 -7.7821 -7.7815 -7.7815 -7.4393 -7.4393 -7.4389 -7.4389 -3.8682 -3.8682 -3.8648 -3.8648 -3.4436 -3.4436 -3.4381 -3.4381 -0.0919 -0.0919 -0.0613 -0.0613 0.0273 0.0273 0.0600 0.0600 1.3395 1.3395 1.3426 1.3426 1.4461 1.4461 1.4878 1.4878 1.9669 1.9669 1.9894 1.9894 2.2757 2.2757 2.2888 2.2888 2.9257 2.9257 3.0293 3.0293 3.0415 3.0415 3.1453 3.1453 3.3158 3.3158 3.3254 3.3254 3.5054 3.5054 3.5194 3.5194 3.9750 3.9750 4.0019 4.0019 4.0219 4.0219 4.0286 4.0286 7.6527 7.6527 7.7361 7.7361 7.9522 7.9522 8.1528 8.1528 8.3801 8.3801 8.4103 8.4103 8.4382 8.4382 k = 0.4375 0.2405-0.0000 ( 12570 PWs) bands (ev): -9.0612 -9.0612 -9.0612 -9.0612 -9.0032 -9.0032 -9.0031 -9.0031 -7.8247 -7.8247 -7.8241 -7.8241 -7.3994 -7.3994 -7.3989 -7.3989 -3.9093 -3.9093 -3.9061 -3.9061 -3.3815 -3.3815 -3.3758 -3.3758 -0.0930 -0.0930 -0.0631 -0.0631 0.0561 0.0561 0.0888 0.0888 1.3167 1.3167 1.3169 1.3169 1.4511 1.4511 1.4989 1.4989 1.9346 1.9346 1.9570 1.9570 2.2959 2.2959 2.3201 2.3201 2.9381 2.9381 3.0330 3.0330 3.0721 3.0721 3.1714 3.1714 3.3143 3.3143 3.3220 3.3220 3.5365 3.5365 3.5543 3.5543 3.9744 3.9744 4.0085 4.0085 4.0251 4.0251 4.0332 4.0332 7.6009 7.6009 7.6775 7.6775 7.9702 7.9702 8.1873 8.1873 8.3664 8.3664 8.4086 8.4086 8.4460 8.4460 k = 0.4250 0.2405-0.0000 ( 12570 PWs) bands (ev): -9.0749 -9.0749 -9.0748 -9.0748 -9.0048 -9.0048 -9.0048 -9.0048 -7.8668 -7.8668 -7.8661 -7.8661 -7.3608 -7.3608 -7.3604 -7.3604 -3.9471 -3.9471 -3.9443 -3.9443 -3.3182 -3.3182 -3.3123 -3.3123 -0.0912 -0.0912 -0.0621 -0.0621 0.0879 0.0879 0.1206 0.1206 1.2890 1.2890 1.2920 1.2920 1.4544 1.4544 1.5085 1.5085 1.9076 1.9076 1.9294 1.9294 2.3092 2.3092 2.3456 2.3456 2.9575 2.9575 3.0411 3.0411 3.1035 3.1035 3.1973 3.1973 3.3214 3.3214 3.3248 3.3248 3.5675 3.5675 3.5890 3.5890 3.9751 3.9751 4.0167 4.0167 4.0294 4.0294 4.0398 4.0398 7.5475 7.5475 7.6187 7.6187 7.9833 7.9833 8.2129 8.2129 8.3540 8.3540 8.4072 8.4072 8.4579 8.4579 k = 0.4125 0.2405-0.0000 ( 12558 PWs) bands (ev): -9.0900 -9.0900 -9.0899 -9.0899 -9.0076 -9.0076 -9.0076 -9.0076 -7.9080 -7.9080 -7.9073 -7.9073 -7.3238 -7.3238 -7.3234 -7.3234 -3.9817 -3.9817 -3.9791 -3.9791 -3.2538 -3.2538 -3.2479 -3.2479 -0.0865 -0.0865 -0.0582 -0.0582 0.1225 0.1225 0.1551 0.1551 1.2600 1.2600 1.2651 1.2651 1.4559 1.4559 1.5161 1.5161 1.8868 1.8868 1.9077 1.9077 2.3153 2.3153 2.3647 2.3647 2.9830 2.9830 3.0536 3.0536 3.1349 3.1349 3.2227 3.2227 3.3338 3.3338 3.3366 3.3366 3.5982 3.5982 3.6232 3.6232 3.9772 3.9772 4.0269 4.0269 4.0346 4.0346 4.0491 4.0491 7.4928 7.4928 7.5598 7.5598 7.9917 7.9917 8.2284 8.2284 8.3428 8.3428 8.4058 8.4058 8.4754 8.4754 k = 0.4000 0.2405-0.0000 ( 12566 PWs) bands (ev): -9.1063 -9.1063 -9.1062 -9.1062 -9.0115 -9.0115 -9.0114 -9.0114 -7.9484 -7.9484 -7.9476 -7.9476 -7.2886 -7.2886 -7.2882 -7.2882 -4.0129 -4.0129 -4.0106 -4.0106 -3.1888 -3.1888 -3.1827 -3.1827 -0.0788 -0.0788 -0.0516 -0.0516 0.1599 0.1599 0.1924 0.1924 1.2297 1.2297 1.2364 1.2364 1.4557 1.4557 1.5217 1.5217 1.8730 1.8730 1.8931 1.8931 2.3149 2.3149 2.3772 2.3772 3.0133 3.0133 3.0700 3.0700 3.1660 3.1660 3.2483 3.2483 3.3483 3.3483 3.3580 3.3580 3.6285 3.6285 3.6565 3.6565 3.9814 3.9814 4.0397 4.0397 4.0410 4.0410 4.0614 4.0614 7.4372 7.4372 7.5011 7.5011 7.9954 7.9954 8.2336 8.2336 8.3325 8.3325 8.4038 8.4038 8.4982 8.4982 k = 0.3875 0.2405-0.0000 ( 12562 PWs) bands (ev): -9.1240 -9.1240 -9.1238 -9.1238 -9.0164 -9.0164 -9.0163 -9.0163 -7.9877 -7.9877 -7.9869 -7.9869 -7.2554 -7.2554 -7.2550 -7.2550 -4.0407 -4.0407 -4.0386 -4.0386 -3.1233 -3.1233 -3.1172 -3.1172 -0.0683 -0.0683 -0.0421 -0.0421 0.1998 0.1998 0.2320 0.2320 1.1987 1.1987 1.2061 1.2061 1.4540 1.4540 1.5251 1.5251 1.8663 1.8663 1.8863 1.8863 2.3086 2.3086 2.3835 2.3835 3.0468 3.0468 3.0896 3.0896 3.1966 3.1966 3.2754 3.2754 3.3675 3.3675 3.3827 3.3827 3.6582 3.6582 3.6888 3.6888 3.9880 3.9880 4.0489 4.0489 4.0554 4.0554 4.0771 4.0771 7.3813 7.3813 7.4428 7.4428 7.9943 7.9943 8.2301 8.2301 8.3231 8.3231 8.4009 8.4009 8.5250 8.5250 k = 0.3750 0.2405-0.0000 ( 12540 PWs) bands (ev): -9.1427 -9.1427 -9.1425 -9.1425 -9.0221 -9.0221 -9.0221 -9.0221 -8.0260 -8.0260 -8.0251 -8.0251 -7.2243 -7.2243 -7.2239 -7.2239 -4.0651 -4.0651 -4.0632 -4.0632 -3.0577 -3.0577 -3.0516 -3.0516 -0.0548 -0.0548 -0.0298 -0.0298 0.2420 0.2420 0.2738 0.2738 1.1673 1.1673 1.1749 1.1749 1.4514 1.4514 1.5264 1.5264 1.8668 1.8668 1.8878 1.8878 2.2977 2.2977 2.3844 2.3844 3.0815 3.0815 3.1112 3.1112 3.2273 3.2273 3.3050 3.3050 3.3898 3.3898 3.4083 3.4083 3.6877 3.6877 3.7200 3.7200 3.9978 3.9978 4.0589 4.0589 4.0743 4.0743 4.0960 4.0960 7.3252 7.3252 7.3851 7.3851 7.9885 7.9885 8.2195 8.2195 8.3144 8.3144 8.3969 8.3969 8.5538 8.5538 k = 0.3625 0.2405-0.0000 ( 12558 PWs) bands (ev): -9.1625 -9.1625 -9.1623 -9.1623 -9.0288 -9.0288 -9.0288 -9.0288 -8.0631 -8.0631 -8.0621 -8.0621 -7.1954 -7.1954 -7.1950 -7.1950 -4.0860 -4.0860 -4.0843 -4.0843 -2.9922 -2.9922 -2.9861 -2.9861 -0.0384 -0.0384 -0.0147 -0.0147 0.2859 0.2859 0.3173 0.3173 1.1362 1.1362 1.1431 1.1431 1.4486 1.4486 1.5263 1.5263 1.8739 1.8739 1.8975 1.8975 2.2831 2.2831 2.3812 2.3812 3.1152 3.1152 3.1334 3.1334 3.2582 3.2582 3.3375 3.3375 3.4142 3.4142 3.4325 3.4325 3.7169 3.7169 3.7499 3.7499 4.0114 4.0114 4.0714 4.0714 4.0965 4.0965 4.1183 4.1183 7.2694 7.2694 7.3282 7.3282 7.9779 7.9779 8.2032 8.2032 8.3061 8.3061 8.3918 8.3918 8.5826 8.5826 k = 0.3500 0.2405-0.0000 ( 12556 PWs) bands (ev): -9.1833 -9.1833 -9.1830 -9.1830 -9.0362 -9.0362 -9.0362 -9.0362 -8.0989 -8.0989 -8.0979 -8.0979 -7.1688 -7.1688 -7.1684 -7.1684 -4.1035 -4.1035 -4.1020 -4.1020 -2.9271 -2.9271 -2.9211 -2.9211 -0.0189 -0.0189 0.0033 0.0033 0.3312 0.3312 0.3618 0.3618 1.1061 1.1061 1.1117 1.1117 1.4463 1.4463 1.5255 1.5255 1.8869 1.8869 1.9149 1.9149 2.2660 2.2660 2.3755 2.3755 3.1461 3.1461 3.1550 3.1550 3.2896 3.2896 3.3728 3.3728 3.4399 3.4399 3.4539 3.4539 3.7460 3.7460 3.7784 3.7784 4.0296 4.0296 4.0869 4.0869 4.1220 4.1220 4.1435 4.1435 7.2142 7.2142 7.2723 7.2723 7.9628 7.9628 8.1821 8.1821 8.2982 8.2982 8.3853 8.3853 8.6103 8.6103 k = 0.3375 0.2405-0.0000 ( 12560 PWs) bands (ev): -9.2048 -9.2048 -9.2046 -9.2046 -9.0443 -9.0443 -9.0443 -9.0443 -8.1335 -8.1335 -8.1324 -8.1324 -7.1446 -7.1446 -7.1443 -7.1443 -4.1178 -4.1178 -4.1165 -4.1165 -2.8628 -2.8628 -2.8569 -2.8569 0.0035 0.0035 0.0242 0.0242 0.3770 0.3770 0.4066 0.4066 1.0779 1.0779 1.0815 1.0815 1.4453 1.4453 1.5252 1.5252 1.9048 1.9048 1.9390 1.9390 2.2475 2.2475 2.3687 2.3687 3.1729 3.1729 3.1747 3.1747 3.3206 3.3206 3.4104 3.4104 3.4668 3.4668 3.4719 3.4719 3.7748 3.7748 3.8053 3.8053 4.0529 4.0529 4.1058 4.1058 4.1505 4.1505 4.1715 4.1715 7.1601 7.1601 7.2176 7.2176 7.9432 7.9432 8.1570 8.1570 8.2905 8.2905 8.3775 8.3775 8.6357 8.6357 k = 0.3250 0.2405-0.0000 ( 12560 PWs) bands (ev): -9.2271 -9.2271 -9.2268 -9.2268 -9.0529 -9.0529 -9.0529 -9.0529 -8.1668 -8.1668 -8.1657 -8.1657 -7.1229 -7.1229 -7.1225 -7.1225 -4.1288 -4.1288 -4.1277 -4.1277 -2.7995 -2.7995 -2.7937 -2.7937 0.0291 0.0291 0.0482 0.0482 0.4223 0.4223 0.4504 0.4504 1.0531 1.0531 1.0537 1.0537 1.4463 1.4463 1.5261 1.5261 1.9264 1.9264 1.9687 1.9687 2.2289 2.2289 2.3628 2.3628 3.1917 3.1917 3.1948 3.1948 3.3496 3.3496 3.4490 3.4490 3.4868 3.4868 3.4957 3.4957 3.8030 3.8030 3.8302 3.8302 4.0814 4.0814 4.1283 4.1283 4.1816 4.1816 4.2018 4.2018 7.1073 7.1073 7.1644 7.1644 7.9192 7.9192 8.1283 8.1283 8.2827 8.2827 8.3682 8.3682 8.6580 8.6580 k = 0.3125 0.2405-0.0000 ( 12564 PWs) bands (ev): -9.2499 -9.2499 -9.2496 -9.2496 -9.0621 -9.0621 -9.0621 -9.0621 -8.1988 -8.1988 -8.1976 -8.1976 -7.1036 -7.1036 -7.1033 -7.1033 -4.1369 -4.1369 -4.1359 -4.1359 -2.7375 -2.7375 -2.7319 -2.7319 0.0578 0.0578 0.0751 0.0751 0.4655 0.4655 0.4915 0.4915 1.0299 1.0299 1.0332 1.0332 1.4499 1.4499 1.5293 1.5293 1.9502 1.9502 2.0026 2.0026 2.2116 2.2116 2.3594 2.3594 3.2055 3.2055 3.2119 3.2119 3.3744 3.3744 3.4812 3.4812 3.5050 3.5050 3.5276 3.5276 3.8301 3.8301 3.8529 3.8529 4.1147 4.1147 4.1544 4.1544 4.2150 4.2150 4.2339 4.2339 7.0562 7.0562 7.1130 7.1130 7.8911 7.8911 8.0965 8.0965 8.2746 8.2746 8.3573 8.3573 8.6765 8.6765 k = 0.3000 0.2405-0.0000 ( 12540 PWs) bands (ev): -9.2731 -9.2731 -9.2728 -9.2728 -9.0717 -9.0717 -9.0717 -9.0717 -8.2295 -8.2295 -8.2282 -8.2282 -7.0867 -7.0867 -7.0864 -7.0864 -4.1421 -4.1421 -4.1412 -4.1412 -2.6771 -2.6771 -2.6718 -2.6718 0.0897 0.0897 0.1052 0.1052 0.5047 0.5047 0.5278 0.5278 1.0123 1.0123 1.0204 1.0204 1.4564 1.4564 1.5352 1.5352 1.9748 1.9748 2.0385 2.0385 2.1979 2.1979 2.3605 2.3605 3.2158 3.2158 3.2246 3.2246 3.3938 3.3938 3.4930 3.4930 3.5401 3.5401 3.5628 3.5628 3.8556 3.8556 3.8735 3.8735 4.1521 4.1521 4.1836 4.1836 4.2501 4.2501 4.2676 4.2676 7.0074 7.0074 7.0636 7.0636 7.8592 7.8592 8.0618 8.0618 8.2661 8.2661 8.3446 8.3446 8.6908 8.6908 k = 0.2875 0.2405-0.0000 ( 12546 PWs) bands (ev): -9.2966 -9.2966 -9.2962 -9.2962 -9.0817 -9.0817 -9.0816 -9.0816 -8.2588 -8.2588 -8.2575 -8.2575 -7.0721 -7.0721 -7.0719 -7.0719 -4.1447 -4.1447 -4.1439 -4.1439 -2.6186 -2.6186 -2.6135 -2.6135 0.1248 0.1248 0.1383 0.1383 0.5372 0.5372 0.5568 0.5568 1.0034 1.0034 1.0173 1.0173 1.4663 1.4663 1.5443 1.5443 1.9986 1.9986 2.0714 2.0714 2.1926 2.1926 2.3680 2.3680 3.2230 3.2230 3.2335 3.2335 3.4074 3.4074 3.4956 3.4956 3.5803 3.5803 3.6006 3.6006 3.8790 3.8790 3.8920 3.8920 4.1924 4.1924 4.2154 4.2154 4.2865 4.2865 4.3021 4.3021 6.9613 6.9613 7.0167 7.0167 7.8238 7.8238 8.0245 8.0245 8.2569 8.2569 8.3300 8.3300 8.7002 8.7002 k = 0.2750 0.2405-0.0000 ( 12546 PWs) bands (ev): -9.3202 -9.3202 -9.3198 -9.3198 -9.0919 -9.0919 -9.0918 -9.0918 -8.2868 -8.2868 -8.2855 -8.2855 -7.0598 -7.0598 -7.0596 -7.0596 -4.1450 -4.1450 -4.1443 -4.1443 -2.5622 -2.5622 -2.5574 -2.5574 0.1633 0.1633 0.1745 0.1745 0.5604 0.5604 0.5764 0.5764 1.0055 1.0055 1.0256 1.0256 1.4797 1.4797 1.5570 1.5570 2.0204 2.0204 2.0926 2.0926 2.2049 2.2049 2.3834 2.3834 3.2272 3.2272 3.2393 3.2393 3.4158 3.4158 3.4940 3.4940 3.6199 3.6199 3.6398 3.6398 3.8999 3.8999 3.9086 3.9086 4.2341 4.2341 4.2488 4.2488 4.3237 4.3237 4.3372 4.3372 6.9183 6.9183 6.9725 6.9725 7.7852 7.7852 7.9848 7.9848 8.2469 8.2469 8.3134 8.3134 8.7046 8.7046 k = 0.2625 0.2405-0.0000 ( 12564 PWs) bands (ev): -9.3438 -9.3438 -9.3434 -9.3434 -9.1022 -9.1022 -9.1022 -9.1022 -8.3135 -8.3135 -8.3121 -8.3121 -7.0496 -7.0496 -7.0494 -7.0494 -4.1431 -4.1431 -4.1425 -4.1425 -2.5081 -2.5081 -2.5037 -2.5037 0.2049 0.2049 0.2135 0.2135 0.5727 0.5727 0.5858 0.5858 1.0201 1.0201 1.0461 1.0461 1.4970 1.4970 1.5733 1.5733 2.0395 2.0395 2.0986 2.0986 2.2383 2.2383 2.4076 2.4076 3.2290 3.2290 3.2428 3.2428 3.4197 3.4197 3.4893 3.4893 3.6570 3.6570 3.6788 3.6788 3.9180 3.9180 3.9236 3.9236 4.2760 4.2760 4.2830 4.2830 4.3613 4.3613 4.3722 4.3722 6.8791 6.8791 6.9317 6.9317 7.7440 7.7440 7.9430 7.9430 8.2359 8.2359 8.2947 8.2947 8.7037 8.7037 k = 0.2500 0.2405-0.0000 ( 12568 PWs) bands (ev): -9.3672 -9.3672 -9.3668 -9.3668 -9.1127 -9.1127 -9.1126 -9.1126 -8.3388 -8.3388 -8.3375 -8.3375 -7.0414 -7.0414 -7.0412 -7.0412 -4.1394 -4.1394 -4.1388 -4.1388 -2.4567 -2.4567 -2.4525 -2.4525 0.2496 0.2496 0.2551 0.2551 0.5746 0.5746 0.5865 0.5865 1.0462 1.0462 1.0770 1.0770 1.5182 1.5182 1.5935 1.5935 2.0564 2.0564 2.0975 2.0975 2.2846 2.2846 2.4403 2.4403 3.2288 3.2288 3.2449 3.2449 3.4200 3.4200 3.4822 3.4822 3.6902 3.6902 3.7162 3.7162 3.9333 3.9333 3.9376 3.9376 4.3164 4.3164 4.3168 4.3168 4.3986 4.3986 4.4066 4.4066 6.8441 6.8441 6.8945 6.8945 7.7005 7.7005 7.8992 7.8992 8.2237 8.2237 8.2741 8.2741 8.6978 8.6978 k = 0.2375 0.2405-0.0000 ( 12574 PWs) bands (ev): -9.3903 -9.3903 -9.3899 -9.3899 -9.1231 -9.1231 -9.1231 -9.1231 -8.3629 -8.3629 -8.3616 -8.3616 -7.0350 -7.0350 -7.0349 -7.0349 -4.1341 -4.1341 -4.1336 -4.1336 -2.4079 -2.4079 -2.4041 -2.4041 0.2970 0.2970 0.2984 0.2984 0.5682 0.5682 0.5814 0.5814 1.0813 1.0813 1.1157 1.1157 1.5437 1.5437 1.6177 1.6177 2.0722 2.0722 2.0965 2.0965 2.3370 2.3370 2.4806 2.4806 3.2273 3.2273 3.2462 3.2462 3.4173 3.4173 3.4732 3.4732 3.7176 3.7176 3.7503 3.7503 3.9462 3.9462 3.9517 3.9517 4.3489 4.3489 4.3543 4.3543 4.4353 4.4353 4.4399 4.4399 6.8140 6.8140 6.8617 6.8617 7.6552 7.6552 7.8536 7.8536 8.2102 8.2102 8.2515 8.2515 8.6868 8.6868 k = 0.2250 0.2405-0.0000 ( 12562 PWs) bands (ev): -9.4130 -9.4130 -9.4126 -9.4126 -9.1335 -9.1335 -9.1334 -9.1334 -8.3857 -8.3857 -8.3844 -8.3844 -7.0303 -7.0303 -7.0302 -7.0302 -4.1275 -4.1275 -4.1270 -4.1270 -2.3620 -2.3620 -2.3586 -2.3586 0.3416 0.3416 0.3464 0.3464 0.5571 0.5571 0.5745 0.5745 1.1218 1.1218 1.1586 1.1586 1.5737 1.5737 1.6460 1.6460 2.0886 2.0886 2.0988 2.0988 2.3921 2.3921 2.5267 2.5267 3.2251 3.2251 3.2477 3.2477 3.4121 3.4121 3.4625 3.4625 3.7372 3.7372 3.7790 3.7790 3.9576 3.9576 3.9670 3.9670 4.3783 4.3783 4.3884 4.3884 4.4707 4.4707 4.4717 4.4717 6.7892 6.7892 6.8337 6.8337 7.6088 7.6088 7.8063 7.8063 8.1953 8.1953 8.2272 8.2272 8.6710 8.6710 k = 0.2125 0.2405-0.0000 ( 12566 PWs) bands (ev): -9.4352 -9.4352 -9.4348 -9.4348 -9.1438 -9.1438 -9.1437 -9.1437 -8.4073 -8.4073 -8.4059 -8.4059 -7.0270 -7.0270 -7.0270 -7.0270 -4.1198 -4.1198 -4.1194 -4.1194 -2.3191 -2.3191 -2.3160 -2.3160 0.3811 0.3811 0.3954 0.3954 0.5456 0.5456 0.5717 0.5717 1.1642 1.1642 1.2025 1.2025 1.6087 1.6087 1.6787 1.6787 2.1061 2.1061 2.1070 2.1070 2.4481 2.4481 2.5767 2.5767 3.2228 3.2228 3.2501 3.2501 3.4051 3.4051 3.4507 3.4507 3.7474 3.7474 3.8001 3.8001 3.9692 3.9692 3.9847 3.9847 4.4038 4.4038 4.4178 4.4178 4.5018 4.5018 4.5041 4.5041 6.7703 6.7703 6.8111 6.8111 7.5617 7.5617 7.7576 7.7576 8.1788 8.1788 8.2016 8.2016 8.6500 8.6500 k = 0.2000 0.2405-0.0000 ( 12588 PWs) bands (ev): -9.4566 -9.4566 -9.4563 -9.4563 -9.1538 -9.1538 -9.1537 -9.1537 -8.4275 -8.4275 -8.4262 -8.4262 -7.0251 -7.0251 -7.0251 -7.0251 -4.1114 -4.1114 -4.1110 -4.1110 -2.2792 -2.2792 -2.2764 -2.2764 0.4096 0.4096 0.4358 0.4358 0.5437 0.5437 0.5813 0.5813 1.2055 1.2055 1.2448 1.2448 1.6494 1.6494 1.7164 1.7164 2.1192 2.1192 2.1288 2.1288 2.5035 2.5035 2.6288 2.6288 3.2213 3.2213 3.2541 3.2541 3.3965 3.3965 3.4381 3.4381 3.7477 3.7477 3.8110 3.8110 3.9825 3.9825 4.0049 4.0049 4.4243 4.4243 4.4415 4.4415 4.5297 4.5297 4.5350 4.5350 6.7576 6.7576 6.7944 6.7944 7.5146 7.5146 7.7075 7.7075 8.1608 8.1608 8.1750 8.1750 8.6226 8.6226 k = 0.1875 0.2405-0.0000 ( 12586 PWs) bands (ev): -9.4774 -9.4774 -9.4770 -9.4770 -9.1636 -9.1636 -9.1635 -9.1635 -8.4466 -8.4466 -8.4453 -8.4453 -7.0243 -7.0243 -7.0243 -7.0243 -4.1025 -4.1025 -4.1020 -4.1020 -2.2424 -2.2424 -2.2399 -2.2399 0.4208 0.4208 0.4504 0.4504 0.5695 0.5695 0.6107 0.6107 1.2434 1.2434 1.2832 1.2832 1.6961 1.6961 1.7595 1.7595 2.1385 2.1385 2.1548 2.1548 2.5571 2.5571 2.6808 2.6808 3.2213 3.2213 3.2603 3.2603 3.3872 3.3872 3.4251 3.4251 3.7384 3.7384 3.8107 3.8107 3.9985 3.9985 4.0271 4.0271 4.4391 4.4391 4.4589 4.4589 4.5555 4.5555 4.5629 4.5629 6.7513 6.7513 6.7841 6.7841 7.4679 7.4679 7.6564 7.6564 8.1410 8.1410 8.1476 8.1476 8.5869 8.5869 k = 0.1750 0.2405-0.0000 ( 12572 PWs) bands (ev): -9.4972 -9.4972 -9.4968 -9.4968 -9.1730 -9.1730 -9.1729 -9.1729 -8.4643 -8.4643 -8.4631 -8.4631 -7.0244 -7.0244 -7.0244 -7.0244 -4.0932 -4.0932 -4.0928 -4.0928 -2.2086 -2.2086 -2.2064 -2.2064 0.4171 0.4171 0.4421 0.4421 0.6208 0.6208 0.6578 0.6578 1.2764 1.2764 1.3160 1.3160 1.7493 1.7493 1.8085 1.8085 2.1637 2.1637 2.1854 2.1854 2.6079 2.6079 2.7307 2.7307 3.2236 3.2236 3.2690 3.2690 3.3778 3.3778 3.4125 3.4125 3.7207 3.7207 3.7996 3.7996 4.0162 4.0162 4.0501 4.0501 4.4476 4.4476 4.4693 4.4693 4.5790 4.5790 4.5877 4.5877 6.7515 6.7515 6.7803 6.7803 7.4222 7.4222 7.6048 7.6048 8.1195 8.1195 8.1198 8.1198 8.5409 8.5409 k = 0.1625 0.2405-0.0000 ( 12560 PWs) bands (ev): -9.5160 -9.5160 -9.5157 -9.5157 -9.1821 -9.1821 -9.1820 -9.1820 -8.4809 -8.4809 -8.4797 -8.4797 -7.0254 -7.0254 -7.0253 -7.0253 -4.0838 -4.0838 -4.0834 -4.0834 -2.1779 -2.1779 -2.1759 -2.1759 0.4056 0.4056 0.4257 0.4257 0.6829 0.6829 0.7157 0.7157 1.3037 1.3037 1.3426 1.3426 1.8086 1.8086 1.8635 1.8635 2.1938 2.1938 2.2204 2.2204 2.6551 2.6551 2.7762 2.7762 3.2288 3.2288 3.2791 3.2791 3.3701 3.3701 3.4009 3.4009 3.6959 3.6959 3.7794 3.7794 4.0340 4.0340 4.0727 4.0727 4.4497 4.4497 4.4722 4.4722 4.6001 4.6001 4.6094 4.6094 6.7578 6.7578 6.7832 6.7832 7.3782 7.3782 7.5531 7.5531 8.0916 8.0916 8.0962 8.0962 8.4843 8.4843 k = 0.1500 0.2405-0.0000 ( 12572 PWs) bands (ev): -9.5338 -9.5338 -9.5335 -9.5335 -9.1907 -9.1907 -9.1906 -9.1906 -8.4962 -8.4962 -8.4951 -8.4951 -7.0269 -7.0269 -7.0268 -7.0268 -4.0745 -4.0745 -4.0742 -4.0742 -2.1500 -2.1500 -2.1483 -2.1483 0.3908 0.3908 0.4072 0.4072 0.7500 0.7500 0.7798 0.7798 1.3255 1.3255 1.3631 1.3631 1.8735 1.8735 1.9240 1.9240 2.2276 2.2276 2.2593 2.2593 2.6983 2.6983 2.8152 2.8152 3.2366 3.2366 3.2878 3.2878 3.3674 3.3674 3.3919 3.3919 3.6656 3.6656 3.7520 3.7520 4.0502 4.0502 4.0937 4.0937 4.4457 4.4457 4.4674 4.4674 4.6190 4.6190 4.6283 4.6283 6.7696 6.7696 6.7923 6.7923 7.3366 7.3366 7.5021 7.5021 8.0628 8.0628 8.0711 8.0711 8.4190 8.4190 k = 0.1375 0.2405-0.0000 ( 12580 PWs) bands (ev): -9.5504 -9.5504 -9.5501 -9.5501 -9.1988 -9.1988 -9.1987 -9.1987 -8.5103 -8.5103 -8.5092 -8.5092 -7.0289 -7.0289 -7.0288 -7.0288 -4.0655 -4.0655 -4.0652 -4.0652 -2.1251 -2.1251 -2.1236 -2.1236 0.3749 0.3749 0.3886 0.3886 0.8198 0.8198 0.8477 0.8477 1.3423 1.3423 1.3782 1.3782 1.9429 1.9429 1.9893 1.9893 2.2629 2.2629 2.3011 2.3011 2.7378 2.7378 2.8462 2.8462 3.2450 3.2450 3.2898 3.2898 3.3739 3.3739 3.3879 3.3879 3.6319 3.6319 3.7194 3.7194 4.0632 4.0632 4.1121 4.1121 4.4364 4.4364 4.4552 4.4552 4.6355 4.6355 4.6444 4.6444 6.7859 6.7859 6.8069 6.8069 7.2984 7.2984 7.4528 7.4528 8.0333 8.0333 8.0444 8.0444 8.3483 8.3483 k = 0.1250 0.2405-0.0000 ( 12572 PWs) bands (ev): -9.5658 -9.5658 -9.5656 -9.5656 -9.2063 -9.2063 -9.2062 -9.2062 -8.5232 -8.5232 -8.5222 -8.5222 -7.0312 -7.0312 -7.0311 -7.0311 -4.0569 -4.0569 -4.0565 -4.0565 -2.1028 -2.1028 -2.1015 -2.1015 0.3591 0.3591 0.3706 0.3706 0.8910 0.8910 0.9175 0.9175 1.3552 1.3552 1.3892 1.3892 2.0154 2.0154 2.0582 2.0582 2.2976 2.2976 2.3446 2.3446 2.7748 2.7748 2.8690 2.8690 3.2500 3.2500 3.2838 3.2838 3.3893 3.3893 3.3911 3.3911 3.5974 3.5974 3.6841 3.6841 4.0717 4.0717 4.1266 4.1266 4.4230 4.4230 4.4369 4.4369 4.6500 4.6500 4.6582 4.6582 6.8051 6.8051 6.8256 6.8256 7.2645 7.2645 7.4065 7.4065 8.0024 8.0024 8.0161 8.0161 8.2755 8.2755 k = 0.1125 0.2405-0.0000 ( 12592 PWs) bands (ev): -9.5800 -9.5800 -9.5797 -9.5797 -9.2133 -9.2133 -9.2132 -9.2132 -8.5348 -8.5348 -8.5339 -8.5339 -7.0336 -7.0336 -7.0335 -7.0335 -4.0487 -4.0487 -4.0484 -4.0484 -2.0832 -2.0832 -2.0821 -2.0821 0.3440 0.3440 0.3538 0.3538 0.9626 0.9626 0.9878 0.9878 1.3652 1.3652 1.3972 1.3972 2.0894 2.0894 2.1297 2.1297 2.3293 2.3293 2.3885 2.3885 2.8108 2.8108 2.8845 2.8845 3.2481 3.2481 3.2725 3.2725 3.4004 3.4004 3.4067 3.4067 3.5671 3.5671 3.6502 3.6502 4.0746 4.0746 4.1357 4.1357 4.4074 4.4074 4.4145 4.4145 4.6624 4.6624 4.6699 4.6699 6.8255 6.8255 6.8468 6.8468 7.2366 7.2366 7.3649 7.3649 7.9695 7.9695 7.9863 7.9863 8.2040 8.2040 k = 0.1000 0.2405-0.0000 ( 12604 PWs) bands (ev): -9.5928 -9.5928 -9.5925 -9.5925 -9.2196 -9.2196 -9.2195 -9.2195 -8.5452 -8.5452 -8.5444 -8.5444 -7.0361 -7.0361 -7.0360 -7.0360 -4.0412 -4.0412 -4.0409 -4.0409 -2.0660 -2.0660 -2.0651 -2.0651 0.3300 0.3300 0.3382 0.3382 1.0333 1.0333 1.0569 1.0569 1.3734 1.3734 1.4037 1.4037 2.1630 2.1630 2.2024 2.2024 2.3561 2.3561 2.4315 2.4315 2.8472 2.8472 2.8944 2.8944 3.2389 3.2389 3.2585 3.2585 3.4070 3.4070 3.4166 3.4166 3.5498 3.5498 3.6245 3.6245 4.0707 4.0707 4.1373 4.1373 4.3908 4.3908 4.3914 4.3914 4.6729 4.6729 4.6797 4.6797 6.8445 6.8445 6.8678 6.8678 7.2164 7.2164 7.3301 7.3301 7.9335 7.9335 7.9554 7.9554 8.1370 8.1370 k = 0.0875 0.2405-0.0000 ( 12596 PWs) bands (ev): -9.6042 -9.6042 -9.6040 -9.6040 -9.2253 -9.2253 -9.2252 -9.2252 -8.5544 -8.5544 -8.5537 -8.5537 -7.0386 -7.0386 -7.0385 -7.0385 -4.0344 -4.0344 -4.0341 -4.0341 -2.0512 -2.0512 -2.0504 -2.0504 0.3173 0.3173 0.3242 0.3242 1.1013 1.1013 1.1228 1.1228 1.3812 1.3812 1.4102 1.4102 2.2333 2.2333 2.2740 2.2740 2.3777 2.3777 2.4731 2.4731 2.8848 2.8848 2.9008 2.9008 3.2240 3.2240 3.2433 3.2433 3.3997 3.3997 3.4095 3.4095 3.5545 3.5545 3.6148 3.6148 4.0596 4.0596 4.1290 4.1290 4.3696 4.3696 4.3771 4.3771 4.6817 4.6817 4.6876 4.6876 6.8596 6.8596 6.8858 6.8858 7.2060 7.2060 7.3046 7.3046 7.8939 7.8939 7.9233 7.9233 8.0773 8.0773 k = 0.0750 0.2405-0.0000 ( 12594 PWs) bands (ev): -9.6141 -9.6141 -9.6139 -9.6139 -9.2303 -9.2303 -9.2302 -9.2302 -8.5623 -8.5623 -8.5617 -8.5617 -7.0409 -7.0409 -7.0409 -7.0409 -4.0284 -4.0284 -4.0281 -4.0281 -2.0387 -2.0387 -2.0380 -2.0380 0.3061 0.3061 0.3118 0.3118 1.1643 1.1643 1.1828 1.1828 1.3902 1.3902 1.4185 1.4185 2.2958 2.2958 2.3373 2.3373 2.3999 2.3999 2.5143 2.5143 2.9051 2.9051 2.9226 2.9226 3.2051 3.2051 3.2283 3.2283 3.3810 3.3810 3.3838 3.3838 3.5768 3.5768 3.6219 3.6219 4.0421 4.0421 4.1097 4.1097 4.3540 4.3540 4.3656 4.3656 4.6890 4.6890 4.6941 4.6941 6.8691 6.8691 6.8979 6.8979 7.2063 7.2063 7.2904 7.2904 7.8510 7.8510 7.8901 7.8901 8.0264 8.0264 k = 0.0625 0.2405-0.0000 ( 12596 PWs) bands (ev): -9.6226 -9.6226 -9.6225 -9.6225 -9.2345 -9.2345 -9.2345 -9.2345 -8.5691 -8.5691 -8.5685 -8.5685 -7.0431 -7.0431 -7.0430 -7.0430 -4.0232 -4.0232 -4.0230 -4.0230 -2.0283 -2.0283 -2.0278 -2.0278 0.2965 0.2965 0.3012 0.3012 1.2189 1.2189 1.2334 1.2334 1.4026 1.4026 1.4307 1.4307 2.3446 2.3446 2.3694 2.3694 2.4459 2.4459 2.5588 2.5588 2.9069 2.9069 2.9567 2.9567 3.1851 3.1851 3.2153 3.2153 3.3474 3.3474 3.3601 3.3601 3.6057 3.6057 3.6378 3.6378 4.0198 4.0198 4.0806 4.0806 4.3447 4.3447 4.3572 4.3572 4.6948 4.6948 4.6991 4.6991 6.8727 6.8727 6.9024 6.9024 7.2170 7.2170 7.2881 7.2881 7.8069 7.8069 7.8556 7.8556 7.9837 7.9837 k = 0.0500 0.2405-0.0000 ( 12588 PWs) bands (ev): -9.6296 -9.6296 -9.6295 -9.6295 -9.2380 -9.2380 -9.2380 -9.2380 -8.5746 -8.5746 -8.5741 -8.5741 -7.0449 -7.0449 -7.0448 -7.0448 -4.0189 -4.0189 -4.0187 -4.0187 -2.0199 -2.0199 -2.0195 -2.0195 0.2887 0.2887 0.2923 0.2923 1.2614 1.2614 1.2712 1.2712 1.4209 1.4209 1.4481 1.4481 2.3747 2.3747 2.3756 2.3756 2.5111 2.5111 2.6105 2.6105 2.9034 2.9034 2.9800 2.9800 3.1679 3.1679 3.2087 3.2087 3.3082 3.3082 3.3416 3.3416 3.6342 3.6342 3.6553 3.6553 3.9958 3.9958 4.0457 4.0457 4.3405 4.3405 4.3516 4.3516 4.6994 4.6994 4.7029 4.7029 6.8721 6.8721 6.9000 6.9000 7.2357 7.2357 7.2955 7.2955 7.7651 7.7651 7.8197 7.8197 7.9424 7.9424 k = 0.0375 0.2405-0.0000 ( 12612 PWs) bands (ev): -9.6351 -9.6351 -9.6350 -9.6350 -9.2408 -9.2408 -9.2408 -9.2408 -8.5788 -8.5788 -8.5785 -8.5785 -7.0463 -7.0463 -7.0463 -7.0463 -4.0155 -4.0155 -4.0154 -4.0154 -2.0135 -2.0135 -2.0132 -2.0132 0.2826 0.2826 0.2853 0.2853 1.2897 1.2897 1.2957 1.2957 1.4451 1.4451 1.4691 1.4691 2.3747 2.3747 2.3871 2.3871 2.5785 2.5785 2.6691 2.6691 2.8905 2.8905 2.9829 2.9829 3.1586 3.1586 3.2136 3.2136 3.2716 3.2716 3.3261 3.3261 3.6583 3.6583 3.6702 3.6702 3.9736 3.9736 4.0103 4.0103 4.3395 4.3395 4.3480 4.3480 4.7030 4.7030 4.7055 4.7055 6.8697 6.8697 6.8930 6.8930 7.2589 7.2589 7.3078 7.3078 7.7300 7.7300 7.7833 7.7833 7.9119 7.9119 k = 0.0250 0.2405-0.0000 ( 12628 PWs) bands (ev): -9.6390 -9.6390 -9.6389 -9.6389 -9.2428 -9.2428 -9.2427 -9.2427 -8.5819 -8.5819 -8.5817 -8.5817 -7.0474 -7.0474 -7.0474 -7.0474 -4.0130 -4.0130 -4.0129 -4.0129 -2.0089 -2.0089 -2.0087 -2.0087 0.2783 0.2783 0.2801 0.2801 1.3060 1.3060 1.3094 1.3094 1.4707 1.4707 1.4887 1.4887 2.3729 2.3729 2.3876 2.3876 2.6436 2.6436 2.7292 2.7292 2.8668 2.8668 2.9620 2.9620 3.1600 3.1600 3.2282 3.2282 3.2424 3.2424 3.3119 3.3119 3.6758 3.6758 3.6808 3.6808 3.9563 3.9563 3.9796 3.9796 4.3400 4.3400 4.3457 4.3457 4.7055 4.7055 4.7072 4.7072 6.8677 6.8677 6.8843 6.8843 7.2829 7.2829 7.3191 7.3191 7.7055 7.7055 7.7488 7.7488 7.8920 7.8920 k = 0.0125 0.2405-0.0000 ( 12632 PWs) bands (ev): -9.6413 -9.6413 -9.6413 -9.6413 -9.2439 -9.2439 -9.2439 -9.2439 -8.5837 -8.5837 -8.5836 -8.5836 -7.0481 -7.0481 -7.0480 -7.0480 -4.0115 -4.0115 -4.0115 -4.0115 -2.0062 -2.0062 -2.0061 -2.0061 0.2760 0.2760 0.2768 0.2768 1.3142 1.3142 1.3157 1.3157 1.4913 1.4913 1.5009 1.5009 2.3731 2.3731 2.3823 2.3823 2.7040 2.7040 2.7742 2.7742 2.8457 2.8457 2.9228 2.9228 3.1710 3.1710 3.2107 3.2107 3.2562 3.2562 3.2967 3.2967 3.6858 3.6858 3.6870 3.6870 3.9467 3.9467 3.9577 3.9577 4.3412 4.3412 4.3440 4.3440 4.7072 4.7072 4.7080 4.7080 6.8677 6.8677 6.8763 6.8763 7.3041 7.3041 7.3239 7.3239 7.6953 7.6953 7.7198 7.7198 7.8821 7.8821 k = 0.0000 0.2405-0.0000 ( 12630 PWs) bands (ev): -9.6421 -9.6421 -9.6421 -9.6421 -9.2443 -9.2443 -9.2443 -9.2443 -8.5842 -8.5842 -8.5842 -8.5842 -7.0483 -7.0483 -7.0483 -7.0483 -4.0110 -4.0110 -4.0110 -4.0110 -2.0052 -2.0052 -2.0052 -2.0052 0.2754 0.2754 0.2754 0.2754 1.3171 1.3171 1.3171 1.3171 1.5021 1.5021 1.5021 1.5021 2.3765 2.3765 2.3765 2.3765 2.7556 2.7556 2.7556 2.7556 2.8749 2.8749 2.8749 2.8749 3.1885 3.1885 3.1885 3.1885 3.2782 3.2782 3.2782 3.2782 3.6890 3.6890 3.6890 3.6890 3.9467 3.9467 3.9467 3.9467 4.3426 4.3426 4.3426 4.3426 4.7080 4.7080 4.7080 4.7080 6.8705 6.8705 6.8705 6.8705 7.3187 7.3187 7.3187 7.3187 7.7007 7.7007 7.7007 7.7007 7.8810 7.8810 k = 0.0000 0.2405-0.0000 ( 12630 PWs) bands (ev): -9.6421 -9.6421 -9.6421 -9.6421 -9.2443 -9.2443 -9.2443 -9.2443 -8.5842 -8.5842 -8.5842 -8.5842 -7.0483 -7.0483 -7.0483 -7.0483 -4.0110 -4.0110 -4.0110 -4.0110 -2.0052 -2.0052 -2.0052 -2.0052 0.2754 0.2754 0.2754 0.2754 1.3171 1.3171 1.3171 1.3171 1.5021 1.5021 1.5021 1.5021 2.3765 2.3765 2.3765 2.3765 2.7556 2.7556 2.7556 2.7556 2.8749 2.8749 2.8749 2.8749 3.1885 3.1885 3.1885 3.1885 3.2782 3.2782 3.2782 3.2782 3.6890 3.6890 3.6890 3.6890 3.9467 3.9467 3.9467 3.9467 4.3426 4.3426 4.3426 4.3426 4.7080 4.7080 4.7080 4.7080 6.8705 6.8705 6.8705 6.8705 7.3187 7.3187 7.3187 7.3187 7.7007 7.7007 7.7007 7.7007 7.8810 7.8810 k = 0.0000 0.2285-0.0000 ( 12630 PWs) bands (ev): -9.6591 -9.6591 -9.6249 -9.6249 -9.2509 -9.2509 -9.2378 -9.2378 -8.5993 -8.5993 -8.5689 -8.5689 -7.0519 -7.0519 -7.0453 -7.0453 -4.0179 -4.0179 -4.0039 -4.0039 -2.0366 -2.0366 -1.9751 -1.9751 0.2757 0.2757 0.2789 0.2789 1.3128 1.3128 1.3211 1.3211 1.4957 1.4957 1.5101 1.5101 2.3542 2.3542 2.3996 2.3996 2.7264 2.7264 2.7753 2.7753 2.8553 2.8553 2.9004 2.9004 3.1866 3.1866 3.1941 3.1941 3.2762 3.2762 3.2806 3.2806 3.6830 3.6830 3.6927 3.6927 3.9187 3.9187 3.9741 3.9741 4.3307 4.3307 4.3498 4.3498 4.7059 4.7059 4.7095 4.7095 6.8432 6.8432 6.8958 6.8958 7.2897 7.2897 7.3499 7.3499 7.6860 7.6860 7.7138 7.7138 7.8789 7.8789 k = 0.0000 0.2165-0.0000 ( 12616 PWs) bands (ev): -9.6757 -9.6757 -9.6075 -9.6075 -9.2574 -9.2574 -9.2312 -9.2312 -8.6141 -8.6141 -8.5534 -8.5534 -7.0562 -7.0562 -7.0431 -7.0431 -4.0243 -4.0243 -3.9966 -3.9966 -2.0688 -2.0688 -1.9464 -1.9464 0.2797 0.2797 0.2860 0.2860 1.3085 1.3085 1.3243 1.3243 1.4915 1.4915 1.5193 1.5193 2.3333 2.3333 2.4220 2.4220 2.6909 2.6909 2.7855 2.7855 2.8429 2.8429 2.9281 2.9281 3.1878 3.1878 3.2035 3.2035 3.2747 3.2747 3.2837 3.2837 3.6750 3.6750 3.6938 3.6938 3.8911 3.8911 3.9999 3.9999 4.3139 4.3139 4.3526 4.3526 4.7031 4.7031 4.7104 4.7104 6.8146 6.8146 6.9182 6.9182 7.2641 7.2641 7.3823 7.3823 7.6706 7.6706 7.7248 7.7248 7.8812 7.8812 k = 0.0000 0.2044-0.0000 ( 12624 PWs) bands (ev): -9.6918 -9.6918 -9.5900 -9.5900 -9.2638 -9.2638 -9.2247 -9.2247 -8.6285 -8.6285 -8.5379 -8.5379 -7.0611 -7.0611 -7.0416 -7.0416 -4.0304 -4.0304 -3.9892 -3.9892 -2.1018 -2.1018 -1.9192 -1.9192 0.2873 0.2873 0.2967 0.2967 1.3043 1.3043 1.3265 1.3265 1.4897 1.4897 1.5294 1.5294 2.3138 2.3138 2.4404 2.4404 2.6551 2.6551 2.7874 2.7874 2.8376 2.8376 2.9539 2.9539 3.1917 3.1917 3.2170 3.2170 3.2736 3.2736 3.2880 3.2880 3.6649 3.6649 3.6923 3.6923 3.8647 3.8647 4.0234 4.0234 4.2921 4.2921 4.3516 4.3516 4.6998 4.6998 4.7106 4.7106 6.7854 6.7854 6.9367 6.9367 7.2429 7.2429 7.4148 7.4148 7.6553 7.6553 7.7337 7.7337 7.8873 7.8873 k = 0.0000 0.1924-0.0000 ( 12632 PWs) bands (ev): -9.7075 -9.7075 -9.5726 -9.5726 -9.2700 -9.2700 -9.2183 -9.2183 -8.6425 -8.6425 -8.5223 -8.5223 -7.0666 -7.0666 -7.0408 -7.0408 -4.0360 -4.0360 -3.9816 -3.9816 -2.1352 -2.1352 -1.8938 -1.8938 0.2983 0.2983 0.3107 0.3107 1.3005 1.3005 1.3276 1.3276 1.4907 1.4907 1.5401 1.5401 2.2953 2.2953 2.4479 2.4479 2.6283 2.6283 2.7834 2.7834 2.8375 2.8375 2.9755 2.9755 3.1976 3.1976 3.2335 3.2335 3.2732 3.2732 3.2946 3.2946 3.6530 3.6530 3.6879 3.6879 3.8404 3.8404 4.0434 4.0434 4.2653 4.2653 4.3478 4.3478 4.6959 4.6959 4.7100 4.7100 6.7563 6.7563 6.9506 6.9506 7.2275 7.2275 7.4464 7.4464 7.6413 7.6413 7.7407 7.7407 7.8963 7.8963 k = 0.0000 0.1804-0.0000 ( 12629 PWs) bands (ev): -9.7225 -9.7225 -9.5554 -9.5554 -9.2761 -9.2761 -9.2121 -9.2121 -8.6559 -8.6559 -8.5070 -8.5070 -7.0725 -7.0725 -7.0406 -7.0406 -4.0412 -4.0412 -3.9741 -3.9741 -2.1686 -2.1686 -1.8702 -1.8702 0.3126 0.3126 0.3280 0.3280 1.2971 1.2971 1.3276 1.3276 1.4945 1.4945 1.5512 1.5512 2.2768 2.2768 2.4367 2.4367 2.6200 2.6200 2.7771 2.7771 2.8398 2.8398 2.9921 2.9921 3.2049 3.2049 3.2493 3.2493 3.2746 3.2746 3.3056 3.3056 3.6393 3.6393 3.6806 3.6806 3.8189 3.8189 4.0590 4.0590 4.2337 4.2337 4.3421 4.3421 4.6918 4.6918 4.7084 4.7084 6.7277 6.7277 6.9592 6.9592 7.2186 7.2186 7.4757 7.4757 7.6296 7.6296 7.7465 7.7465 7.9077 7.9077 k = 0.0000 0.1684-0.0000 ( 12613 PWs) bands (ev): -9.7369 -9.7369 -9.5384 -9.5384 -9.2820 -9.2820 -9.2060 -9.2060 -8.6687 -8.6687 -8.4918 -8.4918 -7.0789 -7.0789 -7.0410 -7.0410 -4.0458 -4.0458 -3.9667 -3.9667 -2.2019 -2.2019 -1.8485 -1.8485 0.3299 0.3299 0.3480 0.3480 1.2943 1.2943 1.3268 1.3268 1.5009 1.5009 1.5624 1.5624 2.2565 2.2565 2.4082 2.4082 2.6294 2.6294 2.7718 2.7718 2.8431 2.8431 3.0047 3.0047 3.2129 3.2129 3.2585 3.2585 3.2801 3.2801 3.3238 3.3238 3.6241 3.6241 3.6709 3.6709 3.8003 3.8003 4.0689 4.0689 4.1976 4.1976 4.3363 4.3363 4.6874 4.6874 4.7055 4.7055 6.7002 6.7002 6.9625 6.9625 7.2166 7.2166 7.5009 7.5009 7.6217 7.6217 7.7515 7.7515 7.9210 7.9210 k = 0.0000 0.1563-0.0000 ( 12625 PWs) bands (ev): -9.7505 -9.7505 -9.5219 -9.5219 -9.2876 -9.2876 -9.2001 -9.2001 -8.6809 -8.6809 -8.4770 -8.4770 -7.0857 -7.0857 -7.0419 -7.0419 -4.0499 -4.0499 -3.9594 -3.9594 -2.2346 -2.2346 -1.8287 -1.8287 0.3499 0.3499 0.3704 0.3704 1.2918 1.2918 1.3259 1.3259 1.5095 1.5095 1.5735 1.5735 2.2318 2.2318 2.3725 2.3725 2.6467 2.6467 2.7707 2.7707 2.8469 2.8469 3.0145 3.0145 3.2210 3.2210 3.2612 3.2612 3.2889 3.2889 3.3486 3.3486 3.6077 3.6077 3.6593 3.6593 3.7844 3.7844 4.0714 4.0714 4.1575 4.1575 4.3319 4.3319 4.6830 4.6830 4.7010 4.7010 6.6743 6.6743 6.9614 6.9614 7.2209 7.2209 7.5193 7.5193 7.6199 7.6199 7.7558 7.7558 7.9356 7.9356 k = 0.0000 0.1443-0.0000 ( 12599 PWs) bands (ev): -9.7634 -9.7634 -9.5058 -9.5058 -9.2929 -9.2929 -9.1946 -9.1946 -8.6924 -8.6924 -8.4627 -8.4627 -7.0926 -7.0926 -7.0434 -7.0434 -4.0534 -4.0534 -3.9524 -3.9524 -2.2664 -2.2664 -1.8108 -1.8108 0.3724 0.3724 0.3947 0.3947 1.2894 1.2894 1.3260 1.3260 1.5197 1.5197 1.5845 1.5845 2.2002 2.2002 2.3371 2.3371 2.6631 2.6631 2.7777 2.7777 2.8513 2.8513 3.0228 3.0228 3.2286 3.2286 3.2618 3.2618 3.2987 3.2987 3.3764 3.3764 3.5903 3.5903 3.6466 3.6466 3.7706 3.7706 4.0650 4.0650 4.1151 4.1151 4.3302 4.3302 4.6788 4.6788 4.6948 4.6948 6.6501 6.6501 6.9572 6.9572 7.2303 7.2303 7.5288 7.5288 7.6261 7.6261 7.7597 7.7597 7.9512 7.9512 k = 0.0000 0.1323-0.0000 ( 12591 PWs) bands (ev): -9.7754 -9.7754 -9.4904 -9.4904 -9.2979 -9.2979 -9.1893 -9.1893 -8.7032 -8.7032 -8.4489 -8.4489 -7.0996 -7.0996 -7.0451 -7.0451 -4.0565 -4.0565 -3.9457 -3.9457 -2.2971 -2.2971 -1.7948 -1.7948 0.3968 0.3968 0.4202 0.4202 1.2866 1.2866 1.3278 1.3278 1.5312 1.5312 1.5953 1.5953 2.1611 2.1611 2.3046 2.3046 2.6745 2.6745 2.7948 2.7948 2.8572 2.8572 3.0305 3.0305 3.2349 3.2349 3.2625 3.2625 3.3096 3.3096 3.4045 3.4045 3.5724 3.5724 3.6337 3.6337 3.7583 3.7583 4.0444 4.0444 4.0758 4.0758 4.3320 4.3320 4.6749 4.6749 4.6866 4.6866 6.6281 6.6281 6.9512 6.9512 7.2437 7.2437 7.5304 7.5304 7.6388 7.6388 7.7632 7.7632 7.9673 7.9673 k = 0.0000 0.1203-0.0000 ( 12587 PWs) bands (ev): -9.7866 -9.7866 -9.4758 -9.4758 -9.3026 -9.3026 -9.1843 -9.1843 -8.7132 -8.7132 -8.4359 -8.4359 -7.1066 -7.1066 -7.0472 -7.0472 -4.0590 -4.0590 -3.9393 -3.9393 -2.3263 -2.3263 -1.7805 -1.7805 0.4228 0.4228 0.4464 0.4464 1.2834 1.2834 1.3323 1.3323 1.5432 1.5432 1.6058 1.6058 2.1165 2.1165 2.2735 2.2735 2.6820 2.6820 2.8187 2.8187 2.8662 2.8662 3.0383 3.0383 3.2385 3.2385 3.2651 3.2651 3.3217 3.3217 3.4306 3.4306 3.5546 3.5546 3.6210 3.6210 3.7470 3.7470 4.0037 4.0037 4.0474 4.0474 4.3371 4.3371 4.6713 4.6713 4.6764 4.6764 6.6084 6.6084 6.9447 6.9447 7.2599 7.2599 7.5275 7.5275 7.6544 7.6544 7.7661 7.7661 7.9834 7.9834 k = 0.0000 0.1082-0.0000 ( 12577 PWs) bands (ev): -9.7968 -9.7968 -9.4622 -9.4622 -9.3070 -9.3070 -9.1797 -9.1797 -8.7223 -8.7223 -8.4236 -8.4236 -7.1134 -7.1134 -7.0495 -7.0495 -4.0611 -4.0611 -3.9334 -3.9334 -2.3538 -2.3538 -1.7681 -1.7681 0.4499 0.4499 0.4725 0.4725 1.2796 1.2796 1.3400 1.3400 1.5553 1.5553 1.6159 1.6159 2.0692 2.0692 2.2412 2.2412 2.6888 2.6888 2.8429 2.8429 2.8821 2.8821 3.0463 3.0463 3.2384 3.2384 3.2707 3.2707 3.3349 3.3349 3.4531 3.4531 3.5374 3.5374 3.6090 3.6090 3.7362 3.7362 3.9543 3.9543 4.0210 4.0210 4.3451 4.3451 4.6637 4.6637 4.6688 4.6688 6.5910 6.5910 6.9382 6.9382 7.2780 7.2780 7.5226 7.5226 7.6699 7.6699 7.7686 7.7686 7.9989 7.9989 k = 0.0000 0.0962-0.0000 ( 12585 PWs) bands (ev): -9.8060 -9.8060 -9.4495 -9.4495 -9.3109 -9.3109 -9.1755 -9.1755 -8.7306 -8.7306 -8.4122 -8.4122 -7.1199 -7.1199 -7.0519 -7.0519 -4.0628 -4.0628 -3.9279 -3.9279 -2.3792 -2.3792 -1.7573 -1.7573 0.4774 0.4774 0.4977 0.4977 1.2755 1.2755 1.3510 1.3510 1.5671 1.5671 1.6255 1.6255 2.0219 2.0219 2.2062 2.2062 2.6967 2.6967 2.8626 2.8626 2.9080 2.9080 3.0547 3.0547 3.2352 3.2352 3.2790 3.2790 3.3490 3.3490 3.4693 3.4693 3.5220 3.5220 3.5984 3.5984 3.7260 3.7260 3.9032 3.9032 3.9923 3.9923 4.3552 4.3552 4.6496 4.6496 4.6661 4.6661 6.5759 6.5759 6.9323 6.9323 7.2976 7.2976 7.5171 7.5171 7.6839 7.6839 7.7705 7.7705 8.0134 8.0134 k = 0.0000 0.0842-0.0000 ( 12589 PWs) bands (ev): -9.8142 -9.8142 -9.4380 -9.4380 -9.3144 -9.3144 -9.1717 -9.1717 -8.7380 -8.7380 -8.4019 -8.4019 -7.1260 -7.1260 -7.0543 -7.0543 -4.0641 -4.0641 -3.9230 -3.9230 -2.4024 -2.4024 -1.7480 -1.7480 0.5048 0.5048 0.5215 0.5215 1.2714 1.2714 1.3652 1.3652 1.5782 1.5782 1.6345 1.6345 1.9764 1.9764 2.1680 2.1680 2.7056 2.7056 2.8811 2.8811 2.9399 2.9399 3.0632 3.0632 3.2296 3.2296 3.2888 3.2888 3.3635 3.3635 3.4751 3.4751 3.5106 3.5106 3.5906 3.5906 3.7165 3.7165 3.8533 3.8533 3.9616 3.9616 4.3668 4.3668 4.6338 4.6338 4.6641 4.6641 6.5631 6.5631 6.9272 6.9272 7.3180 7.3180 7.5114 7.5114 7.6957 7.6957 7.7719 7.7719 8.0263 8.0263 k = 0.0000 0.0722-0.0000 ( 12593 PWs) bands (ev): -9.8214 -9.8214 -9.4278 -9.4278 -9.3175 -9.3175 -9.1684 -9.1684 -8.7445 -8.7445 -8.3927 -8.3927 -7.1316 -7.1316 -7.0566 -7.0566 -4.0651 -4.0651 -3.9186 -3.9186 -2.4229 -2.4229 -1.7402 -1.7402 0.5312 0.5312 0.5432 0.5432 1.2676 1.2676 1.3821 1.3821 1.5883 1.5883 1.6428 1.6428 1.9344 1.9344 2.1271 2.1271 2.7146 2.7146 2.9024 2.9024 2.9737 2.9737 3.0717 3.0717 3.2219 3.2219 3.2991 3.2991 3.3779 3.3779 3.4691 3.4691 3.5022 3.5022 3.5873 3.5873 3.7077 3.7077 3.8072 3.8072 3.9300 3.9300 4.3795 4.3795 4.6168 4.6168 4.6626 4.6626 6.5524 6.5524 6.9230 6.9230 7.3389 7.3389 7.5056 7.5056 7.7049 7.7049 7.7728 7.7728 8.0371 8.0371 k = 0.0000 0.0601-0.0000 ( 12587 PWs) bands (ev): -9.8275 -9.8275 -9.4189 -9.4189 -9.3202 -9.3202 -9.1655 -9.1655 -8.7500 -8.7500 -8.3848 -8.3848 -7.1366 -7.1366 -7.0587 -7.0587 -4.0658 -4.0658 -3.9149 -3.9149 -2.4407 -2.4407 -1.7337 -1.7337 0.5559 0.5559 0.5623 0.5623 1.2640 1.2640 1.4010 1.4010 1.5972 1.5972 1.6502 1.6502 1.8973 1.8973 2.0849 2.0849 2.7226 2.7226 2.9279 2.9279 3.0078 3.0078 3.0802 3.0802 3.2121 3.2121 3.3080 3.3080 3.3916 3.3916 3.4575 3.4575 3.4906 3.4906 3.5890 3.5890 3.6997 3.6997 3.7672 3.7672 3.8987 3.8987 4.3928 4.3928 4.5990 4.5990 4.6615 4.6615 6.5438 6.5438 6.9196 6.9196 7.3596 7.3596 7.4996 7.4996 7.7116 7.7116 7.7735 7.7735 8.0454 8.0454 k = 0.0000 0.0481-0.0000 ( 12587 PWs) bands (ev): -9.8326 -9.8326 -9.4115 -9.4115 -9.3224 -9.3224 -9.1631 -9.1631 -8.7546 -8.7546 -8.3781 -8.3781 -7.1408 -7.1408 -7.0606 -7.0606 -4.0663 -4.0663 -3.9118 -3.9118 -2.4556 -2.4556 -1.7286 -1.7286 0.5774 0.5774 0.5789 0.5789 1.2610 1.2610 1.4207 1.4207 1.6047 1.6047 1.6567 1.6567 1.8665 1.8665 2.0433 2.0433 2.7289 2.7289 2.9569 2.9569 3.0414 3.0414 3.0891 3.0891 3.2003 3.2003 3.3117 3.3117 3.4037 3.4037 3.4457 3.4457 3.4755 3.4755 3.5935 3.5935 3.6922 3.6922 3.7356 3.7356 3.8691 3.8691 4.4065 4.4065 4.5810 4.5810 4.6607 4.6607 6.5370 6.5370 6.9170 6.9170 7.3797 7.3797 7.4932 7.4932 7.7158 7.7158 7.7740 7.7740 8.0513 8.0513 k = 0.0000 0.0361-0.0000 ( 12601 PWs) bands (ev): -9.8365 -9.8365 -9.4057 -9.4057 -9.3241 -9.3241 -9.1613 -9.1613 -8.7582 -8.7582 -8.3729 -8.3729 -7.1441 -7.1441 -7.0621 -7.0621 -4.0666 -4.0666 -3.9093 -3.9093 -2.4673 -2.4673 -1.7247 -1.7247 0.5908 0.5908 0.5965 0.5965 1.2586 1.2586 1.4394 1.4394 1.6104 1.6104 1.6626 1.6626 1.8428 1.8428 2.0047 2.0047 2.7335 2.7335 2.9867 2.9867 3.0731 3.0731 3.1005 3.1005 3.1865 3.1865 3.3044 3.3044 3.4125 3.4125 3.4377 3.4377 3.4618 3.4618 3.5988 3.5988 3.6835 3.6835 3.7145 3.7145 3.8428 3.8428 4.4200 4.4200 4.5636 4.5636 4.6601 4.6601 6.5318 6.5318 6.9150 6.9150 7.3987 7.3987 7.4863 7.4863 7.7181 7.7181 7.7745 7.7745 8.0552 8.0552 k = 0.0000 0.0241-0.0000 ( 12603 PWs) bands (ev): -9.8393 -9.8393 -9.4015 -9.4015 -9.3253 -9.3253 -9.1600 -9.1600 -8.7607 -8.7607 -8.3691 -8.3691 -7.1466 -7.1466 -7.0633 -7.0633 -4.0668 -4.0668 -3.9076 -3.9076 -2.4758 -2.4758 -1.7219 -1.7219 0.6000 0.6000 0.6105 0.6105 1.2568 1.2568 1.4551 1.4551 1.6142 1.6142 1.6677 1.6677 1.8266 1.8266 1.9722 1.9722 2.7365 2.7365 3.0132 3.0132 3.0961 3.0961 3.1233 3.1233 3.1715 3.1715 3.2821 3.2821 3.4167 3.4167 3.4374 3.4374 3.4524 3.4524 3.6036 3.6036 3.6730 3.6730 3.7040 3.7040 3.8218 3.8218 4.4326 4.4326 4.5481 4.5481 4.6598 4.6598 6.5283 6.5283 6.9137 6.9137 7.4156 7.4156 7.4787 7.4787 7.7190 7.7190 7.7749 7.7749 8.0575 8.0575 k = 0.0000 0.0120-0.0000 ( 12613 PWs) bands (ev): -9.8410 -9.8410 -9.3990 -9.3990 -9.3260 -9.3260 -9.1591 -9.1591 -8.7622 -8.7622 -8.3668 -8.3668 -7.1481 -7.1481 -7.0640 -7.0640 -4.0669 -4.0669 -3.9065 -3.9065 -2.4809 -2.4809 -1.7203 -1.7203 0.6055 0.6055 0.6192 0.6192 1.2557 1.2557 1.4656 1.4656 1.6162 1.6162 1.6717 1.6717 1.8177 1.8177 1.9499 1.9499 2.7382 2.7382 3.0312 3.0312 3.1108 3.1108 3.1476 3.1476 3.1666 3.1666 3.2483 3.2483 3.4184 3.4184 3.4409 3.4409 3.4472 3.4472 3.6072 3.6072 3.6643 3.6643 3.6999 3.6999 3.8080 3.8080 4.4422 4.4422 4.5366 4.5366 4.6596 4.6596 6.5262 6.5262 6.9130 6.9130 7.4291 7.4291 7.4711 7.4711 7.7192 7.7192 7.7752 7.7752 8.0586 8.0586 k = 0.0000 0.0000 0.0000 ( 12611 PWs) bands (ev): -9.8416 -9.8416 -9.3981 -9.3981 -9.3263 -9.3263 -9.1589 -9.1589 -8.7628 -8.7628 -8.3660 -8.3660 -7.1486 -7.1486 -7.0642 -7.0642 -4.0669 -4.0669 -3.9061 -3.9061 -2.4826 -2.4826 -1.7197 -1.7197 0.6074 0.6074 0.6221 0.6221 1.2554 1.2554 1.4693 1.4693 1.6168 1.6168 1.6733 1.6733 1.8149 1.8149 1.9418 1.9418 2.7388 2.7388 3.0375 3.0375 3.1200 3.1200 3.1413 3.1413 3.1919 3.1919 3.2194 3.2194 3.4189 3.4189 3.4438 3.4438 3.4443 3.4443 3.6087 3.6087 3.6610 3.6610 3.6988 3.6988 3.8032 3.8032 4.4460 4.4460 4.5321 4.5321 4.6595 4.6595 6.5255 6.5255 6.9127 6.9127 7.4351 7.4351 7.4672 7.4672 7.7192 7.7192 7.7753 7.7753 8.0590 8.0590 k = 0.0000 0.0000 0.0000 ( 12611 PWs) bands (ev): -9.8416 -9.8416 -9.3981 -9.3981 -9.3263 -9.3263 -9.1589 -9.1589 -8.7628 -8.7628 -8.3660 -8.3660 -7.1486 -7.1486 -7.0642 -7.0642 -4.0669 -4.0669 -3.9061 -3.9061 -2.4826 -2.4826 -1.7197 -1.7197 0.6074 0.6074 0.6221 0.6221 1.2554 1.2554 1.4693 1.4693 1.6168 1.6168 1.6733 1.6733 1.8149 1.8149 1.9418 1.9418 2.7388 2.7388 3.0375 3.0375 3.1200 3.1200 3.1413 3.1413 3.1919 3.1919 3.2194 3.2194 3.4189 3.4189 3.4438 3.4438 3.4443 3.4443 3.6087 3.6087 3.6610 3.6610 3.6988 3.6988 3.8032 3.8032 4.4460 4.4460 4.5321 4.5321 4.6595 4.6595 6.5255 6.5255 6.9127 6.9127 7.4351 7.4351 7.4672 7.4672 7.7192 7.7192 7.7753 7.7753 8.0590 8.0590 k = 0.0000 0.0000 0.0119 ( 12621 PWs) bands (ev): -9.8409 -9.8409 -9.3990 -9.3990 -9.3268 -9.3268 -9.1594 -9.1594 -8.7609 -8.7609 -8.3664 -8.3664 -7.1484 -7.1484 -7.0644 -7.0644 -4.0670 -4.0670 -3.9070 -3.9070 -2.4805 -2.4805 -1.7209 -1.7209 0.6050 0.6050 0.6212 0.6212 1.2559 1.2559 1.4698 1.4698 1.6218 1.6218 1.6729 1.6729 1.8149 1.8149 1.9430 1.9430 2.7375 2.7375 3.0364 3.0364 3.1181 3.1181 3.1369 3.1369 3.1917 3.1917 3.2223 3.2223 3.4181 3.4181 3.4422 3.4422 3.4434 3.4434 3.6088 3.6088 3.6605 3.6605 3.6995 3.6995 3.8093 3.8093 4.4437 4.4437 4.5340 4.5340 4.6615 4.6615 6.5248 6.5248 6.9128 6.9128 7.4257 7.4257 7.4711 7.4711 7.7169 7.7169 7.7791 7.7791 8.0589 8.0589 k = 0.0000 0.0000 0.0239 ( 12617 PWs) bands (ev): -9.8389 -9.8389 -9.4020 -9.4020 -9.3283 -9.3283 -9.1608 -9.1608 -8.7556 -8.7556 -8.3675 -8.3675 -7.1478 -7.1478 -7.0649 -7.0649 -4.0672 -4.0672 -3.9096 -3.9096 -2.4743 -2.4743 -1.7243 -1.7243 0.5981 0.5981 0.6183 0.6183 1.2574 1.2574 1.4712 1.4712 1.6364 1.6364 1.6721 1.6721 1.8151 1.8151 1.9465 1.9465 2.7337 2.7337 3.0330 3.0330 3.1126 3.1126 3.1251 3.1251 3.1905 3.1905 3.2305 3.2305 3.4152 3.4152 3.4368 3.4368 3.4422 3.4422 3.6090 3.6090 3.6590 3.6590 3.7015 3.7015 3.8266 3.8266 4.4375 4.4375 4.5395 4.5395 4.6667 4.6667 6.5226 6.5226 6.9128 6.9128 7.4042 7.4042 7.4771 7.4771 7.7108 7.7108 7.7892 7.7892 8.0583 8.0583 k = 0.0000 0.0000 0.0358 ( 12631 PWs) bands (ev): -9.8356 -9.8356 -9.4074 -9.4074 -9.3300 -9.3300 -9.1632 -9.1632 -8.7469 -8.7469 -8.3695 -8.3695 -7.1470 -7.1470 -7.0659 -7.0659 -4.0675 -4.0675 -3.9139 -3.9139 -2.4642 -2.4642 -1.7301 -1.7301 0.5873 0.5873 0.6136 0.6136 1.2600 1.2600 1.4734 1.4734 1.6576 1.6576 1.6732 1.6732 1.8154 1.8154 1.9523 1.9523 2.7272 2.7272 3.0275 3.0275 3.1036 3.1036 3.1089 3.1089 3.1873 3.1873 3.2424 3.2424 3.4094 3.4094 3.4302 3.4302 3.4405 3.4405 3.6093 3.6093 3.6571 3.6571 3.7044 3.7044 3.8526 3.8526 4.4291 4.4291 4.5485 4.5485 4.6739 4.6739 6.5191 6.5191 6.9128 6.9128 7.3761 7.3761 7.4814 7.4814 7.7019 7.7019 7.8031 7.8031 8.0568 8.0568 k = 0.0000 0.0000 0.0477 ( 12625 PWs) bands (ev): -9.8309 -9.8309 -9.4156 -9.4156 -9.3312 -9.3312 -9.1664 -9.1664 -8.7353 -8.7353 -8.3722 -8.3722 -7.1457 -7.1457 -7.0671 -7.0671 -4.0678 -4.0678 -3.9196 -3.9196 -2.4502 -2.4502 -1.7383 -1.7383 0.5736 0.5736 0.6072 0.6072 1.2638 1.2638 1.4762 1.4762 1.6646 1.6646 1.6957 1.6957 1.8161 1.8161 1.9606 1.9606 2.7178 2.7178 3.0199 3.0199 3.0859 3.0859 3.0959 3.0959 3.1822 3.1822 3.2566 3.2566 3.4006 3.4006 3.4247 3.4247 3.4386 3.4386 3.6092 3.6092 3.6545 3.6545 3.7078 3.7078 3.8848 3.8848 4.4205 4.4205 4.5606 4.5606 4.6818 4.6818 6.5143 6.5143 6.9124 6.9124 7.3438 7.3438 7.4839 7.4839 7.6911 7.6911 7.8185 7.8185 8.0522 8.0522 k = 0.0000 0.0000 0.0596 ( 12601 PWs) bands (ev): -9.8249 -9.8249 -9.4267 -9.4267 -9.3315 -9.3315 -9.1706 -9.1706 -8.7212 -8.7212 -8.3758 -8.3758 -7.1441 -7.1441 -7.0687 -7.0687 -4.0681 -4.0681 -3.9267 -3.9267 -2.4325 -2.4325 -1.7488 -1.7488 0.5578 0.5578 0.5992 0.5992 1.2687 1.2687 1.4792 1.4792 1.6631 1.6631 1.7321 1.7321 1.8178 1.8178 1.9713 1.9713 2.7054 2.7054 3.0105 3.0105 3.0631 3.0631 3.0844 3.0844 3.1754 3.1754 3.2718 3.2718 3.3907 3.3907 3.4204 3.4204 3.4369 3.4369 3.6082 3.6082 3.6507 3.6507 3.7111 3.7111 3.9213 3.9213 4.4134 4.4134 4.5752 4.5752 4.6890 4.6890 6.5086 6.5086 6.9111 6.9111 7.3095 7.3095 7.4851 7.4851 7.6786 7.6786 7.8338 7.8338 8.0415 8.0416 k = 0.0000 0.0000 0.0716 ( 12581 PWs) bands (ev): -9.8177 -9.8177 -9.4406 -9.4406 -9.3304 -9.3304 -9.1755 -9.1755 -8.7051 -8.7051 -8.3802 -8.3802 -7.1422 -7.1422 -7.0706 -7.0706 -4.0684 -4.0684 -3.9350 -3.9350 -2.4115 -2.4115 -1.7618 -1.7618 0.5412 0.5412 0.5898 0.5898 1.2748 1.2748 1.4818 1.4818 1.6613 1.6613 1.7695 1.7695 1.8242 1.8242 1.9846 1.9846 2.6897 2.6897 2.9994 2.9994 3.0385 3.0385 3.0722 3.0722 3.1677 3.1677 3.2867 3.2867 3.3816 3.3816 3.4172 3.4172 3.4355 3.4355 3.6057 3.6057 3.6456 3.6456 3.7139 3.7139 3.9606 3.9606 4.4092 4.4092 4.5917 4.5917 4.6948 4.6948 6.5022 6.5022 6.9079 6.9079 7.2755 7.2755 7.4849 7.4849 7.6651 7.6651 7.8473 7.8473 8.0258 8.0258 k = 0.0000 0.0000 0.0835 ( 12565 PWs) bands (ev): -9.8091 -9.8091 -9.4568 -9.4568 -9.3281 -9.3281 -9.1812 -9.1812 -8.6874 -8.6874 -8.3856 -8.3856 -7.1400 -7.1400 -7.0729 -7.0729 -4.0684 -4.0684 -3.9441 -3.9441 -2.3875 -2.3875 -1.7773 -1.7773 0.5247 0.5247 0.5792 0.5792 1.2821 1.2821 1.4835 1.4835 1.6604 1.6604 1.7926 1.7926 1.8483 1.8483 2.0008 2.0008 2.6709 2.6709 2.9869 2.9869 3.0127 3.0127 3.0596 3.0596 3.1599 3.1599 3.3001 3.3001 3.3745 3.3745 3.4149 3.4149 3.4347 3.4347 3.6006 3.6006 3.6397 3.6397 3.7157 3.7157 4.0019 4.0019 4.4084 4.4084 4.6094 4.6094 4.6985 4.6985 6.4957 6.4957 6.9011 6.9011 7.2447 7.2447 7.4833 7.4833 7.6514 7.6514 7.8570 7.8570 8.0096 8.0096 k = 0.0000 0.0000 0.0954 ( 12569 PWs) bands (ev): -9.7993 -9.7993 -9.4749 -9.4749 -9.3246 -9.3246 -9.1875 -9.1875 -8.6685 -8.6685 -8.3919 -8.3919 -7.1376 -7.1376 -7.0754 -7.0754 -4.0682 -4.0682 -3.9539 -3.9539 -2.3606 -2.3606 -1.7952 -1.7952 0.5090 0.5090 0.5676 0.5676 1.2905 1.2905 1.4838 1.4838 1.6610 1.6610 1.7981 1.7981 1.8916 1.8916 2.0201 2.0201 2.6494 2.6494 2.9712 2.9712 2.9880 2.9880 3.0469 3.0469 3.1529 3.1529 3.3106 3.3106 3.3698 3.3698 3.4133 3.4133 3.4348 3.4348 3.5922 3.5922 3.6345 3.6345 3.7163 3.7163 4.0443 4.0443 4.4112 4.4112 4.6276 4.6276 4.7001 4.7001 6.4897 6.4897 6.8889 6.8889 7.2197 7.2197 7.4798 7.4798 7.6385 7.6385 7.8607 7.8607 7.9964 7.9964 k = 0.0000 0.0000 0.1074 ( 12567 PWs) bands (ev): -9.7883 -9.7883 -9.4944 -9.4944 -9.3202 -9.3202 -9.1945 -9.1945 -8.6489 -8.6489 -8.3992 -8.3992 -7.1348 -7.1348 -7.0782 -7.0782 -4.0676 -4.0676 -3.9642 -3.9642 -2.3314 -2.3314 -1.8156 -1.8156 0.4947 0.4947 0.5554 0.5554 1.2999 1.2999 1.4820 1.4820 1.6636 1.6636 1.7976 1.7976 1.9398 1.9398 2.0433 2.0433 2.6257 2.6257 2.9455 2.9455 2.9716 2.9716 3.0344 3.0344 3.1476 3.1476 3.3167 3.3167 3.3674 3.3674 3.4116 3.4116 3.4370 3.4370 3.5807 3.5807 3.6308 3.6308 3.7156 3.7156 4.0871 4.0871 4.4169 4.4169 4.6453 4.6453 4.6996 4.6996 6.4851 6.4851 6.8697 6.8697 7.2032 7.2032 7.4735 7.4735 7.6278 7.6278 7.8563 7.8563 7.9891 7.9891 k = 0.0000 0.0000 0.1193 ( 12587 PWs) bands (ev): -9.7761 -9.7761 -9.5148 -9.5148 -9.3149 -9.3149 -9.2020 -9.2020 -8.6289 -8.6289 -8.4076 -8.4076 -7.1318 -7.1318 -7.0812 -7.0812 -4.0665 -4.0665 -3.9747 -3.9747 -2.3001 -2.3001 -1.8384 -1.8384 0.4825 0.4825 0.5426 0.5426 1.3103 1.3103 1.4780 1.4780 1.6683 1.6683 1.7949 1.7949 1.9864 1.9864 2.0716 2.0716 2.6012 2.6012 2.9124 2.9124 2.9614 2.9614 3.0222 3.0222 3.1445 3.1445 3.3177 3.3177 3.3668 3.3668 3.4083 3.4083 3.4421 3.4421 3.5682 3.5682 3.6286 3.6286 3.7134 3.7134 4.1298 4.1298 4.4242 4.4242 4.6617 4.6617 4.6976 4.6976 6.4826 6.4826 6.8428 6.8428 7.1961 7.1961 7.4637 7.4637 7.6206 7.6206 7.8437 7.8437 7.9883 7.9883 k = 0.0000 0.0000 0.1312 ( 12591 PWs) bands (ev): -9.7627 -9.7627 -9.5359 -9.5359 -9.3088 -9.3088 -9.2099 -9.2099 -8.6087 -8.6087 -8.4170 -8.4170 -7.1287 -7.1287 -7.0844 -7.0844 -4.0648 -4.0648 -3.9851 -3.9851 -2.2671 -2.2671 -1.8635 -1.8635 0.4726 0.4726 0.5298 0.5298 1.3216 1.3216 1.4716 1.4716 1.6753 1.6753 1.7907 1.7907 2.0278 2.0278 2.1055 2.1055 2.5777 2.5777 2.8755 2.8755 2.9542 2.9542 3.0104 3.0104 3.1442 3.1442 3.3135 3.3135 3.3671 3.3671 3.4028 3.4028 3.4501 3.4501 3.5568 3.5568 3.6279 3.6279 3.7098 3.7098 4.1720 4.1720 4.4315 4.4315 4.6762 4.6762 4.6947 4.6947 6.4832 6.4832 6.8095 6.8095 7.1981 7.1981 7.4499 7.4499 7.6179 7.6179 7.8251 7.8251 7.9922 7.9922 k = 0.0000 0.0000 0.1431 ( 12597 PWs) bands (ev): -9.7483 -9.7483 -9.5572 -9.5572 -9.3021 -9.3021 -9.2182 -9.2182 -8.5886 -8.5886 -8.4274 -8.4274 -7.1253 -7.1253 -7.0879 -7.0879 -4.0625 -4.0625 -3.9954 -3.9954 -2.2328 -2.2328 -1.8908 -1.8908 0.4653 0.4653 0.5171 0.5171 1.3336 1.3336 1.4631 1.4631 1.6841 1.6841 1.7852 1.7852 2.0632 2.0632 2.1426 2.1426 2.5577 2.5577 2.8358 2.8358 2.9494 2.9494 2.9991 2.9991 3.1470 3.1470 3.3041 3.3041 3.3677 3.3677 3.3959 3.3959 3.4598 3.4598 3.5477 3.5477 3.6288 3.6288 3.7047 3.7047 4.2132 4.2132 4.4369 4.4369 4.6878 4.6878 4.6919 4.6919 6.4875 6.4875 6.7716 6.7716 7.2074 7.2074 7.4324 7.4324 7.6199 7.6199 7.8028 7.8028 7.9987 7.9987 k = 0.0000 0.0000 0.1551 ( 12596 PWs) bands (ev): -9.7327 -9.7327 -9.5786 -9.5786 -9.2948 -9.2948 -9.2268 -9.2268 -8.5689 -8.5689 -8.4390 -8.4390 -7.1217 -7.1217 -7.0914 -7.0914 -4.0595 -4.0595 -4.0054 -4.0054 -2.1974 -2.1974 -1.9202 -1.9202 0.4606 0.4606 0.5049 0.5049 1.3463 1.3463 1.4528 1.4528 1.6944 1.6944 1.7785 1.7785 2.0946 2.0946 2.1770 2.1770 2.5448 2.5448 2.7938 2.7938 2.9467 2.9467 2.9883 2.9883 3.1529 3.1529 3.2897 3.2897 3.3684 3.3684 3.3890 3.3890 3.4703 3.4703 3.5405 3.5405 3.6318 3.6318 3.6983 3.6983 4.2528 4.2528 4.4384 4.4384 4.6900 4.6900 4.6966 4.6966 6.4963 6.4963 6.7315 6.7315 7.2225 7.2225 7.4116 7.4116 7.6263 7.6263 7.7788 7.7788 8.0065 8.0065 k = 0.0000 0.0000 0.1670 ( 12606 PWs) bands (ev): -9.7161 -9.7161 -9.5998 -9.5998 -9.2871 -9.2871 -9.2355 -9.2355 -8.5496 -8.5496 -8.4518 -8.4518 -7.1181 -7.1181 -7.0951 -7.0951 -4.0556 -4.0556 -4.0148 -4.0148 -2.1615 -2.1615 -1.9513 -1.9513 0.4585 0.4585 0.4935 0.4935 1.3596 1.3596 1.4412 1.4412 1.7057 1.7057 1.7706 1.7706 2.1236 2.1236 2.2020 2.2020 2.5432 2.5432 2.7501 2.7501 2.9461 2.9461 2.9784 2.9784 3.1622 3.1622 3.2713 3.2713 3.3691 3.3691 3.3832 3.3832 3.4810 3.4810 3.5341 3.5341 3.6369 3.6369 3.6906 3.6906 4.2904 4.2904 4.4344 4.4344 4.6903 4.6903 4.7018 4.7018 6.5100 6.5100 6.6909 6.6909 7.2417 7.2417 7.3886 7.3886 7.6367 7.6367 7.7544 7.7544 8.0146 8.0146 k = 0.0000 0.0000 0.1789 ( 12596 PWs) bands (ev): -9.6986 -9.6986 -9.6207 -9.6207 -9.2790 -9.2790 -9.2443 -9.2443 -8.5310 -8.5310 -8.4656 -8.4656 -7.1143 -7.1143 -7.0989 -7.0989 -4.0509 -4.0509 -4.0236 -4.0236 -2.1252 -2.1252 -1.9841 -1.9841 0.4591 0.4591 0.4832 0.4832 1.3733 1.3733 1.4284 1.4284 1.7174 1.7174 1.7616 1.7616 2.1508 2.1508 2.2132 2.2132 2.5560 2.5560 2.7054 2.7054 2.9474 2.9474 2.9694 2.9694 3.1748 3.1748 3.2505 3.2505 3.3701 3.3701 3.3787 3.3787 3.4915 3.4915 3.5274 3.5274 3.6441 3.6441 3.6819 3.6819 4.3254 4.3254 4.4241 4.4241 4.6925 4.6925 4.7038 4.7038 6.5289 6.5289 6.6516 6.6516 7.2638 7.2638 7.3640 7.3640 7.6504 7.6504 7.7304 7.7304 8.0225 8.0225 k = 0.0000 0.0000 0.1909 ( 12602 PWs) bands (ev): -9.6803 -9.6803 -9.6412 -9.6412 -9.2706 -9.2706 -9.2532 -9.2532 -8.5133 -8.5133 -8.4804 -8.4804 -7.1105 -7.1105 -7.1028 -7.1028 -4.0454 -4.0454 -4.0317 -4.0317 -2.0890 -2.0890 -2.0181 -2.0181 0.4620 0.4620 0.4743 0.4743 1.3872 1.3872 1.4150 1.4150 1.7292 1.7292 1.7515 1.7515 2.1756 2.1756 2.2102 2.2102 2.5825 2.5825 2.6609 2.6609 2.9505 2.9505 2.9617 2.9617 3.1905 3.1905 3.2292 3.2292 3.3713 3.3713 3.3755 3.3755 3.5017 3.5017 3.5198 3.5198 3.6529 3.6529 3.6724 3.6724 4.3571 4.3571 4.4073 4.4073 4.6961 4.6961 4.7029 4.7029 6.5529 6.5529 6.6149 6.6149 7.2879 7.2879 7.3386 7.3386 7.6671 7.6671 7.7075 7.7075 8.0301 8.0301 k = 0.0000 0.0000 0.2028 ( 12586 PWs) bands (ev): -9.6611 -9.6611 -9.6611 -9.6611 -9.2620 -9.2620 -9.2620 -9.2620 -8.4964 -8.4964 -8.4964 -8.4964 -7.1066 -7.1066 -7.1066 -7.1066 -4.0390 -4.0390 -4.0390 -4.0390 -2.0532 -2.0532 -2.0532 -2.0532 0.4672 0.4672 0.4672 0.4672 1.4012 1.4012 1.4012 1.4012 1.7407 1.7407 1.7407 1.7407 2.1964 2.1964 2.1964 2.1964 2.6189 2.6189 2.6189 2.6189 2.9553 2.9553 2.9553 2.9553 3.2088 3.2088 3.2088 3.2088 3.3731 3.3731 3.3731 3.3731 3.5112 3.5112 3.5112 3.5112 3.6625 3.6625 3.6625 3.6625 4.3847 4.3847 4.3847 4.3847 4.7000 4.7000 4.7000 4.7000 6.5817 6.5817 6.5817 6.5817 7.3130 7.3130 7.3130 7.3130 7.6862 7.6862 7.6862 7.6862 8.0370 8.0370 k = 0.0000 0.0000 0.2028 ( 12586 PWs) bands (ev): -9.6611 -9.6611 -9.6611 -9.6611 -9.2620 -9.2620 -9.2620 -9.2620 -8.4964 -8.4964 -8.4964 -8.4964 -7.1066 -7.1066 -7.1066 -7.1066 -4.0390 -4.0390 -4.0390 -4.0390 -2.0532 -2.0532 -2.0532 -2.0532 0.4672 0.4672 0.4672 0.4672 1.4012 1.4012 1.4012 1.4012 1.7407 1.7407 1.7407 1.7407 2.1964 2.1964 2.1964 2.1964 2.6189 2.6189 2.6189 2.6189 2.9553 2.9553 2.9553 2.9553 3.2088 3.2088 3.2088 3.2088 3.3731 3.3731 3.3731 3.3731 3.5112 3.5112 3.5112 3.5112 3.6625 3.6625 3.6625 3.6625 4.3847 4.3847 4.3847 4.3847 4.7000 4.7000 4.7000 4.7000 6.5817 6.5817 6.5817 6.5817 7.3130 7.3130 7.3130 7.3130 7.6862 7.6862 7.6862 7.6862 8.0370 8.0370 k = 0.0125-0.0000 0.2028 ( 12590 PWs) bands (ev): -9.6604 -9.6604 -9.6602 -9.6602 -9.2616 -9.2616 -9.2614 -9.2614 -8.4959 -8.4959 -8.4958 -8.4958 -7.1063 -7.1063 -7.1063 -7.1063 -4.0394 -4.0394 -4.0394 -4.0394 -2.0541 -2.0541 -2.0539 -2.0539 0.4653 0.4653 0.4694 0.4694 1.3901 1.3901 1.3951 1.3951 1.7327 1.7327 1.7421 1.7421 2.2017 2.2017 2.2055 2.2055 2.6116 2.6116 2.6197 2.6197 2.9398 2.9398 2.9566 2.9566 3.1995 3.1995 3.2230 3.2230 3.3621 3.3621 3.3832 3.3832 3.5051 3.5051 3.5237 3.5237 3.6540 3.6540 3.6660 3.6660 4.3802 4.3802 4.3883 4.3883 4.6997 4.6997 4.7002 4.7002 6.5868 6.5868 6.5878 6.5878 7.2893 7.2893 7.3331 7.3331 7.6707 7.6707 7.7133 7.7133 8.0339 8.0339 k = 0.0250-0.0000 0.2028 ( 12576 PWs) bands (ev): -9.6581 -9.6581 -9.6578 -9.6578 -9.2604 -9.2604 -9.2600 -9.2600 -8.4943 -8.4943 -8.4942 -8.4942 -7.1055 -7.1055 -7.1054 -7.1054 -4.0407 -4.0407 -4.0406 -4.0406 -2.0565 -2.0565 -2.0561 -2.0561 0.4636 0.4636 0.4719 0.4719 1.3625 1.3625 1.3727 1.3727 1.7196 1.7196 1.7371 1.7371 2.2202 2.2202 2.2265 2.2265 2.5975 2.5975 2.6145 2.6145 2.9134 2.9134 2.9449 2.9449 3.1948 3.1948 3.2381 3.2381 3.3524 3.3524 3.3919 3.3919 3.5060 3.5060 3.5381 3.5381 3.6411 3.6411 3.6672 3.6672 4.3749 4.3749 4.3907 4.3907 4.6994 4.6994 4.7001 4.7001 6.6025 6.6025 6.6052 6.6052 7.2650 7.2650 7.3466 7.3466 7.6694 7.6694 7.7495 7.7495 8.0362 8.0362 k = 0.0375-0.0000 0.2028 ( 12556 PWs) bands (ev): -9.6542 -9.6542 -9.6538 -9.6538 -9.2583 -9.2583 -9.2577 -9.2577 -8.4917 -8.4917 -8.4916 -8.4916 -7.1041 -7.1041 -7.1040 -7.1040 -4.0429 -4.0429 -4.0428 -4.0428 -2.0605 -2.0605 -2.0600 -2.0600 0.4621 0.4621 0.4748 0.4748 1.3208 1.3208 1.3366 1.3366 1.7027 1.7027 1.7264 1.7264 2.2470 2.2470 2.2537 2.2537 2.5770 2.5770 2.6052 2.6052 2.8820 2.8820 2.9238 2.9238 3.1927 3.1927 3.2483 3.2483 3.3466 3.3466 3.3997 3.3997 3.5108 3.5108 3.5460 3.5460 3.6272 3.6272 3.6722 3.6722 4.3688 4.3688 4.3918 4.3918 4.6989 4.6989 4.6994 4.6994 6.6276 6.6276 6.6337 6.6337 7.2423 7.2423 7.3513 7.3513 7.6839 7.6839 7.7934 7.7934 8.0441 8.0441 k = 0.0500-0.0000 0.2028 ( 12574 PWs) bands (ev): -9.6488 -9.6488 -9.6482 -9.6482 -9.2553 -9.2553 -9.2546 -9.2546 -8.4881 -8.4881 -8.4879 -8.4879 -7.1022 -7.1022 -7.1020 -7.1020 -4.0459 -4.0459 -4.0457 -4.0457 -2.0662 -2.0662 -2.0655 -2.0655 0.4605 0.4605 0.4779 0.4779 1.2682 1.2682 1.2900 1.2900 1.6830 1.6830 1.7112 1.7112 2.2751 2.2751 2.2796 2.2796 2.5518 2.5518 2.5950 2.5950 2.8514 2.8514 2.8973 2.8973 3.1906 3.1906 3.2496 3.2496 3.3464 3.3464 3.4073 3.4073 3.5116 3.5116 3.5399 3.5399 3.6202 3.6202 3.6871 3.6871 4.3621 4.3621 4.3913 4.3913 4.6975 4.6975 4.6979 4.6979 6.6608 6.6608 6.6729 6.6729 7.2231 7.2231 7.3479 7.3479 7.7132 7.7132 7.8439 7.8439 8.0576 8.0576 k = 0.0625-0.0000 0.2028 ( 12578 PWs) bands (ev): -9.6418 -9.6418 -9.6411 -9.6411 -9.2515 -9.2515 -9.2506 -9.2506 -8.4834 -8.4834 -8.4832 -8.4832 -7.0997 -7.0997 -7.0996 -7.0996 -4.0497 -4.0497 -4.0495 -4.0495 -2.0736 -2.0736 -2.0727 -2.0727 0.4586 0.4586 0.4812 0.4812 1.2080 1.2080 1.2363 1.2363 1.6607 1.6607 1.6918 1.6918 2.2957 2.2957 2.2958 2.2958 2.5254 2.5254 2.5891 2.5891 2.8263 2.8263 2.8685 2.8685 3.1870 3.1870 3.2421 3.2421 3.3503 3.3503 3.4153 3.4153 3.5013 3.5013 3.5205 3.5205 3.6275 3.6275 3.7105 3.7105 4.3546 4.3546 4.3893 4.3893 4.6939 4.6939 4.6958 4.6958 6.7000 6.7000 6.7218 6.7218 7.2090 7.2090 7.3390 7.3390 7.7540 7.7540 7.9001 7.9001 8.0769 8.0769 k = 0.0750-0.0000 0.2028 ( 12606 PWs) bands (ev): -9.6334 -9.6334 -9.6325 -9.6325 -9.2469 -9.2469 -9.2458 -9.2458 -8.4777 -8.4777 -8.4774 -8.4774 -7.0969 -7.0969 -7.0967 -7.0967 -4.0544 -4.0544 -4.0541 -4.0541 -2.0827 -2.0827 -2.0817 -2.0817 0.4562 0.4562 0.4845 0.4845 1.1431 1.1431 1.1782 1.1782 1.6354 1.6354 1.6682 1.6682 2.2946 2.2946 2.2992 2.2992 2.5041 2.5041 2.5920 2.5920 2.8104 2.8104 2.8405 2.8405 3.1805 3.1805 3.2270 3.2270 3.3557 3.3557 3.4239 3.4239 3.4832 3.4832 3.4938 3.4938 3.6466 3.6466 3.7372 3.7372 4.3465 4.3465 4.3856 4.3856 4.6882 4.6882 4.6920 4.6920 6.7427 6.7427 6.7795 6.7795 7.2021 7.2021 7.3275 7.3275 7.8028 7.8028 7.9609 7.9609 8.1022 8.1022 k = 0.0875-0.0000 0.2028 ( 12598 PWs) bands (ev): -9.6234 -9.6234 -9.6224 -9.6224 -9.2414 -9.2414 -9.2402 -9.2402 -8.4710 -8.4710 -8.4706 -8.4706 -7.0937 -7.0937 -7.0935 -7.0935 -4.0597 -4.0597 -4.0595 -4.0595 -2.0938 -2.0938 -2.0926 -2.0926 0.4529 0.4529 0.4876 0.4876 1.0756 1.0756 1.1183 1.1183 1.6070 1.6070 1.6403 1.6403 2.2743 2.2743 2.2789 2.2789 2.4919 2.4919 2.6022 2.6022 2.8053 2.8053 2.8167 2.8167 3.1698 3.1698 3.2046 3.2046 3.3611 3.3611 3.4328 3.4328 3.4653 3.4653 3.4660 3.4660 3.6705 3.6705 3.7628 3.7628 4.3381 4.3381 4.3805 4.3805 4.6797 4.6797 4.6859 4.6859 6.7861 6.7861 6.8446 6.8446 7.2044 7.2044 7.3157 7.3157 7.8558 7.8558 8.0249 8.0249 8.1340 8.1340 k = 0.1000-0.0000 0.2028 ( 12598 PWs) bands (ev): -9.6121 -9.6121 -9.6109 -9.6109 -9.2352 -9.2352 -9.2338 -9.2338 -8.4632 -8.4632 -8.4627 -8.4627 -7.0902 -7.0902 -7.0900 -7.0900 -4.0658 -4.0658 -4.0655 -4.0655 -2.1069 -2.1069 -2.1056 -2.1056 0.4481 0.4481 0.4902 0.4902 1.0075 1.0075 1.0585 1.0585 1.5752 1.5752 1.6079 1.6079 2.2384 2.2384 2.2385 2.2385 2.4853 2.4853 2.6106 2.6106 2.8027 2.8027 2.8110 2.8110 3.1540 3.1540 3.1746 3.1746 3.3670 3.3670 3.4322 3.4322 3.4514 3.4514 3.4530 3.4530 3.6947 3.6947 3.7849 3.7849 4.3296 4.3296 4.3742 4.3742 4.6681 4.6681 4.6768 4.6768 6.8268 6.8268 6.9157 6.9157 7.2182 7.2182 7.3054 7.3054 7.9096 7.9096 8.0887 8.0887 8.1734 8.1734 k = 0.1125-0.0000 0.2028 ( 12586 PWs) bands (ev): -9.5993 -9.5993 -9.5980 -9.5980 -9.2282 -9.2282 -9.2267 -9.2267 -8.4544 -8.4544 -8.4538 -8.4538 -7.0866 -7.0866 -7.0863 -7.0863 -4.0726 -4.0726 -4.0722 -4.0722 -2.1221 -2.1221 -2.1207 -2.1207 0.4415 0.4415 0.4917 0.4917 0.9405 0.9405 1.0007 1.0007 1.5399 1.5399 1.5710 1.5710 2.1854 2.1854 2.1926 2.1926 2.4784 2.4784 2.6070 2.6070 2.8038 2.8038 2.8242 2.8242 3.1328 3.1328 3.1379 3.1379 3.3742 3.3742 3.4146 3.4146 3.4473 3.4473 3.4607 3.4607 3.7166 3.7166 3.8019 3.8019 4.3213 4.3213 4.3672 4.3672 4.6531 4.6531 4.6641 4.6641 6.8622 6.8622 6.9912 6.9912 7.2450 7.2450 7.2980 7.2980 7.9610 7.9610 8.1473 8.1473 8.2212 8.2212 k = 0.1250-0.0000 0.2028 ( 12598 PWs) bands (ev): -9.5852 -9.5852 -9.5838 -9.5838 -9.2205 -9.2205 -9.2188 -9.2188 -8.4445 -8.4445 -8.4439 -8.4439 -7.0829 -7.0829 -7.0825 -7.0825 -4.0799 -4.0799 -4.0795 -4.0795 -2.1396 -2.1396 -2.1381 -2.1381 0.4322 0.4322 0.4915 0.4915 0.8762 0.8762 0.9463 0.9463 1.5012 1.5012 1.5298 1.5298 2.1258 2.1258 2.1405 2.1405 2.4692 2.4692 2.5885 2.5885 2.8183 2.8183 2.8396 2.8396 3.0975 3.0975 3.1085 3.1085 3.3837 3.3837 3.4014 3.4014 3.4469 3.4469 3.4741 3.4741 3.7349 3.7349 3.8129 3.8129 4.3136 4.3136 4.3598 4.3598 4.6345 4.6345 4.6474 4.6474 6.8912 6.8912 7.0688 7.0688 7.2845 7.2845 7.2950 7.2950 8.0077 8.0077 8.1957 8.1957 8.2780 8.2780 k = 0.1375-0.0000 0.2028 ( 12590 PWs) bands (ev): -9.5698 -9.5698 -9.5683 -9.5683 -9.2121 -9.2121 -9.2103 -9.2103 -8.4336 -8.4336 -8.4329 -8.4329 -7.0792 -7.0792 -7.0789 -7.0789 -4.0877 -4.0877 -4.0872 -4.0872 -2.1595 -2.1595 -2.1579 -2.1579 0.4197 0.4197 0.4884 0.4884 0.8162 0.8162 0.8966 0.8966 1.4593 1.4593 1.4847 1.4847 2.0627 2.0627 2.0850 2.0850 2.4575 2.4575 2.5595 2.5595 2.8373 2.8373 2.8502 2.8502 3.0583 3.0583 3.0860 3.0860 3.3946 3.3946 3.3958 3.3958 3.4502 3.4502 3.4889 3.4889 3.7492 3.7492 3.8178 3.8178 4.3065 4.3065 4.3525 4.3525 4.6125 4.6125 4.6263 4.6263 6.9148 6.9148 7.1448 7.1448 7.2991 7.2991 7.3343 7.3343 8.0485 8.0485 8.2346 8.2346 8.3429 8.3429 k = 0.1500-0.0000 0.2028 ( 12598 PWs) bands (ev): -9.5533 -9.5533 -9.5516 -9.5516 -9.2031 -9.2031 -9.2011 -9.2011 -8.4216 -8.4216 -8.4209 -8.4209 -7.0758 -7.0758 -7.0754 -7.0754 -4.0959 -4.0959 -4.0954 -4.0954 -2.1819 -2.1819 -2.1803 -2.1803 0.4033 0.4033 0.4808 0.4808 0.7626 0.7626 0.8527 0.8527 1.4147 1.4147 1.4363 1.4363 1.9982 1.9982 2.0277 2.0277 2.4443 2.4443 2.5245 2.5245 2.8491 2.8491 2.8500 2.8500 3.0277 3.0277 3.0722 3.0722 3.3933 3.3933 3.4102 3.4102 3.4554 3.4554 3.5044 3.5044 3.7593 3.7593 3.8168 3.8168 4.2999 4.2999 4.3455 4.3455 4.5872 4.5872 4.6007 4.6007 6.9346 6.9346 7.2101 7.2101 7.3181 7.3181 7.3911 7.3911 8.0836 8.0836 8.2680 8.2680 8.4142 8.4142 k = 0.1625-0.0000 0.2028 ( 12594 PWs) bands (ev): -9.5355 -9.5355 -9.5338 -9.5338 -9.1934 -9.1934 -9.1914 -9.1914 -8.4086 -8.4086 -8.4077 -8.4077 -7.0727 -7.0727 -7.0723 -7.0723 -4.1044 -4.1044 -4.1037 -4.1037 -2.2071 -2.2071 -2.2053 -2.2053 0.3828 0.3828 0.4667 0.4667 0.7178 0.7178 0.8151 0.8151 1.3678 1.3678 1.3853 1.3853 1.9333 1.9333 1.9700 1.9700 2.4297 2.4297 2.4862 2.4862 2.8330 2.8330 2.8455 2.8455 3.0155 3.0155 3.0708 3.0708 3.3958 3.3958 3.4260 3.4260 3.4617 3.4617 3.5201 3.5201 3.7656 3.7656 3.8110 3.8110 4.2932 4.2932 4.3393 4.3393 4.5593 4.5593 4.5707 4.5707 6.9527 6.9527 7.2502 7.2502 7.3647 7.3647 7.4510 7.4510 8.1135 8.1135 8.2988 8.2988 8.4892 8.4892 k = 0.1750-0.0000 0.2028 ( 12592 PWs) bands (ev): -9.5168 -9.5168 -9.5149 -9.5149 -9.1832 -9.1832 -9.1811 -9.1811 -8.3945 -8.3945 -8.3936 -8.3936 -7.0700 -7.0700 -7.0696 -7.0696 -4.1129 -4.1129 -4.1122 -4.1122 -2.2349 -2.2349 -2.2332 -2.2332 0.3583 0.3583 0.4443 0.4443 0.6834 0.6834 0.7839 0.7839 1.3192 1.3192 1.3325 1.3325 1.8691 1.8691 1.9127 1.9127 2.4140 2.4140 2.4459 2.4459 2.8052 2.8052 2.8218 2.8218 3.0230 3.0230 3.0797 3.0797 3.4007 3.4007 3.4419 3.4419 3.4682 3.4682 3.5349 3.5349 3.7689 3.7689 3.8021 3.8021 4.2855 4.2855 4.3340 4.3340 4.5300 4.5300 4.5365 4.5365 6.9703 6.9703 7.2711 7.2711 7.4314 7.4314 7.5107 7.5107 8.1391 8.1391 8.3283 8.3283 8.5654 8.5654 k = 0.1875-0.0000 0.2028 ( 12596 PWs) bands (ev): -9.4970 -9.4970 -9.4950 -9.4950 -9.1726 -9.1726 -9.1703 -9.1703 -8.3793 -8.3793 -8.3783 -8.3783 -7.0681 -7.0681 -7.0677 -7.0677 -4.1213 -4.1213 -4.1205 -4.1205 -2.2657 -2.2657 -2.2639 -2.2639 0.3303 0.3303 0.4140 0.4140 0.6595 0.6595 0.7584 0.7584 1.2695 1.2695 1.2787 1.2787 1.8061 1.8061 1.8565 1.8565 2.3970 2.3970 2.4045 2.4045 2.7715 2.7715 2.7876 2.7876 3.0419 3.0419 3.0939 3.0939 3.4064 3.4064 3.4563 3.4563 3.4753 3.4753 3.5478 3.5478 3.7700 3.7700 3.7920 3.7920 4.2751 4.2751 4.3295 4.3295 4.4988 4.4988 4.5010 4.5010 6.9883 6.9883 7.2869 7.2869 7.5017 7.5017 7.5675 7.5675 8.1609 8.1609 8.3576 8.3576 8.6399 8.6399 k = 0.2000-0.0000 0.2028 ( 12596 PWs) bands (ev): -9.4764 -9.4764 -9.4743 -9.4743 -9.1615 -9.1615 -9.1591 -9.1591 -8.3631 -8.3631 -8.3620 -8.3620 -7.0670 -7.0670 -7.0666 -7.0666 -4.1294 -4.1294 -4.1285 -4.1285 -2.2994 -2.2994 -2.2976 -2.2976 0.2999 0.2999 0.3777 0.3777 0.6436 0.6436 0.7375 0.7375 1.2196 1.2196 1.2248 1.2248 1.7450 1.7450 1.8018 1.8018 2.3627 2.3627 2.3783 2.3783 2.7365 2.7365 2.7497 2.7497 3.0652 3.0652 3.1098 3.1098 3.4118 3.4118 3.4658 3.4658 3.4845 3.4845 3.5576 3.5576 3.7701 3.7701 3.7829 3.7829 4.2600 4.2600 4.3252 4.3252 4.4588 4.4588 4.4746 4.4746 7.0071 7.0071 7.3028 7.3028 7.5686 7.5686 7.6189 7.6189 8.1795 8.1795 8.3870 8.3870 8.7084 8.7084 k = 0.2125-0.0000 0.2028 ( 12584 PWs) bands (ev): -9.4551 -9.4551 -9.4529 -9.4529 -9.1500 -9.1500 -9.1475 -9.1475 -8.3457 -8.3457 -8.3445 -8.3445 -7.0670 -7.0670 -7.0665 -7.0665 -4.1370 -4.1370 -4.1360 -4.1360 -2.3361 -2.3361 -2.3344 -2.3344 0.2681 0.2681 0.3384 0.3384 0.6329 0.6329 0.7199 0.7199 1.1703 1.1703 1.1717 1.1717 1.6861 1.6861 1.7491 1.7491 2.3213 2.3213 2.3580 2.3580 2.7030 2.7030 2.7113 2.7113 3.0895 3.0895 3.1252 3.1252 3.4156 3.4156 3.4689 3.4689 3.4963 3.4963 3.5638 3.5638 3.7699 3.7699 3.7767 3.7767 4.2383 4.2383 4.3189 4.3189 4.4195 4.4195 4.4534 4.4534 7.0267 7.0267 7.3200 7.3200 7.6285 7.6285 7.6633 7.6633 8.1952 8.1952 8.4165 8.4165 8.7633 8.7633 k = 0.2250-0.0000 0.2028 ( 12588 PWs) bands (ev): -9.4331 -9.4331 -9.4308 -9.4308 -9.1382 -9.1382 -9.1357 -9.1357 -8.3272 -8.3272 -8.3259 -8.3259 -7.0682 -7.0682 -7.0677 -7.0677 -4.1439 -4.1439 -4.1428 -4.1428 -2.3758 -2.3758 -2.3741 -2.3741 0.2359 0.2359 0.2983 0.2983 0.6244 0.6244 0.7040 0.7040 1.1204 1.1204 1.1222 1.1222 1.6299 1.6299 1.6988 1.6988 2.2809 2.2809 2.3362 2.3362 2.6720 2.6720 2.6735 2.6735 3.1136 3.1136 3.1386 3.1386 3.4169 3.4169 3.4673 3.4673 3.5083 3.5083 3.5668 3.5668 3.7699 3.7699 3.7739 3.7739 4.2091 4.2091 4.3041 4.3041 4.3884 4.3884 4.4392 4.4392 7.0472 7.0472 7.3387 7.3387 7.6793 7.6793 7.6997 7.6997 8.2084 8.2084 8.4455 8.4455 8.7949 8.7949 k = 0.2375-0.0000 0.2028 ( 12576 PWs) bands (ev): -9.4106 -9.4106 -9.4082 -9.4082 -9.1261 -9.1261 -9.1236 -9.1236 -8.3075 -8.3075 -8.3062 -8.3062 -7.0708 -7.0708 -7.0703 -7.0703 -4.1497 -4.1497 -4.1485 -4.1485 -2.4185 -2.4185 -2.4169 -2.4169 0.2043 0.2043 0.2590 0.2590 0.6162 0.6162 0.6882 0.6882 1.0720 1.0720 1.0765 1.0765 1.5767 1.5767 1.6511 1.6511 2.2424 2.2424 2.3135 2.3135 2.6362 2.6362 2.6438 2.6438 3.1365 3.1365 3.1492 3.1492 3.4150 3.4150 3.4626 3.4626 3.5192 3.5192 3.5682 3.5682 3.7701 3.7701 3.7738 3.7738 4.1731 4.1731 4.2724 4.2724 4.3747 4.3747 4.4321 4.4321 7.0682 7.0682 7.3589 7.3589 7.7196 7.7196 7.7276 7.7276 8.2188 8.2188 8.4732 8.4732 8.8051 8.8051 k = 0.2500-0.0000 0.2028 ( 12574 PWs) bands (ev): -9.3878 -9.3878 -9.3853 -9.3853 -9.1139 -9.1139 -9.1113 -9.1113 -8.2867 -8.2867 -8.2853 -8.2853 -7.0751 -7.0751 -7.0745 -7.0745 -4.1542 -4.1542 -4.1530 -4.1530 -2.4641 -2.4641 -2.4626 -2.4626 0.1738 0.1738 0.2215 0.2215 0.6066 0.6066 0.6712 0.6712 1.0277 1.0277 1.0341 1.0341 1.5268 1.5268 1.6062 1.6062 2.2065 2.2065 2.2905 2.2905 2.5993 2.5993 2.6176 2.6176 3.1564 3.1564 3.1579 3.1579 3.4104 3.4104 3.4557 3.4557 3.5282 3.5282 3.5693 3.5693 3.7700 3.7700 3.7747 3.7747 4.1324 4.1324 4.2282 4.2282 4.3751 4.3751 4.4314 4.4314 7.0897 7.0897 7.3804 7.3804 7.7472 7.7472 7.7490 7.7490 8.2260 8.2260 8.4982 8.4982 8.8039 8.8039 k = 0.2625-0.0000 0.2028 ( 12574 PWs) bands (ev): -9.3647 -9.3647 -9.3621 -9.3621 -9.1016 -9.1016 -9.0990 -9.0990 -8.2647 -8.2647 -8.2631 -8.2631 -7.0811 -7.0811 -7.0805 -7.0805 -4.1572 -4.1572 -4.1558 -4.1558 -2.5125 -2.5125 -2.5111 -2.5111 0.1450 0.1450 0.1862 0.1862 0.5945 0.5945 0.6515 0.6515 0.9887 0.9887 0.9961 0.9961 1.4804 1.4804 1.5643 1.5643 2.1738 2.1738 2.2683 2.2683 2.5625 2.5625 2.5926 2.5926 3.1594 3.1594 3.1772 3.1772 3.4047 3.4047 3.4480 3.4480 3.5350 3.5350 3.5707 3.5707 3.7692 3.7692 3.7748 3.7748 4.0896 4.0896 4.1791 4.1791 4.3830 4.3830 4.4359 4.4359 7.1113 7.1113 7.4027 7.4027 7.7593 7.7593 7.7676 7.7676 8.2291 8.2291 8.5189 8.5189 8.7972 8.7972 k = 0.2750-0.0000 0.2028 ( 12580 PWs) bands (ev): -9.3415 -9.3415 -9.3389 -9.3389 -9.0892 -9.0892 -9.0866 -9.0866 -8.2414 -8.2414 -8.2398 -8.2398 -7.0891 -7.0891 -7.0885 -7.0885 -4.1583 -4.1583 -4.1568 -4.1568 -2.5636 -2.5636 -2.5623 -2.5623 0.1180 0.1180 0.1533 0.1533 0.5788 0.5788 0.6281 0.6281 0.9558 0.9558 0.9633 0.9633 1.4378 1.4378 1.5254 1.5254 2.1447 2.1447 2.2475 2.2475 2.5253 2.5253 2.5677 2.5677 3.1581 3.1581 3.1939 3.1939 3.3993 3.3993 3.4407 3.4407 3.5389 3.5389 3.5719 3.5719 3.7671 3.7671 3.7726 3.7726 4.0473 4.0473 4.1289 4.1289 4.3955 4.3955 4.4448 4.4448 7.1327 7.1327 7.4257 7.4257 7.7649 7.7649 7.7766 7.7766 8.2270 8.2270 8.5339 8.5339 8.7874 8.7874 k = 0.2875-0.0000 0.2028 ( 12588 PWs) bands (ev): -9.3183 -9.3183 -9.3157 -9.3157 -9.0769 -9.0769 -9.0744 -9.0744 -8.2169 -8.2169 -8.2152 -8.2152 -7.0992 -7.0992 -7.0985 -7.0985 -4.1572 -4.1572 -4.1557 -4.1557 -2.6172 -2.6172 -2.6161 -2.6161 0.0931 0.0931 0.1230 0.1230 0.5590 0.5590 0.6005 0.6005 0.9294 0.9294 0.9363 0.9363 1.3991 1.3991 1.4898 1.4898 2.1197 2.1197 2.2288 2.2288 2.4877 2.4877 2.5421 2.5421 3.1527 3.1527 3.2073 3.2073 3.3956 3.3956 3.4351 3.4351 3.5394 3.5394 3.5714 3.5714 3.7635 3.7635 3.7676 3.7676 4.0077 4.0077 4.0799 4.0799 4.4115 4.4115 4.4573 4.4573 7.1539 7.1539 7.4490 7.4490 7.7650 7.7650 7.7775 7.7775 8.2187 8.2187 8.5414 8.5414 8.7759 8.7759 k = 0.3000-0.0000 0.2028 ( 12586 PWs) bands (ev): -9.2954 -9.2954 -9.2928 -9.2928 -9.0648 -9.0648 -9.0623 -9.0623 -8.1911 -8.1911 -8.1893 -8.1893 -7.1115 -7.1115 -7.1108 -7.1108 -4.1538 -4.1538 -4.1522 -4.1522 -2.6732 -2.6732 -2.6722 -2.6722 0.0703 0.0703 0.0953 0.0953 0.5351 0.5351 0.5692 0.5692 0.9093 0.9093 0.9154 0.9154 1.3645 1.3645 1.4573 1.4573 2.0987 2.0987 2.2124 2.2124 2.4495 2.4495 2.5152 2.5152 3.1441 3.1441 3.2167 3.2167 3.3939 3.3939 3.4321 3.4321 3.5360 3.5360 3.5675 3.5675 3.7582 3.7582 3.7601 3.7601 3.9725 3.9725 4.0338 4.0338 4.4301 4.4301 4.4727 4.4727 7.1745 7.1745 7.4723 7.4723 7.7610 7.7610 7.7720 7.7720 8.2038 8.2038 8.5398 8.5398 8.7637 8.7637 k = 0.3125-0.0000 0.2028 ( 12584 PWs) bands (ev): -9.2729 -9.2729 -9.2703 -9.2703 -9.0529 -9.0529 -9.0504 -9.0504 -8.1640 -8.1640 -8.1621 -8.1621 -7.1262 -7.1262 -7.1255 -7.1255 -4.1477 -4.1477 -4.1460 -4.1460 -2.7312 -2.7312 -2.7304 -2.7304 0.0495 0.0495 0.0700 0.0700 0.5078 0.5078 0.5350 0.5350 0.8946 0.8946 0.9000 0.9000 1.3342 1.3342 1.4282 1.4282 2.0818 2.0818 2.1986 2.1986 2.4110 2.4110 2.4866 2.4866 3.1330 3.1330 3.2214 3.2214 3.3937 3.3937 3.4323 3.4323 3.5283 3.5283 3.5585 3.5585 3.7512 3.7512 3.7519 3.7519 3.9428 3.9428 3.9923 3.9923 4.4510 4.4510 4.4905 4.4905 7.1944 7.1944 7.4952 7.4952 7.7537 7.7537 7.7618 7.7618 8.1824 8.1824 8.5277 8.5277 8.7512 8.7512 k = 0.3250-0.0000 0.2028 ( 12556 PWs) bands (ev): -9.2508 -9.2508 -9.2483 -9.2483 -9.0413 -9.0413 -9.0389 -9.0389 -8.1356 -8.1356 -8.1336 -8.1336 -7.1433 -7.1433 -7.1425 -7.1425 -4.1388 -4.1388 -4.1370 -4.1370 -2.7911 -2.7911 -2.7905 -2.7905 0.0305 0.0305 0.0470 0.0470 0.4779 0.4779 0.4991 0.4991 0.8843 0.8843 0.8895 0.8895 1.3082 1.3082 1.4024 1.4024 2.0688 2.0688 2.1870 2.1870 2.3726 2.3726 2.4566 2.4566 3.1203 3.1203 3.2210 3.2210 3.3941 3.3941 3.4354 3.4354 3.5165 3.5165 3.5438 3.5438 3.7422 3.7422 3.7450 3.7450 3.9183 3.9183 3.9567 3.9567 4.4734 4.4734 4.5101 4.5101 7.2135 7.2135 7.5173 7.5173 7.7444 7.7444 7.7485 7.7485 8.1553 8.1553 8.5046 8.5046 8.7386 8.7386 k = 0.3375-0.0000 0.2028 ( 12554 PWs) bands (ev): -9.2295 -9.2295 -9.2270 -9.2270 -9.0301 -9.0301 -9.0278 -9.0278 -8.1059 -8.1059 -8.1038 -8.1038 -7.1628 -7.1628 -7.1620 -7.1620 -4.1268 -4.1268 -4.1250 -4.1250 -2.8526 -2.8526 -2.8522 -2.8522 0.0134 0.0134 0.0262 0.0262 0.4466 0.4466 0.4627 0.4627 0.8773 0.8773 0.8830 0.8830 1.2865 1.2865 1.3797 1.3797 2.0592 2.0592 2.1772 2.1772 2.3347 2.3347 2.4256 2.4256 3.1064 3.1064 3.2155 3.2155 3.3937 3.3937 3.4404 3.4404 3.5020 3.5020 3.5246 3.5246 3.7312 3.7312 3.7407 3.7407 3.8985 3.8985 3.9280 3.9280 4.4969 4.4969 4.5310 4.5310 7.2318 7.2318 7.5379 7.5379 7.7337 7.7337 7.7337 7.7337 8.1235 8.1235 8.4717 8.4717 8.7259 8.7259 k = 0.3500-0.0000 0.2028 ( 12578 PWs) bands (ev): -9.2090 -9.2090 -9.2066 -9.2066 -9.0194 -9.0194 -9.0172 -9.0172 -8.0748 -8.0748 -8.0727 -8.0727 -7.1847 -7.1847 -7.1839 -7.1839 -4.1115 -4.1115 -4.1097 -4.1097 -2.9154 -2.9154 -2.9151 -2.9151 -0.0023 -0.0023 0.0073 0.0073 0.4148 0.4148 0.4268 0.4268 0.8730 0.8730 0.8797 0.8797 1.2691 1.2691 1.3602 1.3602 2.0526 2.0526 2.1687 2.1687 2.2979 2.2979 2.3944 2.3944 3.0912 3.0912 3.2049 3.2049 3.3910 3.3910 3.4443 3.4443 3.4877 3.4877 3.5041 3.5041 3.7183 3.7183 3.7389 3.7389 3.8826 3.8826 3.9065 3.9065 4.5209 4.5209 4.5526 4.5526 7.2491 7.2491 7.5564 7.5564 7.7187 7.7187 7.7223 7.7223 8.0883 8.0883 8.4316 8.4316 8.7123 8.7123 k = 0.3625-0.0000 0.2028 ( 12562 PWs) bands (ev): -9.1895 -9.1895 -9.1872 -9.1872 -9.0092 -9.0092 -9.0071 -9.0071 -8.0425 -8.0425 -8.0403 -8.0403 -7.2091 -7.2091 -7.2082 -7.2082 -4.0929 -4.0929 -4.0910 -4.0910 -2.9791 -2.9791 -2.9790 -2.9790 -0.0165 -0.0165 -0.0097 -0.0097 0.3836 0.3836 0.3922 0.3922 0.8707 0.8707 0.8788 0.8788 1.2555 1.2555 1.3434 1.3434 2.0485 2.0485 2.1605 2.1605 2.2632 2.2632 2.3640 2.3640 3.0746 3.0746 3.1894 3.1894 3.3844 3.3844 3.4409 3.4409 3.4806 3.4806 3.4860 3.4860 3.7041 3.7041 3.7387 3.7387 3.8699 3.8699 3.8916 3.8916 4.5450 4.5450 4.5743 4.5743 7.2657 7.2657 7.5715 7.5715 7.7053 7.7053 7.7109 7.7109 8.0513 8.0513 8.3871 8.3871 8.6981 8.6981 k = 0.3750-0.0000 0.2028 ( 12556 PWs) bands (ev): -9.1712 -9.1712 -9.1690 -9.1690 -8.9997 -8.9997 -8.9978 -8.9978 -8.0089 -8.0089 -8.0067 -8.0067 -7.2357 -7.2357 -7.2347 -7.2347 -4.0709 -4.0709 -4.0690 -4.0690 -3.0437 -3.0437 -3.0436 -3.0436 -0.0295 -0.0295 -0.0252 -0.0252 0.3536 0.3536 0.3595 0.3595 0.8701 0.8701 0.8798 0.8798 1.2455 1.2455 1.3290 1.3290 2.0463 2.0463 2.1516 2.1516 2.2311 2.2311 2.3356 2.3356 3.0564 3.0564 3.1693 3.1693 3.3736 3.3736 3.4280 3.4280 3.4732 3.4732 3.4828 3.4828 3.6899 3.6899 3.7390 3.7390 3.8603 3.8603 3.8822 3.8822 4.5687 4.5687 4.5956 4.5956 7.2816 7.2816 7.5818 7.5818 7.6948 7.6948 7.6997 7.6997 8.0141 8.0141 8.3403 8.3403 8.6852 8.6852 k = 0.3875-0.0000 0.2028 ( 12566 PWs) bands (ev): -9.1541 -9.1541 -9.1521 -9.1521 -8.9908 -8.9908 -8.9891 -8.9891 -7.9741 -7.9741 -7.9719 -7.9719 -7.2646 -7.2646 -7.2635 -7.2635 -4.0454 -4.0454 -4.0434 -4.0434 -3.1087 -3.1087 -3.1084 -3.1084 -0.0414 -0.0414 -0.0391 -0.0391 0.3255 0.3255 0.3293 0.3293 0.8711 0.8711 0.8823 0.8823 1.2385 1.2385 1.3164 1.3164 2.0453 2.0453 2.1414 2.1414 2.2027 2.2027 2.3102 2.3102 3.0367 3.0367 3.1453 3.1453 3.3600 3.3600 3.4120 3.4120 3.4655 3.4655 3.4880 3.4880 3.6773 3.6773 3.7388 3.7388 3.8537 3.8537 3.8766 3.8766 4.5916 4.5916 4.6162 4.6162 7.2971 7.2971 7.5858 7.5858 7.6884 7.6884 7.6890 7.6890 7.9786 7.9786 8.2929 8.2929 8.6731 8.6731 k = 0.4000-0.0000 0.2028 ( 12566 PWs) bands (ev): -9.1384 -9.1384 -9.1366 -9.1366 -8.9828 -8.9828 -8.9812 -8.9812 -7.9383 -7.9383 -7.9361 -7.9361 -7.2954 -7.2954 -7.2943 -7.2943 -4.0164 -4.0164 -4.0144 -4.0144 -3.1739 -3.1739 -3.1734 -3.1734 -0.0523 -0.0523 -0.0516 -0.0516 0.2996 0.2996 0.3019 0.3019 0.8735 0.8735 0.8861 0.8861 1.2339 1.2339 1.3053 1.3053 2.0453 2.0453 2.1294 2.1294 2.1785 2.1785 2.2882 2.2882 3.0161 3.0161 3.1186 3.1186 3.3460 3.3460 3.3961 3.3961 3.4614 3.4614 3.4923 3.4923 3.6677 3.6677 3.7377 3.7377 3.8498 3.8498 3.8736 3.8736 4.6134 4.6134 4.6355 4.6355 7.3124 7.3124 7.5838 7.5838 7.6789 7.6789 7.6851 7.6851 7.9469 7.9469 8.2463 8.2463 8.6615 8.6615 k = 0.4125-0.0000 0.2028 ( 12562 PWs) bands (ev): -9.1243 -9.1243 -9.1226 -9.1226 -8.9755 -8.9755 -8.9741 -8.9741 -7.9015 -7.9015 -7.8994 -7.8994 -7.3280 -7.3280 -7.3268 -7.3268 -3.9840 -3.9840 -3.9820 -3.9820 -3.2388 -3.2388 -3.2381 -3.2381 -0.0627 -0.0627 -0.0622 -0.0622 0.2763 0.2763 0.2775 0.2775 0.8773 0.8773 0.8908 0.8908 1.2311 1.2311 1.2949 1.2949 2.0458 2.0458 2.1161 2.1161 2.1591 2.1591 2.2693 2.2693 2.9958 2.9958 3.0904 3.0904 3.3334 3.3334 3.3813 3.3813 3.4594 3.4594 3.4941 3.4941 3.6621 3.6621 3.7355 3.7355 3.8483 3.8483 3.8721 3.8721 4.6336 4.6336 4.6533 4.6533 7.3280 7.3280 7.5772 7.5772 7.6695 7.6695 7.6820 7.6820 7.9216 7.9216 8.2012 8.2012 8.6506 8.6506 k = 0.4250-0.0000 0.2028 ( 12566 PWs) bands (ev): -9.1118 -9.1118 -9.1103 -9.1103 -8.9691 -8.9691 -8.9679 -8.9679 -7.8640 -7.8640 -7.8619 -7.8619 -7.3621 -7.3621 -7.3608 -7.3608 -3.9482 -3.9482 -3.9462 -3.9462 -3.3032 -3.3032 -3.3024 -3.3024 -0.0724 -0.0724 -0.0712 -0.0712 0.2558 0.2558 0.2562 0.2562 0.8824 0.8824 0.8961 0.8961 1.2295 1.2295 1.2849 1.2849 2.0467 2.0467 2.1023 2.1023 2.1446 2.1446 2.2525 2.2525 2.9768 2.9768 3.0621 3.0621 3.3230 3.3230 3.3674 3.3674 3.4586 3.4586 3.4933 3.4933 3.6607 3.6607 3.7321 3.7321 3.8488 3.8488 3.8715 3.8715 4.6520 4.6520 4.6692 4.6692 7.3441 7.3441 7.5678 7.5678 7.6607 7.6607 7.6760 7.6760 7.9049 7.9049 8.1582 8.1582 8.6404 8.6404 k = 0.4375-0.0000 0.2028 ( 12558 PWs) bands (ev): -9.1009 -9.1009 -9.0997 -9.0997 -8.9637 -8.9637 -8.9627 -8.9627 -7.8261 -7.8261 -7.8240 -7.8240 -7.3973 -7.3973 -7.3960 -7.3960 -3.9091 -3.9091 -3.9072 -3.9072 -3.3667 -3.3667 -3.3658 -3.3658 -0.0807 -0.0807 -0.0791 -0.0791 0.2382 0.2382 0.2383 0.2383 0.8883 0.8883 0.9016 0.9016 1.2286 1.2286 1.2752 1.2752 2.0481 2.0481 2.0893 2.0893 2.1350 2.1350 2.2366 2.2366 2.9605 2.9605 3.0349 3.0349 3.3149 3.3149 3.3545 3.3545 3.4586 3.4586 3.4903 3.4903 3.6630 3.6630 3.7279 3.7279 3.8507 3.8507 3.8711 3.8711 4.6683 4.6683 4.6828 4.6828 7.3611 7.3611 7.5564 7.5564 7.6526 7.6526 7.6661 7.6661 7.8978 7.8978 8.1180 8.1180 8.6311 8.6311 k = 0.4500-0.0000 0.2028 ( 12558 PWs) bands (ev): -9.0920 -9.0920 -9.0909 -9.0909 -8.9592 -8.9592 -8.9584 -8.9584 -7.7881 -7.7881 -7.7862 -7.7862 -7.4331 -7.4331 -7.4318 -7.4318 -3.8670 -3.8670 -3.8651 -3.8651 -3.4291 -3.4291 -3.4280 -3.4280 -0.0876 -0.0876 -0.0859 -0.0859 0.2235 0.2235 0.2238 0.2238 0.8949 0.8949 0.9068 0.9068 1.2284 1.2284 1.2656 1.2656 2.0499 2.0499 2.0780 2.0780 2.1302 2.1302 2.2208 2.2208 2.9479 2.9479 3.0099 3.0099 3.3091 3.3091 3.3424 3.3424 3.4594 3.4594 3.4861 3.4861 3.6679 3.6679 3.7230 3.7230 3.8533 3.8533 3.8707 3.8707 4.6823 4.6823 4.6940 4.6940 7.3792 7.3792 7.5429 7.5429 7.6452 7.6452 7.6538 7.6538 7.8996 7.8996 8.0806 8.0806 8.6230 8.6230 k = 0.4625-0.0000 0.2028 ( 12554 PWs) bands (ev): -9.0849 -9.0849 -9.0841 -9.0841 -8.9556 -8.9556 -8.9550 -8.9550 -7.7510 -7.7510 -7.7492 -7.7492 -7.4686 -7.4686 -7.4673 -7.4673 -3.8220 -3.8220 -3.8201 -3.8201 -3.4900 -3.4900 -3.4888 -3.4888 -0.0929 -0.0929 -0.0914 -0.0914 0.2121 0.2121 0.2125 0.2125 0.9014 0.9014 0.9112 0.9112 1.2287 1.2287 1.2565 1.2565 2.0518 2.0518 2.0692 2.0692 2.1302 2.1302 2.2046 2.2046 2.9398 2.9398 2.9878 2.9878 3.3055 3.3055 3.3315 3.3315 3.4608 3.4608 3.4814 3.4814 3.6745 3.6745 3.7174 3.7174 3.8564 3.8564 3.8700 3.8700 4.6937 4.6937 4.7026 4.7026 7.3987 7.3987 7.5268 7.5268 7.6386 7.6386 7.6421 7.6421 7.9085 7.9085 8.0464 8.0464 8.6165 8.6165 k = 0.4750-0.0000 0.2028 ( 12554 PWs) bands (ev): -9.0797 -9.0797 -9.0792 -9.0792 -8.9531 -8.9531 -8.9526 -8.9526 -7.7164 -7.7164 -7.7148 -7.7148 -7.5020 -7.5020 -7.5008 -7.5008 -3.7747 -3.7747 -3.7729 -3.7729 -3.5487 -3.5487 -3.5474 -3.5474 -0.0967 -0.0967 -0.0956 -0.0956 0.2040 0.2040 0.2043 0.2043 0.9072 0.9072 0.9143 0.9143 1.2298 1.2298 1.2482 1.2482 2.0535 2.0535 2.0629 2.0629 2.1348 2.1348 2.1880 2.1880 2.9363 2.9363 2.9692 2.9692 3.3042 3.3042 3.3220 3.3220 3.4628 3.4628 3.4768 3.4768 3.6820 3.6820 3.7112 3.7112 3.8595 3.8595 3.8688 3.8688 4.7025 4.7025 4.7084 4.7084 7.4195 7.4195 7.5078 7.5078 7.6331 7.6331 7.6334 7.6334 7.9226 7.9226 8.0153 8.0153 8.6118 8.6118 k = 0.4875-0.0000 0.2028 ( 12548 PWs) bands (ev): -9.0765 -9.0765 -9.0763 -9.0763 -8.9515 -8.9515 -8.9513 -8.9513 -7.6883 -7.6883 -7.6873 -7.6873 -7.5290 -7.5290 -7.5281 -7.5281 -3.7267 -3.7267 -3.7251 -3.7251 -3.6034 -3.6034 -3.6021 -3.6021 -0.0989 -0.0989 -0.0983 -0.0983 0.1992 0.1992 0.1994 0.1994 0.9118 0.9118 0.9155 0.9155 1.2321 1.2321 1.2413 1.2413 2.0549 2.0549 2.0588 2.0588 2.1439 2.1439 2.1717 2.1717 2.9377 2.9377 2.9544 2.9544 3.3053 3.3053 3.3143 3.3143 3.4654 3.4654 3.4725 3.4725 3.6897 3.6897 3.7045 3.7045 3.8624 3.8624 3.8672 3.8672 4.7083 4.7083 4.7113 4.7113 7.4414 7.4414 7.4865 7.4865 7.6286 7.6286 7.6292 7.6292 7.9408 7.9408 7.9873 7.9873 8.6089 8.6089 k = 0.5000-0.0000 0.2028 ( 12540 PWs) bands (ev): -9.0754 -9.0754 -9.0754 -9.0754 -8.9509 -8.9509 -8.9509 -8.9509 -7.6760 -7.6760 -7.6760 -7.6760 -7.5402 -7.5402 -7.5402 -7.5402 -3.6936 -3.6936 -3.6936 -3.6936 -3.6374 -3.6374 -3.6374 -3.6374 -0.0994 -0.0994 -0.0994 -0.0994 0.1977 0.1977 0.1977 0.1977 0.9147 0.9147 0.9147 0.9147 1.2359 1.2359 1.2359 1.2359 2.0564 2.0564 2.0564 2.0564 2.1566 2.1566 2.1566 2.1566 2.9438 2.9438 2.9438 2.9438 3.3087 3.3087 3.3087 3.3087 3.4687 3.4687 3.4687 3.4687 3.6973 3.6973 3.6973 3.6973 3.8650 3.8650 3.8650 3.8650 4.7113 4.7113 4.7113 4.7113 7.4640 7.4640 7.4640 7.4640 7.6275 7.6275 7.6275 7.6275 7.9625 7.9625 7.9625 7.9625 8.6080 8.6080 k = 0.5000-0.0000 0.2028 ( 12540 PWs) bands (ev): -9.0754 -9.0754 -9.0754 -9.0754 -8.9509 -8.9509 -8.9509 -8.9509 -7.6760 -7.6760 -7.6760 -7.6760 -7.5402 -7.5402 -7.5402 -7.5402 -3.6936 -3.6936 -3.6936 -3.6936 -3.6374 -3.6374 -3.6374 -3.6374 -0.0994 -0.0994 -0.0994 -0.0994 0.1977 0.1977 0.1977 0.1977 0.9147 0.9147 0.9147 0.9147 1.2359 1.2359 1.2359 1.2359 2.0564 2.0564 2.0564 2.0564 2.1566 2.1566 2.1566 2.1566 2.9438 2.9438 2.9438 2.9438 3.3087 3.3087 3.3087 3.3087 3.4687 3.4687 3.4687 3.4687 3.6973 3.6973 3.6973 3.6973 3.8650 3.8650 3.8650 3.8650 4.7113 4.7113 4.7113 4.7113 7.4640 7.4640 7.4640 7.4640 7.6275 7.6275 7.6275 7.6275 7.9625 7.9625 7.9625 7.9625 8.6080 8.6080 k = 0.5000 0.0120 0.2028 ( 12548 PWs) bands (ev): -9.0752 -9.0752 -9.0752 -9.0752 -8.9511 -8.9511 -8.9511 -8.9511 -7.6758 -7.6758 -7.6758 -7.6758 -7.5404 -7.5404 -7.5404 -7.5404 -3.6935 -3.6935 -3.6935 -3.6935 -3.6375 -3.6375 -3.6375 -3.6375 -0.0992 -0.0992 -0.0992 -0.0992 0.1970 0.1970 0.1970 0.1970 0.9157 0.9157 0.9157 0.9157 1.2361 1.2361 1.2361 1.2361 2.0580 2.0580 2.0580 2.0580 2.1588 2.1588 2.1588 2.1588 2.9416 2.9416 2.9416 2.9416 3.2989 3.2989 3.2989 3.2989 3.4757 3.4757 3.4757 3.4757 3.6974 3.6974 3.6974 3.6974 3.8649 3.8649 3.8649 3.8649 4.7088 4.7088 4.7088 4.7088 7.4642 7.4642 7.4642 7.4642 7.6282 7.6282 7.6282 7.6282 7.9667 7.9667 7.9667 7.9667 8.6089 8.6089 k = 0.5000 0.0241 0.2028 ( 12556 PWs) bands (ev): -9.0746 -9.0746 -9.0746 -9.0746 -8.9516 -8.9516 -8.9516 -8.9516 -7.6752 -7.6752 -7.6752 -7.6752 -7.5410 -7.5410 -7.5410 -7.5410 -3.6933 -3.6933 -3.6933 -3.6933 -3.6378 -3.6378 -3.6378 -3.6378 -0.0986 -0.0986 -0.0986 -0.0986 0.1951 0.1951 0.1951 0.1951 0.9187 0.9187 0.9187 0.9187 1.2366 1.2366 1.2366 1.2366 2.0628 2.0628 2.0628 2.0628 2.1653 2.1653 2.1653 2.1653 2.9350 2.9350 2.9350 2.9350 3.2741 3.2741 3.2741 3.2741 3.4921 3.4921 3.4921 3.4921 3.6978 3.6978 3.6978 3.6978 3.8646 3.8646 3.8646 3.8646 4.7014 4.7014 4.7014 4.7014 7.4650 7.4650 7.4650 7.4650 7.6303 7.6303 7.6303 7.6303 7.9793 7.9793 7.9793 7.9793 8.6116 8.6116 k = 0.5000 0.0361 0.2028 ( 12572 PWs) bands (ev): -9.0737 -9.0737 -9.0737 -9.0737 -8.9526 -8.9526 -8.9526 -8.9526 -7.6742 -7.6742 -7.6742 -7.6742 -7.5421 -7.5421 -7.5421 -7.5421 -3.6930 -3.6930 -3.6930 -3.6930 -3.6383 -3.6383 -3.6383 -3.6383 -0.0976 -0.0976 -0.0976 -0.0976 0.1918 0.1918 0.1918 0.1918 0.9237 0.9237 0.9237 0.9237 1.2378 1.2378 1.2378 1.2378 2.0704 2.0704 2.0704 2.0704 2.1757 2.1757 2.1757 2.1757 2.9242 2.9242 2.9242 2.9242 3.2418 3.2418 3.2418 3.2418 3.5105 3.5105 3.5105 3.5105 3.6984 3.6984 3.6984 3.6984 3.8644 3.8644 3.8644 3.8644 4.6891 4.6891 4.6891 4.6891 7.4667 7.4667 7.4667 7.4667 7.6338 7.6338 7.6338 7.6338 7.9999 7.9999 7.9999 7.9999 8.6156 8.6156 k = 0.5000 0.0481 0.2028 ( 12556 PWs) bands (ev): -9.0724 -9.0724 -9.0724 -9.0724 -8.9540 -8.9540 -8.9540 -8.9540 -7.6728 -7.6728 -7.6728 -7.6728 -7.5436 -7.5436 -7.5436 -7.5436 -3.6925 -3.6925 -3.6925 -3.6925 -3.6389 -3.6389 -3.6389 -3.6389 -0.0963 -0.0963 -0.0963 -0.0963 0.1872 0.1872 0.1872 0.1872 0.9307 0.9307 0.9307 0.9307 1.2395 1.2395 1.2395 1.2395 2.0804 2.0804 2.0804 2.0804 2.1898 2.1898 2.1898 2.1898 2.9096 2.9096 2.9096 2.9096 3.2067 3.2067 3.2067 3.2067 3.5259 3.5259 3.5259 3.5259 3.6994 3.6994 3.6994 3.6994 3.8647 3.8647 3.8647 3.8647 4.6724 4.6724 4.6724 4.6724 7.4698 7.4698 7.4698 7.4698 7.6387 7.6387 7.6387 7.6387 8.0279 8.0279 8.0279 8.0279 8.6205 8.6205 k = 0.5000 0.0601 0.2028 ( 12544 PWs) bands (ev): -9.0708 -9.0708 -9.0708 -9.0708 -8.9557 -8.9557 -8.9557 -8.9557 -7.6711 -7.6711 -7.6711 -7.6711 -7.5456 -7.5456 -7.5456 -7.5456 -3.6919 -3.6919 -3.6919 -3.6919 -3.6398 -3.6398 -3.6398 -3.6398 -0.0945 -0.0945 -0.0945 -0.0945 0.1813 0.1813 0.1813 0.1813 0.9398 0.9398 0.9398 0.9398 1.2421 1.2421 1.2421 1.2421 2.0922 2.0922 2.0922 2.0922 2.2068 2.2068 2.2068 2.2068 2.8917 2.8917 2.8917 2.8917 3.1718 3.1718 3.1718 3.1718 3.5359 3.5359 3.5359 3.5359 3.7002 3.7002 3.7002 3.7002 3.8664 3.8664 3.8664 3.8664 4.6516 4.6516 4.6516 4.6516 7.4747 7.4747 7.4747 7.4747 7.6453 7.6453 7.6453 7.6453 8.0623 8.0623 8.0623 8.0623 8.6254 8.6254 k = 0.5000 0.0722 0.2028 ( 12544 PWs) bands (ev): -9.0688 -9.0688 -9.0688 -9.0688 -8.9578 -8.9578 -8.9578 -8.9578 -7.6690 -7.6690 -7.6690 -7.6690 -7.5479 -7.5479 -7.5479 -7.5479 -3.6911 -3.6911 -3.6911 -3.6911 -3.6409 -3.6409 -3.6409 -3.6409 -0.0922 -0.0922 -0.0922 -0.0922 0.1742 0.1742 0.1742 0.1742 0.9509 0.9509 0.9509 0.9509 1.2457 1.2457 1.2457 1.2457 2.1050 2.1050 2.1050 2.1050 2.2261 2.2261 2.2261 2.2261 2.8715 2.8715 2.8715 2.8715 3.1389 3.1389 3.1389 3.1389 3.5392 3.5392 3.5392 3.5392 3.6997 3.6997 3.6997 3.6997 3.8702 3.8702 3.8702 3.8702 4.6270 4.6270 4.6270 4.6270 7.4817 7.4817 7.4817 7.4817 7.6537 7.6537 7.6537 7.6537 8.1022 8.1022 8.1022 8.1022 8.6300 8.6300 k = 0.5000 0.0842 0.2028 ( 12532 PWs) bands (ev): -9.0664 -9.0664 -9.0664 -9.0664 -8.9602 -8.9602 -8.9602 -8.9602 -7.6665 -7.6665 -7.6665 -7.6665 -7.5506 -7.5506 -7.5506 -7.5506 -3.6902 -3.6902 -3.6902 -3.6902 -3.6421 -3.6421 -3.6421 -3.6421 -0.0895 -0.0895 -0.0895 -0.0895 0.1658 0.1658 0.1658 0.1658 0.9641 0.9641 0.9641 0.9641 1.2504 1.2504 1.2504 1.2504 2.1179 2.1179 2.1179 2.1179 2.2465 2.2465 2.2465 2.2465 2.8500 2.8500 2.8500 2.8500 3.1097 3.1097 3.1097 3.1097 3.5360 3.5360 3.5360 3.5360 3.6966 3.6966 3.6966 3.6966 3.8768 3.8768 3.8768 3.8768 4.5992 4.5992 4.5992 4.5992 7.4910 7.4910 7.4910 7.4910 7.6640 7.6640 7.6640 7.6640 8.1465 8.1465 8.1465 8.1465 8.6337 8.6337 k = 0.5000 0.0962 0.2028 ( 12544 PWs) bands (ev): -9.0638 -9.0638 -9.0638 -9.0638 -8.9630 -8.9630 -8.9630 -8.9630 -7.6636 -7.6636 -7.6636 -7.6636 -7.5537 -7.5537 -7.5537 -7.5537 -3.6892 -3.6892 -3.6892 -3.6892 -3.6434 -3.6434 -3.6434 -3.6434 -0.0863 -0.0863 -0.0863 -0.0863 0.1563 0.1563 0.1563 0.1563 0.9793 0.9793 0.9793 0.9793 1.2560 1.2560 1.2560 1.2560 2.1299 2.1299 2.1299 2.1299 2.2668 2.2668 2.2668 2.2668 2.8289 2.8289 2.8289 2.8289 3.0855 3.0855 3.0855 3.0855 3.5267 3.5267 3.5267 3.5267 3.6896 3.6896 3.6896 3.6896 3.8867 3.8867 3.8867 3.8867 4.5686 4.5686 4.5686 4.5686 7.5028 7.5028 7.5028 7.5028 7.6765 7.6765 7.6765 7.6765 8.1936 8.1936 8.1936 8.1936 8.6365 8.6365 k = 0.5000 0.1082 0.2028 ( 12560 PWs) bands (ev): -9.0608 -9.0608 -9.0608 -9.0608 -8.9661 -8.9661 -8.9661 -8.9661 -7.6604 -7.6604 -7.6604 -7.6604 -7.5571 -7.5571 -7.5571 -7.5571 -3.6880 -3.6880 -3.6880 -3.6880 -3.6450 -3.6450 -3.6450 -3.6450 -0.0826 -0.0826 -0.0826 -0.0826 0.1458 0.1458 0.1458 0.1458 0.9965 0.9965 0.9965 0.9965 1.2627 1.2627 1.2627 1.2627 2.1400 2.1400 2.1400 2.1400 2.2855 2.2855 2.2855 2.2855 2.8103 2.8103 2.8103 2.8103 3.0671 3.0671 3.0671 3.0671 3.5120 3.5120 3.5120 3.5120 3.6780 3.6780 3.6780 3.6780 3.8997 3.8997 3.8997 3.8997 4.5359 4.5359 4.5359 4.5359 7.5169 7.5169 7.5169 7.5169 7.6910 7.6910 7.6910 7.6910 8.2423 8.2423 8.2423 8.2423 8.6386 8.6386 k = 0.5000 0.1203 0.2028 ( 12548 PWs) bands (ev): -9.0575 -9.0575 -9.0575 -9.0575 -8.9695 -8.9695 -8.9695 -8.9695 -7.6570 -7.6570 -7.6570 -7.6570 -7.5609 -7.5609 -7.5609 -7.5609 -3.6867 -3.6867 -3.6867 -3.6867 -3.6466 -3.6466 -3.6466 -3.6466 -0.0783 -0.0783 -0.0783 -0.0783 0.1343 0.1343 0.1343 0.1343 1.0155 1.0155 1.0155 1.0155 1.2700 1.2700 1.2700 1.2700 2.1475 2.1475 2.1475 2.1475 2.3009 2.3009 2.3009 2.3009 2.7962 2.7962 2.7962 2.7962 3.0554 3.0554 3.0554 3.0554 3.4926 3.4926 3.4926 3.4926 3.6617 3.6617 3.6617 3.6617 3.9151 3.9151 3.9151 3.9151 4.5014 4.5014 4.5014 4.5014 7.5331 7.5331 7.5331 7.5331 7.7075 7.7075 7.7075 7.7075 8.2910 8.2910 8.2910 8.2910 8.6406 8.6406 k = 0.5000 0.1323 0.2028 ( 12556 PWs) bands (ev): -9.0540 -9.0540 -9.0540 -9.0540 -8.9731 -8.9731 -8.9731 -8.9731 -7.6532 -7.6532 -7.6532 -7.6532 -7.5649 -7.5649 -7.5649 -7.5649 -3.6853 -3.6853 -3.6853 -3.6853 -3.6484 -3.6484 -3.6484 -3.6484 -0.0733 -0.0733 -0.0733 -0.0733 0.1221 0.1221 0.1221 0.1221 1.0362 1.0362 1.0362 1.0362 1.2777 1.2777 1.2777 1.2777 2.1520 2.1520 2.1520 2.1520 2.3111 2.3111 2.3111 2.3111 2.7892 2.7892 2.7892 2.7892 3.0509 3.0509 3.0509 3.0509 3.4689 3.4689 3.4689 3.4689 3.6411 3.6411 3.6411 3.6411 3.9326 3.9326 3.9326 3.9326 4.4658 4.4658 4.4658 4.4658 7.5510 7.5510 7.5510 7.5510 7.7254 7.7254 7.7254 7.7254 8.3378 8.3378 8.3378 8.3378 8.6436 8.6436 k = 0.5000 0.1443 0.2028 ( 12552 PWs) bands (ev): -9.0502 -9.0502 -9.0502 -9.0502 -8.9770 -8.9770 -8.9770 -8.9770 -7.6491 -7.6491 -7.6491 -7.6491 -7.5692 -7.5692 -7.5692 -7.5692 -3.6838 -3.6838 -3.6838 -3.6838 -3.6503 -3.6503 -3.6503 -3.6503 -0.0677 -0.0677 -0.0677 -0.0677 0.1093 0.1093 0.1093 0.1093 1.0583 1.0583 1.0583 1.0583 1.2852 1.2852 1.2852 1.2852 2.1534 2.1534 2.1534 2.1534 2.3146 2.3146 2.3146 2.3146 2.7909 2.7909 2.7909 2.7909 3.0537 3.0537 3.0537 3.0537 3.4416 3.4416 3.4416 3.4416 3.6166 3.6166 3.6166 3.6166 3.9517 3.9517 3.9517 3.9517 4.4296 4.4296 4.4296 4.4296 7.5703 7.5703 7.5703 7.5703 7.7441 7.7441 7.7441 7.7441 8.3809 8.3809 8.3809 8.3809 8.6487 8.6487 k = 0.5000 0.1563 0.2028 ( 12560 PWs) bands (ev): -9.0462 -9.0462 -9.0462 -9.0462 -8.9811 -8.9811 -8.9811 -8.9811 -7.6448 -7.6448 -7.6448 -7.6448 -7.5738 -7.5738 -7.5738 -7.5738 -3.6821 -3.6821 -3.6821 -3.6821 -3.6523 -3.6523 -3.6523 -3.6523 -0.0614 -0.0614 -0.0614 -0.0614 0.0960 0.0960 0.0960 0.0960 1.0816 1.0816 1.0816 1.0816 1.2920 1.2920 1.2920 1.2920 2.1523 2.1523 2.1523 2.1523 2.3109 2.3109 2.3109 2.3109 2.8022 2.8022 2.8022 2.8022 3.0631 3.0631 3.0631 3.0631 3.4112 3.4112 3.4112 3.4112 3.5886 3.5886 3.5886 3.5886 3.9722 3.9722 3.9722 3.9722 4.3931 4.3931 4.3931 4.3931 7.5903 7.5903 7.5903 7.5903 7.7630 7.7630 7.7630 7.7630 8.4187 8.4187 8.4187 8.4187 8.6571 8.6571 k = 0.5000 0.1684 0.2028 ( 12568 PWs) bands (ev): -9.0420 -9.0420 -9.0420 -9.0420 -8.9854 -8.9854 -8.9854 -8.9854 -7.6403 -7.6403 -7.6403 -7.6403 -7.5785 -7.5785 -7.5785 -7.5785 -3.6803 -3.6803 -3.6803 -3.6803 -3.6544 -3.6544 -3.6544 -3.6544 -0.0544 -0.0544 -0.0544 -0.0544 0.0824 0.0824 0.0824 0.0824 1.1056 1.1056 1.1056 1.1056 1.2973 1.2973 1.2973 1.2973 2.1499 2.1499 2.1499 2.1499 2.3005 2.3005 2.3005 2.3005 2.8227 2.8227 2.8227 2.8227 3.0780 3.0780 3.0780 3.0780 3.3787 3.3787 3.3787 3.3787 3.5576 3.5576 3.5576 3.5576 3.9938 3.9938 3.9938 3.9938 4.3567 4.3567 4.3567 4.3567 7.6104 7.6104 7.6104 7.6104 7.7810 7.7810 7.7810 7.7810 8.4501 8.4501 8.4501 8.4501 8.6689 8.6689 k = 0.5000 0.1804 0.2028 ( 12576 PWs) bands (ev): -9.0376 -9.0376 -9.0376 -9.0376 -8.9899 -8.9899 -8.9899 -8.9899 -7.6355 -7.6355 -7.6355 -7.6355 -7.5835 -7.5835 -7.5835 -7.5835 -3.6785 -3.6785 -3.6785 -3.6785 -3.6566 -3.6566 -3.6566 -3.6566 -0.0466 -0.0466 -0.0466 -0.0466 0.0687 0.0687 0.0687 0.0687 1.1298 1.1298 1.1298 1.1298 1.3007 1.3007 1.3007 1.3007 2.1473 2.1473 2.1473 2.1473 2.2851 2.2851 2.2851 2.2851 2.8511 2.8511 2.8511 2.8511 3.0964 3.0964 3.0964 3.0964 3.3457 3.3457 3.3457 3.3457 3.5241 3.5241 3.5241 3.5241 4.0165 4.0165 4.0165 4.0165 4.3210 4.3210 4.3210 4.3210 7.6299 7.6299 7.6299 7.6299 7.7971 7.7971 7.7971 7.7971 8.4754 8.4754 8.4754 8.4754 8.6830 8.6830 k = 0.5000 0.1924 0.2028 ( 12592 PWs) bands (ev): -9.0330 -9.0330 -9.0330 -9.0330 -8.9945 -8.9945 -8.9945 -8.9945 -7.6306 -7.6306 -7.6306 -7.6306 -7.5886 -7.5886 -7.5886 -7.5886 -3.6765 -3.6765 -3.6765 -3.6765 -3.6588 -3.6588 -3.6588 -3.6588 -0.0380 -0.0380 -0.0380 -0.0380 0.0551 0.0551 0.0551 0.0551 1.1535 1.1535 1.1535 1.1535 1.3015 1.3015 1.3015 1.3015 2.1458 2.1458 2.1458 2.1458 2.2665 2.2665 2.2665 2.2665 2.8856 2.8856 2.8856 2.8856 3.1145 3.1145 3.1145 3.1145 3.3155 3.3155 3.3155 3.3155 3.4887 3.4887 3.4887 3.4887 4.0402 4.0402 4.0402 4.0402 4.2861 4.2861 4.2861 4.2861 7.6479 7.6479 7.6479 7.6479 7.8106 7.8106 7.8106 7.8106 8.4957 8.4957 8.4957 8.4957 8.6972 8.6972 k = 0.5000 0.2044 0.2028 ( 12584 PWs) bands (ev): -9.0284 -9.0284 -9.0284 -9.0284 -8.9993 -8.9993 -8.9993 -8.9993 -7.6255 -7.6255 -7.6255 -7.6255 -7.5938 -7.5938 -7.5938 -7.5938 -3.6745 -3.6745 -3.6745 -3.6745 -3.6610 -3.6610 -3.6610 -3.6610 -0.0287 -0.0287 -0.0287 -0.0287 0.0417 0.0417 0.0417 0.0417 1.1758 1.1758 1.1758 1.1758 1.2996 1.2996 1.2996 1.2996 2.1464 2.1464 2.1464 2.1464 2.2468 2.2468 2.2468 2.2468 2.9241 2.9241 2.9241 2.9241 3.1253 3.1253 3.1253 3.1253 3.2944 3.2944 3.2944 3.2944 3.4521 3.4521 3.4521 3.4521 4.0648 4.0648 4.0648 4.0648 4.2526 4.2526 4.2526 4.2526 7.6636 7.6636 7.6636 7.6636 7.8210 7.8210 7.8210 7.8210 8.5121 8.5121 8.5121 8.5121 8.7091 8.7091 k = 0.5000 0.2165 0.2028 ( 12576 PWs) bands (ev): -9.0236 -9.0236 -9.0236 -9.0236 -9.0041 -9.0041 -9.0041 -9.0041 -7.6203 -7.6203 -7.6203 -7.6203 -7.5990 -7.5990 -7.5990 -7.5990 -3.6724 -3.6724 -3.6724 -3.6724 -3.6633 -3.6633 -3.6633 -3.6633 -0.0186 -0.0186 -0.0186 -0.0186 0.0285 0.0285 0.0285 0.0285 1.1952 1.1952 1.1952 1.1952 1.2954 1.2954 1.2954 1.2954 2.1494 2.1494 2.1494 2.1494 2.2283 2.2283 2.2283 2.2283 2.9646 2.9646 2.9646 2.9646 3.1199 3.1199 3.1199 3.1199 3.2910 3.2910 3.2910 3.2910 3.4155 3.4155 3.4155 3.4155 4.0898 4.0898 4.0898 4.0898 4.2210 4.2210 4.2210 4.2210 7.6758 7.6758 7.6758 7.6758 7.8281 7.8281 7.8281 7.8281 8.5248 8.5248 8.5248 8.5248 8.7172 8.7172 k = 0.5000 0.2285 0.2028 ( 12572 PWs) bands (ev): -9.0187 -9.0187 -9.0187 -9.0187 -9.0090 -9.0090 -9.0090 -9.0090 -7.6151 -7.6151 -7.6151 -7.6151 -7.6044 -7.6044 -7.6044 -7.6044 -3.6702 -3.6702 -3.6702 -3.6702 -3.6655 -3.6655 -3.6655 -3.6655 -0.0078 -0.0078 -0.0078 -0.0078 0.0159 0.0159 0.0159 0.0159 1.2093 1.2093 1.2093 1.2093 1.2907 1.2907 1.2907 1.2907 2.1537 2.1537 2.1537 2.1537 2.2140 2.2140 2.2140 2.2140 3.0033 3.0033 3.0033 3.0033 3.0987 3.0987 3.0987 3.0987 3.3051 3.3051 3.3051 3.3051 3.3813 3.3813 3.3813 3.3813 4.1136 4.1136 4.1136 4.1136 4.1933 4.1933 4.1933 4.1933 7.6837 7.6837 7.6837 7.6837 7.8322 7.8322 7.8322 7.8322 8.5332 8.5332 8.5332 8.5332 8.7215 8.7215 k = 0.5000 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0136 -9.0136 -9.0136 -9.0136 -7.6103 -7.6103 -7.6103 -7.6103 -7.6091 -7.6091 -7.6091 -7.6091 -3.6687 -3.6687 -3.6687 -3.6687 -3.6671 -3.6671 -3.6671 -3.6671 0.0028 0.0028 0.0028 0.0028 0.0046 0.0046 0.0046 0.0046 1.2148 1.2148 1.2148 1.2148 1.2885 1.2885 1.2885 1.2885 2.1561 2.1561 2.1561 2.1561 2.2082 2.2082 2.2082 2.2082 3.0257 3.0257 3.0257 3.0257 3.0813 3.0813 3.0813 3.0813 3.3193 3.3193 3.3193 3.3193 3.3614 3.3614 3.3614 3.3614 4.1266 4.1266 4.1266 4.1266 4.1789 4.1789 4.1789 4.1789 7.6864 7.6864 7.6864 7.6864 7.8335 7.8335 7.8335 7.8335 8.5361 8.5361 8.5361 8.5361 8.7228 8.7228 k = 0.5000 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0136 -9.0136 -9.0136 -9.0136 -7.6103 -7.6103 -7.6103 -7.6103 -7.6091 -7.6091 -7.6091 -7.6091 -3.6687 -3.6687 -3.6687 -3.6687 -3.6671 -3.6671 -3.6671 -3.6671 0.0028 0.0028 0.0028 0.0028 0.0046 0.0046 0.0046 0.0046 1.2148 1.2148 1.2148 1.2148 1.2885 1.2885 1.2885 1.2885 2.1561 2.1561 2.1561 2.1561 2.2082 2.2082 2.2082 2.2082 3.0257 3.0257 3.0257 3.0257 3.0813 3.0813 3.0813 3.0813 3.3193 3.3193 3.3193 3.3193 3.3614 3.3614 3.3614 3.3614 4.1266 4.1266 4.1266 4.1266 4.1789 4.1789 4.1789 4.1789 7.6864 7.6864 7.6864 7.6864 7.8335 7.8335 7.8335 7.8335 8.5361 8.5361 8.5361 8.5361 8.7228 8.7228 k = 0.4875 0.2405 0.2028 ( 12572 PWs) bands (ev): -9.0149 -9.0149 -9.0149 -9.0149 -9.0143 -9.0143 -9.0143 -9.0143 -7.6533 -7.6533 -7.6533 -7.6533 -7.5664 -7.5664 -7.5664 -7.5664 -3.7185 -3.7185 -3.7185 -3.7185 -3.6150 -3.6150 -3.6150 -3.6150 -0.0153 -0.0153 -0.0153 -0.0153 0.0251 0.0251 0.0251 0.0251 1.2117 1.2117 1.2117 1.2117 1.2914 1.2914 1.2914 1.2914 2.1394 2.1394 2.1394 2.1394 2.2291 2.2291 2.2291 2.2291 3.0204 3.0204 3.0204 3.0204 3.0816 3.0816 3.0816 3.0816 3.3152 3.3152 3.3152 3.3152 3.3697 3.3697 3.3697 3.3697 4.1229 4.1229 4.1229 4.1229 4.1847 4.1847 4.1847 4.1847 7.6830 7.6830 7.6830 7.6830 7.8372 7.8372 7.8372 7.8372 8.5354 8.5354 8.5354 8.5354 8.7228 8.7228 k = 0.4750 0.2405 0.2028 ( 12576 PWs) bands (ev): -9.0172 -9.0172 -9.0172 -9.0172 -9.0164 -9.0164 -9.0164 -9.0164 -7.6968 -7.6968 -7.6968 -7.6968 -7.5236 -7.5236 -7.5236 -7.5236 -3.7667 -3.7667 -3.7667 -3.7667 -3.5600 -3.5600 -3.5600 -3.5600 -0.0320 -0.0320 -0.0320 -0.0320 0.0488 0.0488 0.0488 0.0488 1.2032 1.2032 1.2032 1.2032 1.2994 1.2994 1.2994 1.2994 2.1135 2.1135 2.1135 2.1135 2.2676 2.2676 2.2676 2.2676 3.0074 3.0074 3.0074 3.0074 3.0797 3.0797 3.0797 3.0797 3.3101 3.3101 3.3101 3.3101 3.3874 3.3874 3.3874 3.3874 4.1150 4.1150 4.1150 4.1150 4.1988 4.1988 4.1988 4.1988 7.6737 7.6737 7.6737 7.6737 7.8473 7.8473 7.8473 7.8473 8.5331 8.5331 8.5331 8.5331 8.7227 8.7227 k = 0.4625 0.2405 0.2028 ( 12576 PWs) bands (ev): -9.0210 -9.0210 -9.0210 -9.0210 -9.0200 -9.0200 -9.0200 -9.0200 -7.7401 -7.7401 -7.7401 -7.7401 -7.4814 -7.4814 -7.4814 -7.4814 -3.8122 -3.8122 -3.8122 -3.8122 -3.5032 -3.5032 -3.5032 -3.5032 -0.0462 -0.0462 -0.0462 -0.0462 0.0747 0.0747 0.0747 0.0747 1.1908 1.1908 1.1908 1.1908 1.3112 1.3112 1.3112 1.3112 2.0901 2.0901 2.0901 2.0901 2.3114 2.3114 2.3114 2.3114 2.9903 2.9903 2.9903 2.9903 3.0720 3.0720 3.0720 3.0720 3.3106 3.3106 3.3106 3.3106 3.4079 3.4079 3.4079 3.4079 4.1070 4.1070 4.1070 4.1070 4.2172 4.2172 4.2172 4.2172 7.6605 7.6605 7.6605 7.6605 7.8618 7.8618 7.8618 7.8618 8.5294 8.5294 8.5294 8.5294 8.7225 8.7225 k = 0.4500 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.0262 -9.0262 -9.0262 -9.0262 -9.0251 -9.0251 -9.0251 -9.0251 -7.7830 -7.7830 -7.7830 -7.7830 -7.4401 -7.4401 -7.4401 -7.4401 -3.8550 -3.8550 -3.8550 -3.8550 -3.4447 -3.4447 -3.4447 -3.4447 -0.0580 -0.0580 -0.0580 -0.0580 0.1028 0.1028 0.1028 0.1028 1.1757 1.1757 1.1757 1.1757 1.3262 1.3262 1.3262 1.3262 2.0709 2.0709 2.0709 2.0709 2.3580 2.3580 2.3580 2.3580 2.9717 2.9717 2.9717 2.9717 3.0579 3.0579 3.0579 3.0579 3.3179 3.3179 3.3179 3.3179 3.4287 3.4287 3.4287 3.4287 4.1007 4.1007 4.1007 4.1007 4.2382 4.2382 4.2382 4.2382 7.6448 7.6448 7.6448 7.6448 7.8788 7.8788 7.8788 7.8788 8.5243 8.5243 8.5243 8.5243 8.7222 8.7222 k = 0.4375 0.2405 0.2028 ( 12568 PWs) bands (ev): -9.0329 -9.0329 -9.0329 -9.0329 -9.0315 -9.0315 -9.0315 -9.0315 -7.8252 -7.8252 -7.8252 -7.8252 -7.4000 -7.4000 -7.4000 -7.4000 -3.8949 -3.8949 -3.8949 -3.8949 -3.3849 -3.3849 -3.3849 -3.3849 -0.0673 -0.0673 -0.0673 -0.0673 0.1329 0.1329 0.1329 0.1329 1.1586 1.1586 1.1586 1.1586 1.3441 1.3441 1.3441 1.3441 2.0561 2.0561 2.0561 2.0561 2.4058 2.4058 2.4058 2.4058 2.9528 2.9528 2.9528 2.9528 3.0389 3.0389 3.0389 3.0389 3.3307 3.3307 3.3307 3.3307 3.4490 3.4490 3.4490 3.4490 4.0967 4.0967 4.0967 4.0967 4.2611 4.2611 4.2611 4.2611 7.6279 7.6279 7.6279 7.6279 7.8967 7.8967 7.8967 7.8967 8.5182 8.5182 8.5182 8.5182 8.7219 8.7219 k = 0.4250 0.2405 0.2028 ( 12564 PWs) bands (ev): -9.0414 -9.0414 -9.0414 -9.0414 -9.0390 -9.0390 -9.0390 -9.0390 -7.8667 -7.8667 -7.8667 -7.8667 -7.3613 -7.3613 -7.3613 -7.3613 -3.9317 -3.9317 -3.9317 -3.9317 -3.3238 -3.3238 -3.3238 -3.3238 -0.0741 -0.0741 -0.0741 -0.0741 0.1648 0.1648 0.1648 0.1648 1.1402 1.1402 1.1402 1.1402 1.3652 1.3652 1.3652 1.3652 2.0454 2.0454 2.0454 2.0454 2.4535 2.4535 2.4535 2.4535 2.9343 2.9343 2.9343 2.9343 3.0178 3.0178 3.0178 3.0178 3.3471 3.3471 3.3471 3.3471 3.4682 3.4682 3.4682 3.4682 4.0954 4.0954 4.0954 4.0954 4.2853 4.2853 4.2853 4.2853 7.6101 7.6101 7.6101 7.6101 7.9145 7.9145 7.9145 7.9145 8.5110 8.5110 8.5110 8.5110 8.7215 8.7215 k = 0.4125 0.2405 0.2028 ( 12580 PWs) bands (ev): -9.0515 -9.0515 -9.0515 -9.0515 -9.0474 -9.0474 -9.0474 -9.0474 -7.9071 -7.9071 -7.9071 -7.9071 -7.3242 -7.3242 -7.3242 -7.3242 -3.9654 -3.9654 -3.9654 -3.9654 -3.2618 -3.2618 -3.2618 -3.2618 -0.0783 -0.0783 -0.0783 -0.0783 0.1982 0.1982 0.1982 0.1982 1.1212 1.1212 1.1212 1.1212 1.3897 1.3897 1.3897 1.3897 2.0383 2.0383 2.0383 2.0383 2.4992 2.4992 2.4992 2.4992 2.9166 2.9166 2.9166 2.9166 2.9971 2.9971 2.9971 2.9971 3.3655 3.3655 3.3655 3.3655 3.4865 3.4865 3.4865 3.4865 4.0969 4.0969 4.0969 4.0969 4.3106 4.3106 4.3106 4.3106 7.5920 7.5920 7.5920 7.5920 7.9313 7.9313 7.9313 7.9313 8.5028 8.5028 8.5028 8.5028 8.7214 8.7214 k = 0.4000 0.2405 0.2028 ( 12556 PWs) bands (ev): -9.0632 -9.0632 -9.0632 -9.0632 -9.0568 -9.0568 -9.0568 -9.0568 -7.9465 -7.9465 -7.9465 -7.9465 -7.2889 -7.2889 -7.2889 -7.2889 -3.9959 -3.9959 -3.9959 -3.9959 -3.1992 -3.1992 -3.1992 -3.1992 -0.0799 -0.0799 -0.0799 -0.0799 0.2327 0.2327 0.2327 0.2327 1.1023 1.1023 1.1023 1.1023 1.4178 1.4178 1.4178 1.4178 2.0344 2.0344 2.0344 2.0344 2.5405 2.5405 2.5405 2.5405 2.9004 2.9004 2.9004 2.9004 2.9793 2.9793 2.9793 2.9793 3.3849 3.3849 3.3849 3.3849 3.5042 3.5042 3.5042 3.5042 4.1011 4.1011 4.1011 4.1011 4.3369 4.3369 4.3369 4.3369 7.5736 7.5736 7.5736 7.5736 7.9463 7.9463 7.9463 7.9463 8.4936 8.4936 8.4936 8.4936 8.7215 8.7215 k = 0.3875 0.2405 0.2028 ( 12556 PWs) bands (ev): -9.0764 -9.0764 -9.0764 -9.0764 -9.0671 -9.0671 -9.0671 -9.0671 -7.9847 -7.9847 -7.9847 -7.9847 -7.2555 -7.2555 -7.2555 -7.2555 -4.0231 -4.0231 -4.0231 -4.0231 -3.1361 -3.1361 -3.1361 -3.1361 -0.0787 -0.0787 -0.0787 -0.0787 0.2679 0.2679 0.2679 0.2679 1.0845 1.0845 1.0845 1.0845 1.4497 1.4497 1.4497 1.4497 2.0330 2.0330 2.0330 2.0330 2.5742 2.5742 2.5742 2.5742 2.8872 2.8872 2.8872 2.8872 2.9662 2.9662 2.9662 2.9662 3.4047 3.4047 3.4047 3.4047 3.5217 3.5217 3.5217 3.5217 4.1078 4.1078 4.1078 4.1078 4.3638 4.3638 4.3638 4.3638 7.5550 7.5550 7.5550 7.5550 7.9588 7.9588 7.9588 7.9588 8.4833 8.4833 8.4833 8.4833 8.7220 8.7220 k = 0.3750 0.2405 0.2028 ( 12536 PWs) bands (ev): -9.0912 -9.0912 -9.0912 -9.0912 -9.0781 -9.0781 -9.0781 -9.0781 -8.0215 -8.0215 -8.0215 -8.0215 -7.2243 -7.2243 -7.2243 -7.2243 -4.0471 -4.0471 -4.0471 -4.0471 -3.0728 -3.0728 -3.0728 -3.0728 -0.0746 -0.0746 -0.0746 -0.0746 0.3032 0.3032 0.3032 0.3032 1.0687 1.0687 1.0687 1.0687 1.4855 1.4855 1.4855 1.4855 2.0336 2.0336 2.0336 2.0336 2.5964 2.5964 2.5964 2.5964 2.8793 2.8793 2.8793 2.8793 2.9589 2.9589 2.9589 2.9589 3.4249 3.4249 3.4249 3.4249 3.5396 3.5396 3.5396 3.5396 4.1167 4.1167 4.1167 4.1167 4.3911 4.3911 4.3911 4.3911 7.5363 7.5363 7.5363 7.5363 7.9682 7.9682 7.9682 7.9682 8.4717 8.4717 8.4717 8.4717 8.7231 8.7231 k = 0.3625 0.2405 0.2028 ( 12528 PWs) bands (ev): -9.1073 -9.1073 -9.1073 -9.1073 -9.0898 -9.0898 -9.0898 -9.0898 -8.0569 -8.0569 -8.0569 -8.0569 -7.1954 -7.1954 -7.1954 -7.1954 -4.0678 -4.0678 -4.0678 -4.0678 -3.0096 -3.0096 -3.0096 -3.0096 -0.0676 -0.0676 -0.0676 -0.0676 0.3377 0.3377 0.3377 0.3377 1.0559 1.0559 1.0559 1.0559 1.5255 1.5255 1.5255 1.5255 2.0360 2.0360 2.0360 2.0360 2.6044 2.6044 2.6044 2.6044 2.8777 2.8777 2.8777 2.8777 2.9585 2.9585 2.9585 2.9585 3.4457 3.4457 3.4457 3.4457 3.5585 3.5585 3.5585 3.5585 4.1275 4.1275 4.1275 4.1275 4.4185 4.4185 4.4185 4.4185 7.5175 7.5175 7.5175 7.5175 7.9739 7.9739 7.9739 7.9739 8.4583 8.4583 8.4583 8.4583 8.7248 8.7248 k = 0.3500 0.2405 0.2028 ( 12520 PWs) bands (ev): -9.1247 -9.1247 -9.1247 -9.1247 -9.1021 -9.1021 -9.1021 -9.1021 -8.0909 -8.0909 -8.0909 -8.0909 -7.1688 -7.1688 -7.1688 -7.1688 -4.0853 -4.0853 -4.0853 -4.0853 -2.9469 -2.9469 -2.9469 -2.9469 -0.0574 -0.0574 -0.0574 -0.0574 0.3707 0.3707 0.3707 0.3707 1.0475 1.0475 1.0475 1.0475 1.5694 1.5694 1.5694 1.5694 2.0399 2.0399 2.0399 2.0399 2.5985 2.5985 2.5985 2.5985 2.8804 2.8804 2.8804 2.8804 2.9657 2.9657 2.9657 2.9657 3.4675 3.4675 3.4675 3.4675 3.5790 3.5790 3.5790 3.5790 4.1396 4.1396 4.1396 4.1396 4.4458 4.4458 4.4458 4.4458 7.4987 7.4987 7.4987 7.4987 7.9755 7.9755 7.9755 7.9755 8.4427 8.4427 8.4427 8.4427 8.7271 8.7271 k = 0.3375 0.2405 0.2028 ( 12516 PWs) bands (ev): -9.1432 -9.1432 -9.1432 -9.1432 -9.1148 -9.1148 -9.1148 -9.1148 -8.1234 -8.1234 -8.1234 -8.1234 -7.1446 -7.1446 -7.1446 -7.1446 -4.0997 -4.0997 -4.0997 -4.0997 -2.8847 -2.8847 -2.8847 -2.8847 -0.0440 -0.0440 -0.0440 -0.0440 0.4009 0.4009 0.4009 0.4009 1.0444 1.0444 1.0444 1.0444 1.6174 1.6174 1.6174 1.6174 2.0451 2.0451 2.0451 2.0451 2.5819 2.5819 2.5819 2.5819 2.8838 2.8838 2.8838 2.8838 2.9797 2.9797 2.9797 2.9797 3.4910 3.4910 3.4910 3.4910 3.6014 3.6014 3.6014 3.6014 4.1529 4.1529 4.1529 4.1529 4.4726 4.4726 4.4726 4.4726 7.4800 7.4800 7.4800 7.4800 7.9728 7.9728 7.9728 7.9728 8.4244 8.4244 8.4244 8.4244 8.7297 8.7297 k = 0.3250 0.2405 0.2028 ( 12528 PWs) bands (ev): -9.1628 -9.1628 -9.1628 -9.1628 -9.1281 -9.1281 -9.1281 -9.1281 -8.1544 -8.1544 -8.1544 -8.1544 -7.1229 -7.1229 -7.1229 -7.1229 -4.1112 -4.1112 -4.1112 -4.1112 -2.8235 -2.8235 -2.8235 -2.8235 -0.0271 -0.0271 -0.0271 -0.0271 0.4276 0.4276 0.4276 0.4276 1.0479 1.0479 1.0479 1.0479 1.6692 1.6692 1.6692 1.6692 2.0519 2.0519 2.0519 2.0519 2.5584 2.5584 2.5584 2.5584 2.8863 2.8863 2.8863 2.8863 2.9973 2.9973 2.9973 2.9973 3.5169 3.5169 3.5169 3.5169 3.6260 3.6260 3.6260 3.6260 4.1670 4.1670 4.1670 4.1670 4.4985 4.4985 4.4985 4.4985 7.4613 7.4613 7.4613 7.4613 7.9656 7.9656 7.9656 7.9656 8.4028 8.4028 8.4028 8.4028 8.7319 8.7319 k = 0.3125 0.2405 0.2028 ( 12544 PWs) bands (ev): -9.1833 -9.1833 -9.1833 -9.1833 -9.1416 -9.1416 -9.1416 -9.1416 -8.1840 -8.1840 -8.1840 -8.1840 -7.1037 -7.1037 -7.1037 -7.1037 -4.1198 -4.1198 -4.1198 -4.1198 -2.7635 -2.7635 -2.7635 -2.7635 -0.0067 -0.0067 -0.0067 -0.0067 0.4499 0.4499 0.4499 0.4499 1.0586 1.0586 1.0586 1.0586 1.7247 1.7247 1.7247 1.7247 2.0604 2.0604 2.0604 2.0604 2.5309 2.5309 2.5309 2.5309 2.8876 2.8876 2.8876 2.8876 3.0150 3.0150 3.0150 3.0150 3.5457 3.5457 3.5457 3.5457 3.6529 3.6529 3.6529 3.6529 4.1816 4.1816 4.1816 4.1816 4.5233 4.5233 4.5233 4.5233 7.4430 7.4430 7.4430 7.4430 7.9540 7.9540 7.9540 7.9540 8.3774 8.3774 8.3774 8.3774 8.7332 8.7332 k = 0.3000 0.2405 0.2028 ( 12540 PWs) bands (ev): -9.2045 -9.2045 -9.2045 -9.2045 -9.1554 -9.1554 -9.1554 -9.1554 -8.2120 -8.2120 -8.2120 -8.2120 -7.0869 -7.0869 -7.0869 -7.0869 -4.1258 -4.1258 -4.1258 -4.1258 -2.7050 -2.7050 -2.7050 -2.7050 0.0174 0.0174 0.0174 0.0174 0.4672 0.4672 0.4672 0.4672 1.0771 1.0771 1.0771 1.0771 1.7834 1.7834 1.7834 1.7834 2.0709 2.0709 2.0709 2.0709 2.5016 2.5016 2.5016 2.5016 2.8881 2.8881 2.8881 2.8881 3.0300 3.0300 3.0300 3.0300 3.5776 3.5776 3.5776 3.5776 3.6820 3.6820 3.6820 3.6820 4.1965 4.1965 4.1965 4.1965 4.5464 4.5464 4.5464 4.5464 7.4249 7.4249 7.4249 7.4249 7.9381 7.9381 7.9381 7.9381 8.3476 8.3476 8.3476 8.3476 8.7325 8.7325 k = 0.2875 0.2405 0.2028 ( 12532 PWs) bands (ev): -9.2263 -9.2263 -9.2263 -9.2263 -9.1693 -9.1693 -9.1693 -9.1693 -8.2385 -8.2385 -8.2385 -8.2385 -7.0724 -7.0724 -7.0724 -7.0724 -4.1294 -4.1294 -4.1294 -4.1294 -2.6482 -2.6482 -2.6482 -2.6482 0.0453 0.0453 0.0453 0.0453 0.4797 0.4797 0.4797 0.4797 1.1029 1.1029 1.1029 1.1029 1.8448 1.8448 1.8448 1.8448 2.0839 2.0839 2.0839 2.0839 2.4719 2.4719 2.4719 2.4719 2.8882 2.8882 2.8882 2.8882 3.0406 3.0406 3.0406 3.0406 3.6125 3.6125 3.6125 3.6125 3.7129 3.7129 3.7129 3.7129 4.2118 4.2118 4.2118 4.2118 4.5676 4.5676 4.5676 4.5676 7.4071 7.4071 7.4071 7.4071 7.9182 7.9182 7.9182 7.9182 8.3131 8.3131 8.3131 8.3131 8.7290 8.7290 k = 0.2750 0.2405 0.2028 ( 12532 PWs) bands (ev): -9.2484 -9.2484 -9.2484 -9.2484 -9.1833 -9.1833 -9.1833 -9.1833 -8.2637 -8.2637 -8.2637 -8.2637 -7.0602 -7.0602 -7.0602 -7.0602 -4.1308 -4.1308 -4.1308 -4.1308 -2.5933 -2.5933 -2.5933 -2.5933 0.0771 0.0771 0.0771 0.0771 0.4877 0.4877 0.4877 0.4877 1.1356 1.1356 1.1356 1.1356 1.9079 1.9079 1.9079 1.9079 2.0998 2.0998 2.0998 2.0998 2.4431 2.4431 2.4431 2.4431 2.8881 2.8881 2.8881 2.8881 3.0463 3.0463 3.0463 3.0463 3.6498 3.6498 3.6498 3.6498 3.7453 3.7453 3.7453 3.7453 4.2272 4.2272 4.2272 4.2272 4.5865 4.5865 4.5865 4.5865 7.3896 7.3896 7.3896 7.3896 7.8948 7.8948 7.8948 7.8948 8.2735 8.2735 8.2735 8.2735 8.7215 8.7215 k = 0.2625 0.2405 0.2028 ( 12536 PWs) bands (ev): -9.2708 -9.2708 -9.2708 -9.2708 -9.1972 -9.1972 -9.1972 -9.1972 -8.2874 -8.2874 -8.2874 -8.2874 -7.0501 -7.0501 -7.0501 -7.0501 -4.1302 -4.1302 -4.1302 -4.1302 -2.5406 -2.5406 -2.5406 -2.5406 0.1128 0.1128 0.1128 0.1128 0.4921 0.4921 0.4921 0.4921 1.1739 1.1739 1.1739 1.1739 1.9708 1.9708 1.9708 1.9708 2.1199 2.1199 2.1199 2.1199 2.4166 2.4166 2.4166 2.4166 2.8881 2.8881 2.8881 2.8881 3.0469 3.0469 3.0469 3.0469 3.6888 3.6888 3.6888 3.6888 3.7785 3.7785 3.7785 3.7785 4.2429 4.2429 4.2429 4.2429 4.6029 4.6029 4.6029 4.6029 7.3722 7.3722 7.3722 7.3722 7.8683 7.8683 7.8683 7.8683 8.2290 8.2290 8.2290 8.2290 8.7093 8.7093 k = 0.2500 0.2405 0.2028 ( 12536 PWs) bands (ev): -9.2932 -9.2932 -9.2932 -9.2932 -9.2111 -9.2111 -9.2111 -9.2111 -8.3098 -8.3098 -8.3098 -8.3098 -7.0421 -7.0421 -7.0421 -7.0421 -4.1280 -4.1280 -4.1280 -4.1280 -2.4903 -2.4903 -2.4903 -2.4903 0.1525 0.1525 0.1525 0.1525 0.4937 0.4937 0.4937 0.4937 1.2166 1.2166 1.2166 1.2166 2.0296 2.0296 2.0296 2.0296 2.1463 2.1463 2.1463 2.1463 2.3942 2.3942 2.3942 2.3942 2.8886 2.8886 2.8886 2.8886 3.0429 3.0429 3.0429 3.0429 3.7282 3.7282 3.7282 3.7282 3.8118 3.8118 3.8118 3.8118 4.2590 4.2590 4.2590 4.2590 4.6164 4.6164 4.6164 4.6164 7.3546 7.3546 7.3546 7.3546 7.8393 7.8393 7.8393 7.8393 8.1799 8.1799 8.1799 8.1799 8.6915 8.6915 k = 0.2375 0.2405 0.2028 ( 12544 PWs) bands (ev): -9.3156 -9.3156 -9.3156 -9.3156 -9.2248 -9.2248 -9.2248 -9.2248 -8.3309 -8.3309 -8.3309 -8.3309 -7.0358 -7.0358 -7.0358 -7.0358 -4.1244 -4.1244 -4.1244 -4.1244 -2.4425 -2.4425 -2.4425 -2.4425 0.1959 0.1959 0.1959 0.1959 0.4936 0.4936 0.4936 0.4936 1.2626 1.2626 1.2626 1.2626 2.0775 2.0775 2.0775 2.0775 2.1822 2.1822 2.1822 2.1822 2.3796 2.3796 2.3796 2.3796 2.8895 2.8895 2.8895 2.8895 3.0350 3.0350 3.0350 3.0350 3.7670 3.7670 3.7670 3.7670 3.8448 3.8448 3.8448 3.8448 4.2754 4.2754 4.2754 4.2754 4.6270 4.6270 4.6270 4.6270 7.3361 7.3361 7.3361 7.3361 7.8084 7.8084 7.8084 7.8084 8.1270 8.1270 8.1270 8.1270 8.6675 8.6675 k = 0.2250 0.2405 0.2028 ( 12556 PWs) bands (ev): -9.3377 -9.3377 -9.3377 -9.3377 -9.2382 -9.2382 -9.2382 -9.2382 -8.3507 -8.3507 -8.3507 -8.3507 -7.0313 -7.0313 -7.0313 -7.0313 -4.1196 -4.1196 -4.1196 -4.1196 -2.3974 -2.3974 -2.3974 -2.3974 0.2429 0.2429 0.2429 0.2429 0.4926 0.4926 0.4926 0.4926 1.3105 1.3105 1.3105 1.3105 2.1090 2.1090 2.1090 2.1090 2.2264 2.2264 2.2264 2.2264 2.3792 2.3792 2.3792 2.3792 2.8908 2.8908 2.8908 2.8908 3.0245 3.0245 3.0245 3.0245 3.8037 3.8037 3.8037 3.8037 3.8771 3.8771 3.8771 3.8771 4.2924 4.2924 4.2924 4.2924 4.6346 4.6346 4.6346 4.6346 7.3160 7.3160 7.3160 7.3160 7.7764 7.7764 7.7764 7.7764 8.0716 8.0716 8.0716 8.0716 8.6366 8.6366 k = 0.2125 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.3593 -9.3593 -9.3593 -9.3593 -9.2513 -9.2513 -9.2513 -9.2513 -8.3692 -8.3692 -8.3692 -8.3692 -7.0282 -7.0282 -7.0282 -7.0282 -4.1138 -4.1138 -4.1138 -4.1138 -2.3551 -2.3551 -2.3551 -2.3551 0.2929 0.2929 0.2929 0.2929 0.4919 0.4919 0.4919 0.4919 1.3595 1.3595 1.3595 1.3595 2.1248 2.1248 2.1248 2.1248 2.2676 2.2676 2.2676 2.2676 2.4029 2.4029 2.4029 2.4029 2.8918 2.8918 2.8918 2.8918 3.0135 3.0135 3.0135 3.0135 3.8367 3.8367 3.8367 3.8367 3.9086 3.9086 3.9086 3.9086 4.3098 4.3098 4.3098 4.3098 4.6393 4.6393 4.6393 4.6393 7.2929 7.2929 7.2929 7.2929 7.7440 7.7440 7.7440 7.7440 8.0154 8.0154 8.0154 8.0154 8.5985 8.5985 k = 0.2000 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.3805 -9.3805 -9.3805 -9.3805 -9.2641 -9.2641 -9.2641 -9.2641 -8.3866 -8.3866 -8.3866 -8.3866 -7.0264 -7.0264 -7.0264 -7.0264 -4.1074 -4.1074 -4.1074 -4.1074 -2.3157 -2.3157 -2.3157 -2.3157 0.3441 0.3441 0.3441 0.3441 0.4934 0.4934 0.4934 0.4934 1.4087 1.4087 1.4087 1.4087 2.1274 2.1274 2.1274 2.1274 2.3004 2.3004 2.3004 2.3004 2.4524 2.4524 2.4524 2.4524 2.8904 2.8904 2.8904 2.8904 3.0054 3.0054 3.0054 3.0054 3.8645 3.8645 3.8645 3.8645 3.9395 3.9395 3.9395 3.9395 4.3276 4.3276 4.3276 4.3276 4.6413 4.6413 4.6413 4.6413 7.2654 7.2654 7.2654 7.2654 7.7118 7.7118 7.7118 7.7118 7.9605 7.9605 7.9605 7.9605 8.5530 8.5530 k = 0.1875 0.2405 0.2028 ( 12568 PWs) bands (ev): -9.4009 -9.4009 -9.4009 -9.4009 -9.2764 -9.2764 -9.2764 -9.2764 -8.4029 -8.4029 -8.4029 -8.4029 -7.0258 -7.0258 -7.0258 -7.0258 -4.1005 -4.1005 -4.1005 -4.1005 -2.2792 -2.2792 -2.2792 -2.2792 0.3919 0.3919 0.3919 0.3919 0.5020 0.5020 0.5020 0.5020 1.4573 1.4573 1.4573 1.4573 2.1198 2.1198 2.1198 2.1198 2.3311 2.3311 2.3311 2.3311 2.5160 2.5160 2.5160 2.5160 2.8844 2.8844 2.8844 2.8844 3.0046 3.0046 3.0046 3.0046 3.8861 3.8861 3.8861 3.8861 3.9694 3.9694 3.9694 3.9694 4.3452 4.3452 4.3452 4.3452 4.6409 4.6409 4.6409 4.6409 7.2321 7.2321 7.2321 7.2321 7.6804 7.6804 7.6804 7.6804 7.9096 7.9096 7.9096 7.9096 8.5006 8.5006 k = 0.1750 0.2405 0.2028 ( 12576 PWs) bands (ev): -9.4206 -9.4206 -9.4206 -9.4206 -9.2881 -9.2881 -9.2881 -9.2881 -8.4180 -8.4180 -8.4180 -8.4180 -7.0260 -7.0260 -7.0260 -7.0260 -4.0934 -4.0934 -4.0934 -4.0934 -2.2456 -2.2456 -2.2456 -2.2456 0.4251 0.4251 0.4251 0.4251 0.5288 0.5288 0.5288 0.5288 1.5047 1.5047 1.5047 1.5047 2.1059 2.1059 2.1059 2.1059 2.3639 2.3639 2.3639 2.3639 2.5824 2.5824 2.5824 2.5824 2.8739 2.8739 2.8739 2.8739 3.0145 3.0145 3.0145 3.0145 3.9014 3.9014 3.9014 3.9014 3.9979 3.9979 3.9979 3.9979 4.3623 4.3623 4.3623 4.3623 4.6387 4.6387 4.6387 4.6387 7.1915 7.1915 7.1915 7.1915 7.6500 7.6500 7.6500 7.6500 7.8650 7.8650 7.8650 7.8650 8.4419 8.4419 k = 0.1625 0.2405 0.2028 ( 12572 PWs) bands (ev): -9.4394 -9.4394 -9.4394 -9.4394 -9.2993 -9.2993 -9.2993 -9.2993 -8.4319 -8.4319 -8.4319 -8.4319 -7.0271 -7.0271 -7.0271 -7.0271 -4.0861 -4.0861 -4.0861 -4.0861 -2.2150 -2.2150 -2.2150 -2.2150 0.4386 0.4386 0.4386 0.4386 0.5790 0.5790 0.5790 0.5790 1.5503 1.5503 1.5503 1.5503 2.0886 2.0886 2.0886 2.0886 2.3987 2.3987 2.3987 2.3987 2.6407 2.6407 2.6407 2.6407 2.8661 2.8661 2.8661 2.8661 3.0353 3.0353 3.0353 3.0353 3.9105 3.9105 3.9105 3.9105 4.0239 4.0239 4.0239 4.0239 4.3783 4.3783 4.3783 4.3783 4.6352 4.6352 4.6352 4.6352 7.1430 7.1430 7.1430 7.1430 7.6208 7.6208 7.6208 7.6208 7.8286 7.8286 7.8286 7.8286 8.3784 8.3784 k = 0.1500 0.2405 0.2028 ( 12568 PWs) bands (ev): -9.4571 -9.4571 -9.4571 -9.4571 -9.3099 -9.3099 -9.3099 -9.3099 -8.4449 -8.4449 -8.4449 -8.4449 -7.0287 -7.0287 -7.0287 -7.0287 -4.0789 -4.0789 -4.0789 -4.0789 -2.1872 -2.1872 -2.1872 -2.1872 0.4419 0.4419 0.4419 0.4419 0.6429 0.6429 0.6429 0.6429 1.5937 1.5937 1.5937 1.5937 2.0697 2.0697 2.0697 2.0697 2.4341 2.4341 2.4341 2.4341 2.6749 2.6749 2.6749 2.6749 2.8767 2.8767 2.8767 2.8767 3.0658 3.0658 3.0658 3.0658 3.9142 3.9142 3.9142 3.9142 4.0466 4.0466 4.0466 4.0466 4.3923 4.3923 4.3923 4.3923 4.6308 4.6308 4.6308 4.6308 7.0869 7.0869 7.0869 7.0869 7.5930 7.5930 7.5930 7.5930 7.8010 7.8010 7.8010 7.8010 8.3117 8.3117 k = 0.1375 0.2405 0.2028 ( 12580 PWs) bands (ev): -9.4738 -9.4738 -9.4738 -9.4738 -9.3199 -9.3199 -9.3199 -9.3199 -8.4567 -8.4567 -8.4567 -8.4567 -7.0309 -7.0309 -7.0309 -7.0309 -4.0719 -4.0719 -4.0719 -4.0719 -2.1621 -2.1621 -2.1621 -2.1621 0.4414 0.4414 0.4414 0.4414 0.7136 0.7136 0.7136 0.7136 1.6345 1.6345 1.6345 1.6345 2.0502 2.0502 2.0502 2.0502 2.4685 2.4685 2.4685 2.4685 2.6751 2.6751 2.6751 2.6751 2.9167 2.9167 2.9167 2.9167 3.1050 3.1050 3.1050 3.1050 3.9128 3.9128 3.9128 3.9128 4.0654 4.0654 4.0654 4.0654 4.4040 4.4040 4.4040 4.4040 4.6263 4.6263 4.6263 4.6263 7.0243 7.0243 7.0243 7.0243 7.5671 7.5671 7.5671 7.5671 7.7815 7.7815 7.7815 7.7815 8.2435 8.2435 k = 0.1250 0.2405 0.2028 ( 12572 PWs) bands (ev): -9.4892 -9.4892 -9.4892 -9.4892 -9.3291 -9.3291 -9.3291 -9.3291 -8.4675 -8.4675 -8.4675 -8.4675 -7.0333 -7.0333 -7.0333 -7.0333 -4.0653 -4.0653 -4.0653 -4.0653 -2.1398 -2.1398 -2.1398 -2.1398 0.4396 0.4396 0.4396 0.4396 0.7884 0.7884 0.7884 0.7884 1.6722 1.6722 1.6722 1.6722 2.0307 2.0307 2.0307 2.0307 2.4986 2.4986 2.4986 2.4986 2.6542 2.6542 2.6542 2.6542 2.9754 2.9754 2.9754 2.9754 3.1519 3.1519 3.1519 3.1519 3.9071 3.9071 3.9071 3.9071 4.0798 4.0798 4.0798 4.0798 4.4129 4.4129 4.4129 4.4129 4.6219 4.6219 4.6219 4.6219 6.9572 6.9572 6.9572 6.9572 7.5438 7.5438 7.5438 7.5438 7.7682 7.7682 7.7682 7.7682 8.1761 8.1761 k = 0.1125 0.2405 0.2028 ( 12568 PWs) bands (ev): -9.5034 -9.5034 -9.5034 -9.5034 -9.3375 -9.3375 -9.3375 -9.3375 -8.4772 -8.4772 -8.4772 -8.4772 -7.0358 -7.0358 -7.0358 -7.0358 -4.0590 -4.0590 -4.0590 -4.0590 -2.1201 -2.1201 -2.1201 -2.1201 0.4373 0.4373 0.4373 0.4373 0.8660 0.8660 0.8660 0.8660 1.7067 1.7067 1.7067 1.7067 2.0114 2.0114 2.0114 2.0114 2.5156 2.5156 2.5156 2.5156 2.6327 2.6327 2.6327 2.6327 3.0403 3.0403 3.0403 3.0403 3.2050 3.2050 3.2050 3.2050 3.8976 3.8976 3.8976 3.8976 4.0896 4.0896 4.0896 4.0896 4.4189 4.4189 4.4189 4.4189 4.6180 4.6180 4.6180 4.6180 6.8875 6.8875 6.8875 6.8875 7.5239 7.5239 7.5239 7.5239 7.7585 7.7585 7.7585 7.7585 8.1117 8.1117 k = 0.1000 0.2405 0.2028 ( 12584 PWs) bands (ev): -9.5163 -9.5163 -9.5163 -9.5163 -9.3452 -9.3452 -9.3452 -9.3452 -8.4859 -8.4859 -8.4859 -8.4859 -7.0385 -7.0385 -7.0385 -7.0385 -4.0533 -4.0533 -4.0533 -4.0533 -2.1028 -2.1028 -2.1028 -2.1028 0.4349 0.4349 0.4349 0.4349 0.9454 0.9454 0.9454 0.9454 1.7377 1.7377 1.7377 1.7377 1.9924 1.9924 1.9924 1.9924 2.5039 2.5039 2.5039 2.5039 2.6321 2.6321 2.6321 2.6321 3.1060 3.1060 3.1060 3.1060 3.2623 3.2623 3.2623 3.2623 3.8850 3.8850 3.8850 3.8850 4.0948 4.0948 4.0948 4.0948 4.4220 4.4220 4.4220 4.4220 4.6146 4.6146 4.6146 4.6146 6.8177 6.8177 6.8177 6.8177 7.5079 7.5079 7.5079 7.5079 7.7494 7.7494 7.7494 7.7494 8.0529 8.0529 k = 0.0875 0.2405 0.2028 ( 12576 PWs) bands (ev): -9.5278 -9.5278 -9.5278 -9.5278 -9.3520 -9.3520 -9.3520 -9.3520 -8.4935 -8.4935 -8.4935 -8.4935 -7.0410 -7.0410 -7.0410 -7.0410 -4.0481 -4.0481 -4.0481 -4.0481 -2.0879 -2.0879 -2.0879 -2.0879 0.4325 0.4325 0.4325 0.4325 1.0257 1.0257 1.0257 1.0257 1.7649 1.7649 1.7649 1.7649 1.9737 1.9737 1.9737 1.9737 2.4666 2.4666 2.4666 2.4666 2.6519 2.6519 2.6519 2.6519 3.1702 3.1702 3.1702 3.1702 3.3213 3.3213 3.3213 3.3213 3.8698 3.8698 3.8698 3.8698 4.0958 4.0958 4.0958 4.0958 4.4226 4.4226 4.4226 4.4226 4.6115 4.6115 4.6115 4.6115 6.7497 6.7497 6.7497 6.7497 7.4960 7.4960 7.4960 7.4960 7.7375 7.7375 7.7375 7.7375 8.0030 8.0030 k = 0.0750 0.2405 0.2028 ( 12588 PWs) bands (ev): -9.5379 -9.5379 -9.5379 -9.5379 -9.3580 -9.3580 -9.3580 -9.3580 -8.5002 -8.5002 -8.5002 -8.5002 -7.0435 -7.0435 -7.0435 -7.0435 -4.0435 -4.0435 -4.0435 -4.0435 -2.0752 -2.0752 -2.0752 -2.0752 0.4304 0.4304 0.4304 0.4304 1.1058 1.1058 1.1058 1.1058 1.7881 1.7881 1.7881 1.7881 1.9552 1.9552 1.9552 1.9552 2.4189 2.4189 2.4189 2.4189 2.6785 2.6785 2.6785 2.6785 3.2320 3.2320 3.2320 3.2320 3.3788 3.3788 3.3788 3.3788 3.8531 3.8531 3.8531 3.8531 4.0931 4.0931 4.0931 4.0931 4.4210 4.4210 4.4210 4.4210 4.6089 4.6089 4.6089 4.6089 6.6858 6.6858 6.6858 6.6858 7.4884 7.4884 7.4884 7.4884 7.7201 7.7201 7.7201 7.7201 7.9644 7.9644 k = 0.0625 0.2405 0.2028 ( 12584 PWs) bands (ev): -9.5464 -9.5464 -9.5464 -9.5464 -9.3631 -9.3631 -9.3631 -9.3631 -8.5058 -8.5058 -8.5058 -8.5058 -7.0456 -7.0456 -7.0456 -7.0456 -4.0396 -4.0396 -4.0396 -4.0396 -2.0647 -2.0647 -2.0647 -2.0647 0.4284 0.4284 0.4284 0.4284 1.1842 1.1842 1.1842 1.1842 1.8068 1.8068 1.8068 1.8068 1.9368 1.9368 1.9368 1.9368 2.3688 2.3688 2.3688 2.3688 2.7055 2.7055 2.7055 2.7055 3.2905 3.2905 3.2905 3.2905 3.4319 3.4319 3.4319 3.4319 3.8358 3.8358 3.8358 3.8358 4.0874 4.0874 4.0874 4.0874 4.4179 4.4179 4.4179 4.4179 4.6065 4.6065 4.6065 4.6065 6.6278 6.6278 6.6278 6.6278 7.4851 7.4851 7.4851 7.4851 7.6959 7.6959 7.6959 7.6959 7.9383 7.9383 k = 0.0500 0.2405 0.2028 ( 12568 PWs) bands (ev): -9.5535 -9.5535 -9.5535 -9.5535 -9.3674 -9.3674 -9.3674 -9.3674 -8.5104 -8.5104 -8.5104 -8.5104 -7.0475 -7.0475 -7.0475 -7.0475 -4.0363 -4.0363 -4.0363 -4.0363 -2.0563 -2.0563 -2.0563 -2.0563 0.4268 0.4268 0.4268 0.4268 1.2591 1.2591 1.2591 1.2591 1.8202 1.8202 1.8202 1.8202 1.9191 1.9191 1.9191 1.9191 2.3206 2.3206 2.3206 2.3206 2.7304 2.7304 2.7304 2.7304 3.3449 3.3449 3.3449 3.3449 3.4772 3.4772 3.4772 3.4772 3.8193 3.8193 3.8193 3.8193 4.0797 4.0797 4.0797 4.0797 4.4138 4.4138 4.4138 4.4138 4.6043 4.6043 4.6043 4.6043 6.5774 6.5774 6.5774 6.5774 7.4860 7.4860 7.4860 7.4860 7.6669 7.6669 7.6669 7.6669 7.9229 7.9229 k = 0.0375 0.2405 0.2028 ( 12556 PWs) bands (ev): -9.5590 -9.5590 -9.5590 -9.5590 -9.3706 -9.3706 -9.3706 -9.3706 -8.5139 -8.5139 -8.5139 -8.5139 -7.0490 -7.0490 -7.0490 -7.0490 -4.0338 -4.0338 -4.0338 -4.0338 -2.0498 -2.0498 -2.0498 -2.0498 0.4254 0.4254 0.4254 0.4254 1.3275 1.3275 1.3275 1.3275 1.8264 1.8264 1.8264 1.8264 1.9038 1.9038 1.9038 1.9038 2.2779 2.2779 2.2779 2.2779 2.7515 2.7515 2.7515 2.7515 3.3937 3.3937 3.3937 3.3937 3.5116 3.5116 3.5116 3.5116 3.8054 3.8054 3.8054 3.8054 4.0712 4.0712 4.0712 4.0712 4.4096 4.4096 4.4096 4.4096 4.6025 4.6025 4.6025 4.6025 6.5364 6.5364 6.5364 6.5364 7.4907 7.4907 7.4907 7.4907 7.6366 7.6366 7.6366 7.6366 7.9148 7.9148 k = 0.0250 0.2405 0.2028 ( 12544 PWs) bands (ev): -9.5630 -9.5630 -9.5630 -9.5630 -9.3730 -9.3730 -9.3730 -9.3730 -8.5165 -8.5165 -8.5165 -8.5165 -7.0502 -7.0502 -7.0502 -7.0502 -4.0320 -4.0320 -4.0320 -4.0320 -2.0452 -2.0452 -2.0452 -2.0452 0.4245 0.4245 0.4245 0.4245 1.3851 1.3851 1.3851 1.3851 1.8238 1.8238 1.8238 1.8238 1.8942 1.8942 1.8942 1.8942 2.2444 2.2444 2.2444 2.2444 2.7676 2.7676 2.7676 2.7676 3.4350 3.4350 3.4350 3.4350 3.5325 3.5325 3.5325 3.5325 3.7956 3.7956 3.7956 3.7956 4.0633 4.0633 4.0633 4.0633 4.4060 4.4060 4.4060 4.4060 4.6010 4.6010 4.6010 4.6010 6.5060 6.5060 6.5060 6.5060 7.4986 7.4986 7.4986 7.4986 7.6085 7.6085 7.6085 7.6085 7.9110 7.9110 k = 0.0125 0.2405 0.2028 ( 12544 PWs) bands (ev): -9.5654 -9.5654 -9.5654 -9.5654 -9.3744 -9.3744 -9.3744 -9.3744 -8.5180 -8.5180 -8.5180 -8.5180 -7.0508 -7.0508 -7.0508 -7.0508 -4.0309 -4.0309 -4.0309 -4.0309 -2.0425 -2.0425 -2.0425 -2.0425 0.4239 0.4239 0.4239 0.4239 1.4250 1.4250 1.4250 1.4250 1.8158 1.8158 1.8158 1.8158 1.8906 1.8906 1.8906 1.8906 2.2230 2.2230 2.2230 2.2230 2.7777 2.7777 2.7777 2.7777 3.4651 3.4651 3.4651 3.4651 3.5405 3.5405 3.5405 3.5405 3.7903 3.7903 3.7903 3.7903 4.0577 4.0577 4.0577 4.0577 4.4035 4.4035 4.4035 4.4035 4.6001 4.6001 4.6001 4.6001 6.4873 6.4873 6.4873 6.4873 7.5076 7.5076 7.5076 7.5076 7.5867 7.5867 7.5867 7.5867 7.9095 7.9095 k = 0.0000 0.2405 0.2028 ( 12552 PWs) bands (ev): -9.5662 -9.5662 -9.5662 -9.5662 -9.3749 -9.3749 -9.3749 -9.3749 -8.5185 -8.5185 -8.5185 -8.5185 -7.0511 -7.0511 -7.0511 -7.0511 -4.0305 -4.0305 -4.0305 -4.0305 -2.0416 -2.0416 -2.0416 -2.0416 0.4237 0.4237 0.4237 0.4237 1.4397 1.4397 1.4397 1.4397 1.8115 1.8115 1.8115 1.8115 1.8900 1.8900 1.8900 1.8900 2.2156 2.2156 2.2156 2.2156 2.7811 2.7811 2.7811 2.7811 3.4770 3.4770 3.4770 3.4770 3.5413 3.5413 3.5413 3.5413 3.7888 3.7888 3.7888 3.7888 4.0557 4.0557 4.0557 4.0557 4.4026 4.4026 4.4026 4.4026 4.5997 4.5997 4.5997 4.5997 6.4810 6.4810 6.4810 6.4810 7.5123 7.5123 7.5123 7.5123 7.5777 7.5777 7.5777 7.5777 7.9091 7.9091 k = 0.0000 0.2405 0.2028 ( 12552 PWs) bands (ev): -9.5662 -9.5662 -9.5662 -9.5662 -9.3749 -9.3749 -9.3749 -9.3749 -8.5185 -8.5185 -8.5185 -8.5185 -7.0511 -7.0511 -7.0511 -7.0511 -4.0305 -4.0305 -4.0305 -4.0305 -2.0416 -2.0416 -2.0416 -2.0416 0.4237 0.4237 0.4237 0.4237 1.4397 1.4397 1.4397 1.4397 1.8115 1.8115 1.8115 1.8115 1.8900 1.8900 1.8900 1.8900 2.2156 2.2156 2.2156 2.2156 2.7811 2.7811 2.7811 2.7811 3.4770 3.4770 3.4770 3.4770 3.5413 3.5413 3.5413 3.5413 3.7888 3.7888 3.7888 3.7888 4.0557 4.0557 4.0557 4.0557 4.4026 4.4026 4.4026 4.4026 4.5997 4.5997 4.5997 4.5997 6.4810 6.4810 6.4810 6.4810 7.5123 7.5123 7.5123 7.5123 7.5777 7.5777 7.5777 7.5777 7.9091 7.9091 k = 0.0000 0.2285 0.2028 ( 12544 PWs) bands (ev): -9.5671 -9.5671 -9.5671 -9.5671 -9.3739 -9.3739 -9.3739 -9.3739 -8.5184 -8.5184 -8.5184 -8.5184 -7.0514 -7.0514 -7.0514 -7.0514 -4.0305 -4.0305 -4.0305 -4.0305 -2.0416 -2.0416 -2.0416 -2.0416 0.4239 0.4239 0.4239 0.4239 1.4394 1.4394 1.4394 1.4394 1.8069 1.8069 1.8069 1.8069 1.8970 1.8970 1.8970 1.8970 2.2162 2.2162 2.2162 2.2162 2.7820 2.7820 2.7820 2.7820 3.4759 3.4759 3.4759 3.4759 3.5405 3.5405 3.5405 3.5405 3.7858 3.7858 3.7858 3.7858 4.0554 4.0554 4.0554 4.0554 4.4017 4.4017 4.4017 4.4017 4.6007 4.6007 4.6007 4.6007 6.4808 6.4808 6.4808 6.4808 7.5069 7.5069 7.5069 7.5069 7.5836 7.5836 7.5836 7.5836 7.9095 7.9095 k = 0.0000 0.2165 0.2028 ( 12552 PWs) bands (ev): -9.5698 -9.5698 -9.5698 -9.5698 -9.3708 -9.3708 -9.3708 -9.3708 -8.5180 -8.5180 -8.5180 -8.5180 -7.0524 -7.0524 -7.0524 -7.0524 -4.0307 -4.0307 -4.0307 -4.0307 -2.0418 -2.0418 -2.0418 -2.0418 0.4245 0.4245 0.4245 0.4245 1.4385 1.4385 1.4385 1.4385 1.7966 1.7966 1.7966 1.7966 1.9148 1.9148 1.9148 1.9148 2.2179 2.2179 2.2179 2.2179 2.7847 2.7847 2.7847 2.7847 3.4726 3.4726 3.4726 3.4726 3.5380 3.5380 3.5380 3.5380 3.7774 3.7774 3.7774 3.7774 4.0543 4.0543 4.0543 4.0543 4.3993 4.3993 4.3993 4.3993 4.6034 4.6034 4.6034 4.6034 6.4805 6.4805 6.4805 6.4805 7.4946 7.4946 7.4946 7.4946 7.5974 7.5974 7.5974 7.5974 7.9109 7.9109 k = 0.0000 0.2044 0.2028 ( 12558 PWs) bands (ev): -9.5740 -9.5740 -9.5740 -9.5740 -9.3660 -9.3660 -9.3660 -9.3660 -8.5174 -8.5174 -8.5174 -8.5174 -7.0540 -7.0540 -7.0540 -7.0540 -4.0310 -4.0310 -4.0310 -4.0310 -2.0421 -2.0421 -2.0421 -2.0421 0.4255 0.4255 0.4255 0.4255 1.4371 1.4371 1.4371 1.4371 1.7847 1.7847 1.7847 1.7847 1.9388 1.9388 1.9388 1.9388 2.2208 2.2208 2.2208 2.2208 2.7890 2.7890 2.7890 2.7890 3.4669 3.4669 3.4669 3.4669 3.5340 3.5340 3.5340 3.5340 3.7647 3.7647 3.7647 3.7647 4.0510 4.0510 4.0510 4.0510 4.3960 4.3960 4.3960 4.3960 4.6077 4.6077 4.6077 4.6077 6.4800 6.4800 6.4800 6.4800 7.4799 7.4799 7.4799 7.4799 7.6141 7.6141 7.6141 7.6141 7.9132 7.9132 k = 0.0000 0.1924 0.2028 ( 12562 PWs) bands (ev): -9.5795 -9.5795 -9.5795 -9.5795 -9.3598 -9.3598 -9.3598 -9.3598 -8.5166 -8.5166 -8.5166 -8.5166 -7.0562 -7.0562 -7.0562 -7.0562 -4.0314 -4.0314 -4.0314 -4.0314 -2.0424 -2.0424 -2.0424 -2.0424 0.4270 0.4270 0.4270 0.4270 1.4352 1.4352 1.4352 1.4352 1.7734 1.7734 1.7734 1.7734 1.9667 1.9667 1.9667 1.9667 2.2250 2.2250 2.2250 2.2250 2.7951 2.7951 2.7951 2.7951 3.4588 3.4588 3.4588 3.4588 3.5285 3.5285 3.5285 3.5285 3.7489 3.7489 3.7489 3.7489 4.0443 4.0443 4.0443 4.0443 4.3926 4.3926 4.3926 4.3926 4.6132 4.6132 4.6132 4.6132 6.4798 6.4798 6.4798 6.4798 7.4649 7.4649 7.4649 7.4649 7.6312 7.6312 7.6312 7.6312 7.9168 7.9168 k = 0.0000 0.1804 0.2028 ( 12568 PWs) bands (ev): -9.5860 -9.5860 -9.5860 -9.5860 -9.3524 -9.3524 -9.3524 -9.3524 -8.5155 -8.5155 -8.5155 -8.5155 -7.0590 -7.0590 -7.0590 -7.0590 -4.0319 -4.0319 -4.0319 -4.0319 -2.0429 -2.0429 -2.0429 -2.0429 0.4288 0.4288 0.4288 0.4288 1.4329 1.4329 1.4329 1.4329 1.7633 1.7633 1.7633 1.7633 1.9972 1.9972 1.9972 1.9972 2.2308 2.2308 2.2308 2.2308 2.8027 2.8027 2.8027 2.8027 3.4481 3.4481 3.4481 3.4481 3.5215 3.5215 3.5215 3.5215 3.7315 3.7315 3.7315 3.7315 4.0327 4.0327 4.0327 4.0327 4.3896 4.3896 4.3896 4.3896 4.6197 4.6197 4.6197 4.6197 6.4802 6.4802 6.4802 6.4802 7.4503 7.4503 7.4503 7.4503 7.6474 7.6474 7.6474 7.6474 7.9217 7.9217 k = 0.0000 0.1684 0.2028 ( 12562 PWs) bands (ev): -9.5930 -9.5930 -9.5930 -9.5930 -9.3442 -9.3442 -9.3442 -9.3442 -8.5143 -8.5143 -8.5143 -8.5143 -7.0623 -7.0623 -7.0623 -7.0623 -4.0324 -4.0324 -4.0324 -4.0324 -2.0435 -2.0435 -2.0435 -2.0435 0.4310 0.4310 0.4310 0.4310 1.4303 1.4303 1.4303 1.4303 1.7548 1.7548 1.7548 1.7548 2.0291 2.0291 2.0291 2.0291 2.2386 2.2386 2.2386 2.2386 2.8118 2.8118 2.8118 2.8118 3.4347 3.4347 3.4347 3.4347 3.5132 3.5132 3.5132 3.5132 3.7138 3.7138 3.7138 3.7138 4.0156 4.0156 4.0156 4.0156 4.3876 4.3876 4.3876 4.3876 4.6267 4.6267 4.6267 4.6267 6.4815 6.4815 6.4815 6.4815 7.4363 7.4363 7.4363 7.4363 7.6616 7.6616 7.6616 7.6616 7.9282 7.9282 k = 0.0000 0.1563 0.2028 ( 12558 PWs) bands (ev): -9.6004 -9.6004 -9.6004 -9.6004 -9.3356 -9.3356 -9.3356 -9.3356 -8.5129 -8.5129 -8.5129 -8.5129 -7.0659 -7.0659 -7.0659 -7.0659 -4.0330 -4.0330 -4.0330 -4.0330 -2.0442 -2.0442 -2.0442 -2.0442 0.4336 0.4336 0.4336 0.4336 1.4275 1.4275 1.4275 1.4275 1.7478 1.7478 1.7478 1.7478 2.0613 2.0613 2.0613 2.0613 2.2491 2.2491 2.2491 2.2491 2.8221 2.8221 2.8221 2.8221 3.4188 3.4188 3.4188 3.4188 3.5036 3.5036 3.5036 3.5036 3.6967 3.6967 3.6967 3.6967 3.9927 3.9927 3.9927 3.9927 4.3866 4.3866 4.3866 4.3866 4.6342 4.6342 4.6342 4.6342 6.4839 6.4839 6.4839 6.4839 7.4230 7.4230 7.4230 7.4230 7.6735 7.6735 7.6735 7.6735 7.9363 7.9363 k = 0.0000 0.1443 0.2028 ( 12552 PWs) bands (ev): -9.6079 -9.6079 -9.6079 -9.6079 -9.3268 -9.3268 -9.3268 -9.3268 -8.5113 -8.5113 -8.5113 -8.5113 -7.0699 -7.0699 -7.0699 -7.0699 -4.0336 -4.0336 -4.0336 -4.0336 -2.0449 -2.0449 -2.0449 -2.0449 0.4365 0.4365 0.4365 0.4365 1.4245 1.4245 1.4245 1.4245 1.7424 1.7424 1.7424 1.7424 2.0922 2.0922 2.0922 2.0922 2.2635 2.2635 2.2635 2.2635 2.8335 2.8335 2.8335 2.8335 3.4007 3.4007 3.4007 3.4007 3.4927 3.4927 3.4927 3.4927 3.6807 3.6807 3.6807 3.6807 3.9644 3.9644 3.9644 3.9644 4.3864 4.3864 4.3864 4.3864 4.6419 4.6419 4.6419 4.6419 6.4879 6.4879 6.4879 6.4879 7.4103 7.4103 7.4103 7.4103 7.6826 7.6826 7.6826 7.6826 7.9458 7.9458 k = 0.0000 0.1323 0.2028 ( 12580 PWs) bands (ev): -9.6153 -9.6153 -9.6153 -9.6153 -9.3180 -9.3180 -9.3180 -9.3180 -8.5097 -8.5097 -8.5097 -8.5097 -7.0741 -7.0741 -7.0741 -7.0741 -4.0343 -4.0343 -4.0343 -4.0343 -2.0458 -2.0458 -2.0458 -2.0458 0.4396 0.4396 0.4396 0.4396 1.4215 1.4215 1.4215 1.4215 1.7384 1.7384 1.7384 1.7384 2.1197 2.1197 2.1197 2.1197 2.2833 2.2833 2.2833 2.2833 2.8457 2.8457 2.8457 2.8457 3.3808 3.3808 3.3808 3.3808 3.4808 3.4808 3.4808 3.4808 3.6661 3.6661 3.6661 3.6661 3.9315 3.9315 3.9315 3.9315 4.3867 4.3867 4.3867 4.3867 4.6497 4.6497 4.6497 4.6497 6.4934 6.4934 6.4934 6.4934 7.3982 7.3982 7.3982 7.3982 7.6892 7.6892 7.6892 7.6892 7.9564 7.9564 k = 0.0000 0.1203 0.2028 ( 12594 PWs) bands (ev): -9.6225 -9.6225 -9.6225 -9.6225 -9.3095 -9.3095 -9.3095 -9.3095 -8.5080 -8.5080 -8.5080 -8.5080 -7.0784 -7.0784 -7.0784 -7.0784 -4.0350 -4.0350 -4.0350 -4.0350 -2.0467 -2.0467 -2.0467 -2.0467 0.4430 0.4430 0.4430 0.4430 1.4185 1.4185 1.4185 1.4185 1.7356 1.7356 1.7356 1.7356 2.1422 2.1422 2.1422 2.1422 2.3095 2.3095 2.3095 2.3095 2.8586 2.8586 2.8586 2.8586 3.3599 3.3599 3.3599 3.3599 3.4680 3.4680 3.4680 3.4680 3.6529 3.6529 3.6529 3.6529 3.8949 3.8949 3.8949 3.8949 4.3872 4.3872 4.3872 4.3872 4.6573 4.6573 4.6573 4.6573 6.5005 6.5005 6.5005 6.5005 7.3866 7.3866 7.3866 7.3866 7.6933 7.6933 7.6933 7.6933 7.9676 7.9676 k = 0.0000 0.1082 0.2028 ( 12592 PWs) bands (ev): -9.6292 -9.6292 -9.6292 -9.6292 -9.3013 -9.3013 -9.3013 -9.3013 -8.5062 -8.5062 -8.5062 -8.5062 -7.0828 -7.0828 -7.0828 -7.0828 -4.0356 -4.0356 -4.0356 -4.0356 -2.0476 -2.0476 -2.0476 -2.0476 0.4465 0.4465 0.4465 0.4465 1.4156 1.4156 1.4156 1.4156 1.7341 1.7341 1.7341 1.7341 2.1592 2.1592 2.1592 2.1592 2.3422 2.3422 2.3422 2.3422 2.8719 2.8719 2.8719 2.8719 3.3386 3.3386 3.3386 3.3386 3.4544 3.4544 3.4544 3.4544 3.6407 3.6407 3.6407 3.6407 3.8561 3.8561 3.8561 3.8561 4.3876 4.3876 4.3876 4.3876 4.6646 4.6646 4.6646 4.6646 6.5091 6.5091 6.5091 6.5091 7.3754 7.3754 7.3754 7.3754 7.6953 7.6953 7.6953 7.6953 7.9790 7.9790 k = 0.0000 0.0962 0.2028 ( 12584 PWs) bands (ev): -9.6355 -9.6355 -9.6355 -9.6355 -9.2936 -9.2936 -9.2936 -9.2936 -8.5045 -8.5045 -8.5045 -8.5045 -7.0871 -7.0871 -7.0871 -7.0871 -4.0363 -4.0363 -4.0363 -4.0363 -2.0485 -2.0485 -2.0485 -2.0485 0.4500 0.4500 0.4500 0.4500 1.4128 1.4128 1.4128 1.4128 1.7335 1.7335 1.7335 1.7335 2.1713 2.1713 2.1713 2.1713 2.3798 2.3798 2.3798 2.3798 2.8852 2.8852 2.8852 2.8852 3.3175 3.3175 3.3175 3.3175 3.4403 3.4403 3.4403 3.4403 3.6289 3.6289 3.6289 3.6289 3.8165 3.8165 3.8165 3.8165 4.3878 4.3878 4.3878 4.3878 4.6715 4.6715 4.6715 4.6715 6.5189 6.5189 6.5189 6.5189 7.3647 7.3647 7.3647 7.3647 7.6958 7.6958 7.6958 7.6958 7.9901 7.9901 k = 0.0000 0.0842 0.2028 ( 12592 PWs) bands (ev): -9.6413 -9.6413 -9.6413 -9.6413 -9.2866 -9.2866 -9.2866 -9.2866 -8.5028 -8.5028 -8.5028 -8.5028 -7.0911 -7.0911 -7.0911 -7.0911 -4.0368 -4.0368 -4.0368 -4.0368 -2.0495 -2.0495 -2.0495 -2.0495 0.4534 0.4534 0.4534 0.4534 1.4103 1.4103 1.4103 1.4103 1.7337 1.7337 1.7337 1.7337 2.1799 2.1799 2.1799 2.1799 2.4203 2.4203 2.4203 2.4203 2.8982 2.8982 2.8982 2.8982 3.2972 3.2972 3.2972 3.2972 3.4263 3.4263 3.4263 3.4263 3.6167 3.6167 3.6167 3.6167 3.7781 3.7781 3.7781 3.7781 4.3877 4.3877 4.3877 4.3877 4.6779 4.6779 4.6779 4.6779 6.5295 6.5295 6.5295 6.5295 7.3545 7.3545 7.3545 7.3545 7.6952 7.6952 7.6952 7.6952 8.0005 8.0005 k = 0.0000 0.0722 0.2028 ( 12590 PWs) bands (ev): -9.6464 -9.6464 -9.6464 -9.6464 -9.2803 -9.2803 -9.2803 -9.2803 -8.5013 -8.5013 -8.5013 -8.5013 -7.0949 -7.0949 -7.0949 -7.0949 -4.0374 -4.0374 -4.0374 -4.0374 -2.0503 -2.0503 -2.0503 -2.0503 0.4567 0.4567 0.4567 0.4567 1.4080 1.4080 1.4080 1.4080 1.7346 1.7346 1.7346 1.7346 2.1858 2.1858 2.1858 2.1858 2.4618 2.4618 2.4618 2.4618 2.9107 2.9107 2.9107 2.9107 3.2781 3.2781 3.2781 3.2781 3.4128 3.4128 3.4128 3.4128 3.6028 3.6028 3.6028 3.6028 3.7431 3.7431 3.7431 3.7431 4.3873 4.3873 4.3873 4.3873 4.6835 4.6835 4.6835 4.6835 6.5405 6.5405 6.5405 6.5405 7.3449 7.3449 7.3449 7.3449 7.6938 7.6938 7.6938 7.6938 8.0098 8.0098 k = 0.0000 0.0601 0.2028 ( 12596 PWs) bands (ev): -9.6508 -9.6508 -9.6508 -9.6508 -9.2748 -9.2748 -9.2748 -9.2748 -8.4999 -8.4999 -8.4999 -8.4999 -7.0983 -7.0983 -7.0983 -7.0983 -4.0378 -4.0378 -4.0378 -4.0378 -2.0511 -2.0511 -2.0511 -2.0511 0.4596 0.4596 0.4596 0.4596 1.4060 1.4060 1.4060 1.4060 1.7358 1.7358 1.7358 1.7358 2.1899 2.1899 2.1899 2.1899 2.5022 2.5022 2.5022 2.5022 2.9224 2.9224 2.9224 2.9224 3.2605 3.2605 3.2605 3.2605 3.4005 3.4005 3.4005 3.4005 3.5861 3.5861 3.5861 3.5861 3.7139 3.7139 3.7139 3.7139 4.3868 4.3868 4.3868 4.3868 4.6885 4.6885 4.6885 4.6885 6.5512 6.5512 6.5512 6.5512 7.3361 7.3361 7.3361 7.3361 7.6921 7.6921 7.6921 7.6921 8.0180 8.0180 k = 0.0000 0.0481 0.2028 ( 12604 PWs) bands (ev): -9.6544 -9.6544 -9.6544 -9.6544 -9.2703 -9.2703 -9.2703 -9.2703 -8.4987 -8.4987 -8.4987 -8.4987 -7.1012 -7.1012 -7.1012 -7.1012 -4.0382 -4.0382 -4.0382 -4.0382 -2.0518 -2.0518 -2.0518 -2.0518 0.4622 0.4622 0.4622 0.4622 1.4043 1.4043 1.4043 1.4043 1.7372 1.7372 1.7372 1.7372 2.1927 2.1927 2.1927 2.1927 2.5397 2.5397 2.5397 2.5397 2.9329 2.9329 2.9329 2.9329 3.2445 3.2445 3.2445 3.2445 3.3900 3.3900 3.3900 3.3900 3.5666 3.5666 3.5666 3.5666 3.6922 3.6922 3.6922 3.6922 4.3862 4.3862 4.3862 4.3862 4.6926 4.6926 4.6926 4.6926 6.5611 6.5611 6.5611 6.5611 7.3283 7.3283 7.3283 7.3283 7.6903 7.6903 7.6903 7.6903 8.0248 8.0248 k = 0.0000 0.0361 0.2028 ( 12604 PWs) bands (ev): -9.6573 -9.6573 -9.6573 -9.6573 -9.2667 -9.2667 -9.2667 -9.2667 -8.4977 -8.4977 -8.4977 -8.4977 -7.1035 -7.1035 -7.1035 -7.1035 -4.0385 -4.0385 -4.0385 -4.0385 -2.0524 -2.0524 -2.0524 -2.0524 0.4643 0.4643 0.4643 0.4643 1.4030 1.4030 1.4030 1.4030 1.7385 1.7385 1.7385 1.7385 2.1945 2.1945 2.1945 2.1945 2.5720 2.5720 2.5720 2.5720 2.9419 2.9419 2.9419 2.9419 3.2305 3.2305 3.2305 3.2305 3.3820 3.3820 3.3820 3.3820 3.5462 3.5462 3.5462 3.5462 3.6777 3.6777 3.6777 3.6777 4.3856 4.3856 4.3856 4.3856 4.6958 4.6958 4.6958 4.6958 6.5697 6.5697 6.5697 6.5697 7.3219 7.3219 7.3219 7.3219 7.6887 7.6887 7.6887 7.6887 8.0301 8.0301 k = 0.0000 0.0241 0.2028 ( 12614 PWs) bands (ev): -9.6594 -9.6594 -9.6594 -9.6594 -9.2641 -9.2641 -9.2641 -9.2641 -8.4970 -8.4970 -8.4970 -8.4970 -7.1052 -7.1052 -7.1052 -7.1052 -4.0388 -4.0388 -4.0388 -4.0388 -2.0528 -2.0528 -2.0528 -2.0528 0.4659 0.4659 0.4659 0.4659 1.4020 1.4020 1.4020 1.4020 1.7397 1.7397 1.7397 1.7397 2.1956 2.1956 2.1956 2.1956 2.5973 2.5973 2.5973 2.5973 2.9490 2.9490 2.9490 2.9490 3.2191 3.2191 3.2191 3.2191 3.3767 3.3767 3.3767 3.3767 3.5281 3.5281 3.5281 3.5281 3.6688 3.6688 3.6688 3.6688 4.3851 4.3851 4.3851 4.3851 4.6981 4.6981 4.6981 4.6981 6.5762 6.5762 6.5762 6.5762 7.3171 7.3171 7.3171 7.3171 7.6874 7.6874 7.6874 7.6874 8.0340 8.0340 k = 0.0000 0.0120 0.2028 ( 12582 PWs) bands (ev): -9.6607 -9.6607 -9.6607 -9.6607 -9.2625 -9.2625 -9.2625 -9.2625 -8.4965 -8.4965 -8.4965 -8.4965 -7.1063 -7.1063 -7.1063 -7.1063 -4.0389 -4.0389 -4.0389 -4.0389 -2.0531 -2.0531 -2.0531 -2.0531 0.4669 0.4669 0.4669 0.4669 1.4014 1.4014 1.4014 1.4014 1.7404 1.7404 1.7404 1.7404 2.1962 2.1962 2.1962 2.1962 2.6134 2.6134 2.6134 2.6134 2.9536 2.9536 2.9536 2.9536 3.2115 3.2115 3.2115 3.2115 3.3739 3.3739 3.3739 3.3739 3.5157 3.5157 3.5157 3.5157 3.6640 3.6640 3.6640 3.6640 4.3848 4.3848 4.3848 4.3848 4.6995 4.6995 4.6995 4.6995 6.5803 6.5803 6.5803 6.5803 7.3140 7.3140 7.3140 7.3140 7.6865 7.6865 7.6865 7.6865 8.0363 8.0363 k = 0.0000 0.0000 0.2028 ( 12586 PWs) bands (ev): -9.6611 -9.6611 -9.6611 -9.6611 -9.2620 -9.2620 -9.2620 -9.2620 -8.4964 -8.4964 -8.4964 -8.4964 -7.1066 -7.1066 -7.1066 -7.1066 -4.0390 -4.0390 -4.0390 -4.0390 -2.0532 -2.0532 -2.0532 -2.0532 0.4672 0.4672 0.4672 0.4672 1.4012 1.4012 1.4012 1.4012 1.7407 1.7407 1.7407 1.7407 2.1964 2.1964 2.1964 2.1964 2.6189 2.6189 2.6189 2.6189 2.9553 2.9553 2.9553 2.9553 3.2088 3.2088 3.2088 3.2088 3.3731 3.3731 3.3731 3.3731 3.5112 3.5112 3.5112 3.5112 3.6625 3.6625 3.6625 3.6625 4.3847 4.3847 4.3847 4.3847 4.7000 4.7000 4.7000 4.7000 6.5817 6.5817 6.5817 6.5817 7.3130 7.3130 7.3130 7.3130 7.6862 7.6862 7.6862 7.6862 8.0370 8.0370 k = 0.0000 0.2405-0.0000 ( 12630 PWs) bands (ev): -9.6421 -9.6421 -9.6421 -9.6421 -9.2443 -9.2443 -9.2443 -9.2443 -8.5842 -8.5842 -8.5842 -8.5842 -7.0483 -7.0483 -7.0483 -7.0483 -4.0110 -4.0110 -4.0110 -4.0110 -2.0052 -2.0052 -2.0052 -2.0052 0.2754 0.2754 0.2754 0.2754 1.3171 1.3171 1.3171 1.3171 1.5021 1.5021 1.5021 1.5021 2.3765 2.3765 2.3765 2.3765 2.7556 2.7556 2.7556 2.7556 2.8749 2.8749 2.8749 2.8749 3.1885 3.1885 3.1885 3.1885 3.2782 3.2782 3.2782 3.2782 3.6890 3.6890 3.6890 3.6890 3.9467 3.9467 3.9467 3.9467 4.3426 4.3426 4.3426 4.3426 4.7080 4.7080 4.7080 4.7080 6.8705 6.8705 6.8705 6.8705 7.3187 7.3187 7.3187 7.3187 7.7007 7.7007 7.7007 7.7007 7.8810 7.8810 k = 0.0000 0.2405 0.0119 ( 12614 PWs) bands (ev): -9.6416 -9.6416 -9.6416 -9.6416 -9.2453 -9.2453 -9.2453 -9.2453 -8.5836 -8.5836 -8.5836 -8.5836 -7.0483 -7.0483 -7.0483 -7.0483 -4.0112 -4.0112 -4.0112 -4.0112 -2.0056 -2.0056 -2.0056 -2.0056 0.2766 0.2766 0.2766 0.2766 1.3185 1.3185 1.3185 1.3185 1.5028 1.5028 1.5028 1.5028 2.3724 2.3724 2.3724 2.3724 2.7451 2.7451 2.7451 2.7451 2.8817 2.8817 2.8817 2.8817 3.1862 3.1862 3.1862 3.1862 3.2854 3.2854 3.2854 3.2854 3.6890 3.6890 3.6890 3.6890 3.9485 3.9485 3.9485 3.9485 4.3426 4.3426 4.3426 4.3426 4.7072 4.7072 4.7072 4.7072 6.8659 6.8659 6.8659 6.8659 7.3218 7.3218 7.3218 7.3218 7.6995 7.6995 7.6995 7.6995 7.8815 7.8815 k = 0.0000 0.2405 0.0239 ( 12618 PWs) bands (ev): -9.6403 -9.6403 -9.6403 -9.6403 -9.2482 -9.2482 -9.2482 -9.2482 -8.5818 -8.5818 -8.5818 -8.5818 -7.0484 -7.0484 -7.0484 -7.0484 -4.0117 -4.0117 -4.0117 -4.0117 -2.0065 -2.0065 -2.0065 -2.0065 0.2801 0.2801 0.2801 0.2801 1.3227 1.3227 1.3227 1.3227 1.5049 1.5049 1.5049 1.5049 2.3605 2.3605 2.3605 2.3605 2.7195 2.7195 2.7195 2.7195 2.8956 2.8956 2.8956 2.8956 3.1825 3.1825 3.1825 3.1825 3.3039 3.3039 3.3039 3.3039 3.6889 3.6889 3.6889 3.6889 3.9536 3.9536 3.9536 3.9536 4.3428 4.3428 4.3428 4.3428 4.7048 4.7048 4.7048 4.7048 6.8526 6.8526 6.8526 6.8526 7.3304 7.3304 7.3304 7.3304 7.6961 7.6961 7.6961 7.6961 7.8829 7.8829 k = 0.0000 0.2405 0.0358 ( 12624 PWs) bands (ev): -9.6380 -9.6380 -9.6380 -9.6380 -9.2530 -9.2530 -9.2530 -9.2530 -8.5788 -8.5788 -8.5788 -8.5788 -7.0485 -7.0485 -7.0485 -7.0485 -4.0125 -4.0125 -4.0125 -4.0125 -2.0081 -2.0081 -2.0081 -2.0081 0.2859 0.2859 0.2859 0.2859 1.3295 1.3295 1.3295 1.3295 1.5086 1.5086 1.5086 1.5086 2.3414 2.3414 2.3414 2.3414 2.6866 2.6866 2.6866 2.6866 2.9074 2.9074 2.9074 2.9074 3.1834 3.1834 3.1834 3.1834 3.3292 3.3292 3.3292 3.3292 3.6887 3.6887 3.6887 3.6887 3.9619 3.9619 3.9619 3.9619 4.3431 4.3431 4.3431 4.3431 4.7010 4.7010 4.7010 4.7010 6.8318 6.8318 6.8318 6.8318 7.3434 7.3434 7.3434 7.3434 7.6905 7.6905 7.6905 7.6905 7.8850 7.8850 k = 0.0000 0.2405 0.0477 ( 12616 PWs) bands (ev): -9.6348 -9.6348 -9.6348 -9.6348 -9.2595 -9.2595 -9.2595 -9.2595 -8.5749 -8.5749 -8.5749 -8.5749 -7.0486 -7.0486 -7.0486 -7.0486 -4.0136 -4.0136 -4.0136 -4.0136 -2.0101 -2.0101 -2.0101 -2.0101 0.2937 0.2937 0.2937 0.2937 1.3385 1.3385 1.3385 1.3385 1.5140 1.5140 1.5140 1.5140 2.3162 2.3162 2.3162 2.3162 2.6500 2.6500 2.6500 2.6500 2.9121 2.9121 2.9121 2.9121 3.1919 3.1919 3.1919 3.1919 3.3584 3.3584 3.3584 3.3584 3.6884 3.6884 3.6884 3.6884 3.9729 3.9729 3.9729 3.9729 4.3436 4.3436 4.3436 4.3436 4.6957 4.6957 4.6957 4.6957 6.8052 6.8052 6.8052 6.8052 7.3593 7.3593 7.3593 7.3593 7.6832 7.6832 7.6832 7.6832 7.8876 7.8876 k = 0.0000 0.2405 0.0596 ( 12598 PWs) bands (ev): -9.6308 -9.6308 -9.6308 -9.6308 -9.2675 -9.2675 -9.2675 -9.2675 -8.5701 -8.5701 -8.5701 -8.5701 -7.0488 -7.0488 -7.0488 -7.0488 -4.0149 -4.0149 -4.0149 -4.0149 -2.0127 -2.0127 -2.0127 -2.0127 0.3033 0.3033 0.3033 0.3033 1.3494 1.3494 1.3494 1.3494 1.5216 1.5216 1.5216 1.5216 2.2861 2.2861 2.2861 2.2861 2.6114 2.6114 2.6114 2.6114 2.9090 2.9090 2.9090 2.9090 3.2084 3.2084 3.2084 3.2084 3.3900 3.3900 3.3900 3.3900 3.6880 3.6880 3.6880 3.6880 3.9857 3.9857 3.9857 3.9857 4.3446 4.3446 4.3446 4.3446 4.6891 4.6891 4.6891 4.6891 6.7745 6.7745 6.7745 6.7745 7.3770 7.3770 7.3770 7.3770 7.6745 7.6745 7.6745 7.6745 7.8905 7.8905 k = 0.0000 0.2405 0.0716 ( 12594 PWs) bands (ev): -9.6261 -9.6261 -9.6261 -9.6261 -9.2768 -9.2768 -9.2768 -9.2768 -8.5647 -8.5647 -8.5647 -8.5647 -7.0490 -7.0490 -7.0490 -7.0490 -4.0164 -4.0164 -4.0164 -4.0164 -2.0156 -2.0156 -2.0156 -2.0156 0.3145 0.3145 0.3145 0.3145 1.3615 1.3615 1.3615 1.3615 1.5316 1.5316 1.5316 1.5316 2.2525 2.2525 2.2525 2.2525 2.5712 2.5712 2.5712 2.5712 2.8997 2.8997 2.8997 2.8997 3.2310 3.2310 3.2310 3.2310 3.4226 3.4226 3.4226 3.4226 3.6876 3.6876 3.6876 3.6876 3.9997 3.9997 3.9997 3.9997 4.3461 4.3461 4.3461 4.3461 4.6815 4.6815 4.6815 4.6815 6.7412 6.7412 6.7412 6.7412 7.3951 7.3951 7.3951 7.3951 7.6648 7.6648 7.6648 7.6648 7.8935 7.8935 k = 0.0000 0.2405 0.0835 ( 12598 PWs) bands (ev): -9.6206 -9.6206 -9.6206 -9.6206 -9.2872 -9.2872 -9.2872 -9.2872 -8.5589 -8.5589 -8.5589 -8.5589 -7.0493 -7.0493 -7.0493 -7.0493 -4.0181 -4.0181 -4.0181 -4.0181 -2.0188 -2.0188 -2.0188 -2.0188 0.3269 0.3269 0.3269 0.3269 1.3741 1.3741 1.3741 1.3741 1.5446 1.5446 1.5446 1.5446 2.2165 2.2165 2.2165 2.2165 2.5298 2.5298 2.5298 2.5298 2.8863 2.8863 2.8863 2.8863 3.2574 3.2574 3.2574 3.2574 3.4553 3.4553 3.4553 3.4553 3.6876 3.6876 3.6876 3.6876 4.0139 4.0139 4.0139 4.0139 4.3484 4.3484 4.3484 4.3484 4.6729 4.6729 4.6729 4.6729 6.7065 6.7065 6.7065 6.7065 7.4129 7.4129 7.4129 7.4129 7.6544 7.6544 7.6544 7.6544 7.8964 7.8964 k = 0.0000 0.2405 0.0954 ( 12608 PWs) bands (ev): -9.6145 -9.6145 -9.6145 -9.6145 -9.2983 -9.2983 -9.2983 -9.2983 -8.5528 -8.5528 -8.5528 -8.5528 -7.0495 -7.0495 -7.0495 -7.0495 -4.0199 -4.0199 -4.0199 -4.0199 -2.0221 -2.0221 -2.0221 -2.0221 0.3401 0.3401 0.3401 0.3401 1.3866 1.3866 1.3866 1.3866 1.5611 1.5611 1.5611 1.5611 2.1793 2.1793 2.1793 2.1793 2.4877 2.4877 2.4877 2.4877 2.8708 2.8708 2.8708 2.8708 3.2856 3.2856 3.2856 3.2856 3.4865 3.4865 3.4865 3.4865 3.6886 3.6886 3.6886 3.6886 4.0274 4.0274 4.0274 4.0274 4.3517 4.3517 4.3517 4.3517 4.6637 4.6637 4.6637 4.6637 6.6716 6.6716 6.6716 6.6716 7.4300 7.4300 7.4300 7.4300 7.6436 7.6436 7.6436 7.6436 7.8991 7.8991 k = 0.0000 0.2405 0.1074 ( 12592 PWs) bands (ev): -9.6079 -9.6079 -9.6079 -9.6079 -9.3099 -9.3099 -9.3099 -9.3099 -8.5468 -8.5468 -8.5468 -8.5468 -7.0498 -7.0498 -7.0498 -7.0498 -4.0216 -4.0216 -4.0216 -4.0216 -2.0254 -2.0254 -2.0254 -2.0254 0.3538 0.3538 0.3538 0.3538 1.3982 1.3982 1.3982 1.3982 1.5813 1.5813 1.5813 1.5813 2.1417 2.1417 2.1417 2.1417 2.4452 2.4452 2.4452 2.4452 2.8548 2.8548 2.8548 2.8548 3.3142 3.3142 3.3142 3.3142 3.5145 3.5145 3.5145 3.5145 3.6918 3.6918 3.6918 3.6918 4.0392 4.0392 4.0392 4.0392 4.3561 4.3561 4.3561 4.3561 4.6540 4.6540 4.6540 4.6540 6.6373 6.6373 6.6373 6.6373 7.4458 7.4458 7.4458 7.4458 7.6328 7.6328 7.6328 7.6328 7.9014 7.9014 k = 0.0000 0.2405 0.1193 ( 12558 PWs) bands (ev): -9.6010 -9.6010 -9.6010 -9.6010 -9.3217 -9.3217 -9.3217 -9.3217 -8.5410 -8.5410 -8.5410 -8.5410 -7.0500 -7.0500 -7.0500 -7.0500 -4.0234 -4.0234 -4.0234 -4.0234 -2.0287 -2.0287 -2.0287 -2.0287 0.3673 0.3673 0.3673 0.3673 1.4085 1.4085 1.4085 1.4085 1.6054 1.6054 1.6054 1.6054 2.1045 2.1045 2.1045 2.1045 2.4030 2.4030 2.4030 2.4030 2.8392 2.8392 2.8392 2.8392 3.3423 3.3423 3.3423 3.3423 3.5371 3.5371 3.5371 3.5371 3.6986 3.6986 3.6986 3.6986 4.0487 4.0487 4.0487 4.0487 4.3618 4.3618 4.3618 4.3618 4.6442 4.6442 4.6442 4.6442 6.6048 6.6048 6.6048 6.6048 7.4601 7.4601 7.4601 7.4601 7.6223 7.6223 7.6223 7.6223 7.9035 7.9035 k = 0.0000 0.2405 0.1312 ( 12562 PWs) bands (ev): -9.5939 -9.5939 -9.5939 -9.5939 -9.3332 -9.3332 -9.3332 -9.3332 -8.5355 -8.5355 -8.5355 -8.5355 -7.0503 -7.0503 -7.0503 -7.0503 -4.0251 -4.0251 -4.0251 -4.0251 -2.0318 -2.0318 -2.0318 -2.0318 0.3804 0.3804 0.3804 0.3804 1.4172 1.4172 1.4172 1.4172 1.6332 1.6332 1.6332 1.6332 2.0681 2.0681 2.0681 2.0681 2.3620 2.3620 2.3620 2.3620 2.8248 2.8248 2.8248 2.8248 3.3694 3.3694 3.3694 3.3694 3.5524 3.5524 3.5524 3.5524 3.7099 3.7099 3.7099 3.7099 4.0555 4.0555 4.0555 4.0555 4.3686 4.3686 4.3686 4.3686 4.6345 4.6345 4.6345 4.6345 6.5746 6.5746 6.5746 6.5746 7.4730 7.4730 7.4730 7.4730 7.6123 7.6123 7.6123 7.6123 7.9051 7.9051 k = 0.0000 0.2405 0.1431 ( 12564 PWs) bands (ev): -9.5870 -9.5870 -9.5870 -9.5870 -9.3442 -9.3442 -9.3442 -9.3442 -8.5306 -8.5306 -8.5306 -8.5306 -7.0505 -7.0505 -7.0505 -7.0505 -4.0266 -4.0266 -4.0266 -4.0266 -2.0346 -2.0346 -2.0346 -2.0346 0.3924 0.3924 0.3924 0.3924 1.4243 1.4243 1.4243 1.4243 1.6640 1.6640 1.6640 1.6640 2.0327 2.0327 2.0327 2.0327 2.3232 2.3232 2.3232 2.3232 2.8120 2.8120 2.8120 2.8120 3.3950 3.3950 3.3950 3.3950 3.5599 3.5599 3.5599 3.5599 3.7256 3.7256 3.7256 3.7256 4.0592 4.0592 4.0592 4.0592 4.3762 4.3762 4.3762 4.3762 4.6254 4.6254 4.6254 4.6254 6.5476 6.5476 6.5476 6.5476 7.4842 7.4842 7.4842 7.4842 7.6031 7.6031 7.6031 7.6031 7.9065 7.9065 k = 0.0000 0.2405 0.1551 ( 12568 PWs) bands (ev): -9.5804 -9.5804 -9.5804 -9.5804 -9.3542 -9.3542 -9.3542 -9.3542 -8.5264 -8.5264 -8.5264 -8.5264 -7.0507 -7.0507 -7.0507 -7.0507 -4.0279 -4.0279 -4.0279 -4.0279 -2.0370 -2.0370 -2.0370 -2.0370 0.4030 0.4030 0.4030 0.4030 1.4300 1.4300 1.4300 1.4300 1.6972 1.6972 1.6972 1.6972 1.9983 1.9983 1.9983 1.9983 2.2881 2.2881 2.2881 2.2881 2.8011 2.8011 2.8011 2.8011 3.4188 3.4188 3.4188 3.4188 3.5608 3.5608 3.5608 3.5608 3.7435 3.7435 3.7435 3.7435 4.0604 4.0604 4.0604 4.0604 4.3840 4.3840 4.3840 4.3840 4.6170 4.6170 4.6170 4.6170 6.5245 6.5245 6.5245 6.5245 7.4937 7.4937 7.4937 7.4937 7.5948 7.5948 7.5948 7.5948 7.9075 7.9075 k = 0.0000 0.2405 0.1670 ( 12564 PWs) bands (ev): -9.5747 -9.5747 -9.5747 -9.5747 -9.3627 -9.3627 -9.3627 -9.3627 -8.5230 -8.5230 -8.5230 -8.5230 -7.0509 -7.0509 -7.0509 -7.0509 -4.0290 -4.0290 -4.0290 -4.0290 -2.0390 -2.0390 -2.0390 -2.0390 0.4118 0.4118 0.4118 0.4118 1.4343 1.4343 1.4343 1.4343 1.7317 1.7317 1.7317 1.7317 1.9650 1.9650 1.9650 1.9650 2.2582 2.2582 2.2582 2.2582 2.7925 2.7925 2.7925 2.7925 3.4402 3.4402 3.4402 3.4402 3.5571 3.5571 3.5571 3.5571 3.7611 3.7611 3.7611 3.7611 4.0597 4.0597 4.0597 4.0597 4.3913 4.3913 4.3913 4.3913 4.6099 4.6099 4.6099 4.6099 6.5059 6.5059 6.5059 6.5059 7.5014 7.5014 7.5014 7.5014 7.5878 7.5878 7.5878 7.5878 7.9082 7.9082 k = 0.0000 0.2405 0.1789 ( 12560 PWs) bands (ev): -9.5701 -9.5701 -9.5701 -9.5701 -9.3693 -9.3693 -9.3693 -9.3693 -8.5206 -8.5206 -8.5206 -8.5206 -7.0510 -7.0510 -7.0510 -7.0510 -4.0298 -4.0298 -4.0298 -4.0298 -2.0404 -2.0404 -2.0404 -2.0404 0.4183 0.4183 0.4183 0.4183 1.4373 1.4373 1.4373 1.4373 1.7659 1.7659 1.7659 1.7659 1.9329 1.9329 1.9329 1.9329 2.2352 2.2352 2.2352 2.2352 2.7862 2.7862 2.7862 2.7862 3.4585 3.4585 3.4585 3.4585 3.5507 3.5507 3.5507 3.5507 3.7757 3.7757 3.7757 3.7757 4.0579 4.0579 4.0579 4.0579 4.3973 4.3973 4.3973 4.3973 4.6044 4.6044 4.6044 4.6044 6.4922 6.4922 6.4922 6.4922 7.5073 7.5073 7.5073 7.5073 7.5824 7.5824 7.5824 7.5824 7.9087 7.9087 k = 0.0000 0.2405 0.1909 ( 12552 PWs) bands (ev): -9.5672 -9.5672 -9.5672 -9.5672 -9.3735 -9.3735 -9.3735 -9.3735 -8.5190 -8.5190 -8.5190 -8.5190 -7.0511 -7.0511 -7.0511 -7.0511 -4.0303 -4.0303 -4.0303 -4.0303 -2.0413 -2.0413 -2.0413 -2.0413 0.4223 0.4223 0.4223 0.4223 1.4391 1.4391 1.4391 1.4391 1.7964 1.7964 1.7964 1.7964 1.9043 1.9043 1.9043 1.9043 2.2206 2.2206 2.2206 2.2206 2.7824 2.7824 2.7824 2.7824 3.4718 3.4718 3.4718 3.4718 3.5443 3.5443 3.5443 3.5443 3.7854 3.7854 3.7854 3.7854 4.0563 4.0563 4.0563 4.0563 4.4012 4.4012 4.4012 4.4012 4.6009 4.6009 4.6009 4.6009 6.4838 6.4838 6.4838 6.4838 7.5110 7.5110 7.5110 7.5110 7.5789 7.5789 7.5789 7.5789 7.9090 7.9090 k = 0.0000 0.2405 0.2028 ( 12552 PWs) bands (ev): -9.5662 -9.5662 -9.5662 -9.5662 -9.3749 -9.3749 -9.3749 -9.3749 -8.5185 -8.5185 -8.5185 -8.5185 -7.0511 -7.0511 -7.0511 -7.0511 -4.0305 -4.0305 -4.0305 -4.0305 -2.0416 -2.0416 -2.0416 -2.0416 0.4237 0.4237 0.4237 0.4237 1.4397 1.4397 1.4397 1.4397 1.8115 1.8115 1.8115 1.8115 1.8900 1.8900 1.8900 1.8900 2.2156 2.2156 2.2156 2.2156 2.7811 2.7811 2.7811 2.7811 3.4770 3.4770 3.4770 3.4770 3.5413 3.5413 3.5413 3.5413 3.7888 3.7888 3.7888 3.7888 4.0557 4.0557 4.0557 4.0557 4.4026 4.4026 4.4026 4.4026 4.5997 4.5997 4.5997 4.5997 6.4810 6.4810 6.4810 6.4810 7.5123 7.5123 7.5123 7.5123 7.5777 7.5777 7.5777 7.5777 7.9091 7.9091 k = 0.5000-0.0000 0.2028 ( 12540 PWs) bands (ev): -9.0754 -9.0754 -9.0754 -9.0754 -8.9509 -8.9509 -8.9509 -8.9509 -7.6760 -7.6760 -7.6760 -7.6760 -7.5402 -7.5402 -7.5402 -7.5402 -3.6936 -3.6936 -3.6936 -3.6936 -3.6374 -3.6374 -3.6374 -3.6374 -0.0994 -0.0994 -0.0994 -0.0994 0.1977 0.1977 0.1977 0.1977 0.9147 0.9147 0.9147 0.9147 1.2359 1.2359 1.2359 1.2359 2.0564 2.0564 2.0564 2.0564 2.1566 2.1566 2.1566 2.1566 2.9438 2.9438 2.9438 2.9438 3.3087 3.3087 3.3087 3.3087 3.4687 3.4687 3.4687 3.4687 3.6973 3.6973 3.6973 3.6973 3.8650 3.8650 3.8650 3.8650 4.7113 4.7113 4.7113 4.7113 7.4640 7.4640 7.4640 7.4640 7.6275 7.6275 7.6275 7.6275 7.9625 7.9625 7.9625 7.9625 8.6080 8.6080 k = 0.5000-0.0000 0.1909 ( 12544 PWs) bands (ev): -9.0754 -9.0754 -9.0754 -9.0754 -8.9509 -8.9509 -8.9509 -8.9509 -7.6758 -7.6758 -7.6757 -7.6757 -7.5405 -7.5405 -7.5404 -7.5404 -3.6937 -3.6937 -3.6937 -3.6937 -3.6372 -3.6372 -3.6372 -3.6372 -0.1025 -0.1025 -0.0973 -0.0973 0.1900 0.1900 0.2005 0.2005 0.9099 0.9099 0.9205 0.9205 1.2387 1.2387 1.2436 1.2436 2.0314 2.0314 2.0512 2.0512 2.1609 2.1609 2.1880 2.1880 2.9309 2.9309 2.9501 2.9501 3.3044 3.3044 3.3173 3.3173 3.4655 3.4655 3.4695 3.4695 3.6915 3.6915 3.6992 3.6992 3.8617 3.8617 3.8638 3.8638 4.7082 4.7082 4.7087 4.7087 7.4448 7.4448 7.4794 7.4794 7.6183 7.6183 7.6505 7.6505 7.9635 7.9635 7.9689 7.9689 8.6085 8.6085 k = 0.5000-0.0000 0.1789 ( 12542 PWs) bands (ev): -9.0754 -9.0754 -9.0754 -9.0754 -8.9509 -8.9509 -8.9509 -8.9509 -7.6749 -7.6749 -7.6748 -7.6748 -7.5413 -7.5413 -7.5412 -7.5412 -3.6941 -3.6941 -3.6940 -3.6940 -3.6367 -3.6367 -3.6366 -3.6366 -0.1066 -0.1066 -0.0964 -0.0964 0.1780 0.1780 0.1983 0.1983 0.9069 0.9069 0.9268 0.9268 1.2522 1.2522 1.2611 1.2611 1.9980 1.9980 2.0215 2.0215 2.1948 2.1948 2.2334 2.2334 2.9122 2.9122 2.9494 2.9494 3.3047 3.3047 3.3293 3.3293 3.4604 3.4604 3.4677 3.4677 3.6821 3.6821 3.6971 3.6971 3.8539 3.8539 3.8580 3.8580 4.6993 4.6993 4.7004 4.7004 7.4267 7.4267 7.4855 7.4855 7.6285 7.6285 7.6820 7.6820 7.9718 7.9718 7.9834 7.9834 8.6114 8.6114 k = 0.5000-0.0000 0.1670 ( 12538 PWs) bands (ev): -9.0755 -9.0755 -9.0755 -9.0755 -8.9509 -8.9509 -8.9509 -8.9509 -7.6736 -7.6736 -7.6734 -7.6734 -7.5427 -7.5427 -7.5425 -7.5425 -3.6947 -3.6947 -3.6946 -3.6946 -3.6358 -3.6358 -3.6356 -3.6356 -0.1114 -0.1114 -0.0964 -0.0964 0.1621 0.1621 0.1911 0.1911 0.9063 0.9063 0.9334 0.9334 1.2754 1.2754 1.2874 1.2874 1.9650 1.9650 1.9875 1.9875 2.2380 2.2380 2.2841 2.2841 2.8887 2.8887 2.9422 2.9422 3.3085 3.3085 3.3428 3.3428 3.4544 3.4544 3.4633 3.4633 3.6701 3.6701 3.6908 3.6908 3.8421 3.8421 3.8481 3.8481 4.6850 4.6850 4.6865 4.6865 7.4121 7.4121 7.4828 7.4828 7.6573 7.6573 7.7187 7.7187 7.9870 7.9870 8.0062 8.0062 8.6164 8.6164 k = 0.5000-0.0000 0.1551 ( 12546 PWs) bands (ev): -9.0756 -9.0756 -9.0756 -9.0756 -8.9509 -8.9509 -8.9509 -8.9509 -7.6716 -7.6716 -7.6714 -7.6714 -7.5446 -7.5446 -7.5444 -7.5444 -3.6955 -3.6955 -3.6954 -3.6954 -3.6346 -3.6346 -3.6344 -3.6344 -0.1169 -0.1169 -0.0973 -0.0973 0.1431 0.1431 0.1796 0.1796 0.9085 0.9085 0.9404 0.9404 1.3070 1.3070 1.3211 1.3211 1.9349 1.9349 1.9552 1.9552 2.2841 2.2841 2.3378 2.3378 2.8613 2.8613 2.9295 2.9295 3.3134 3.3134 3.3556 3.3556 3.4491 3.4491 3.4567 3.4567 3.6568 3.6568 3.6805 3.6805 3.8271 3.8271 3.8345 3.8345 4.6655 4.6655 4.6672 4.6672 7.4016 7.4016 7.4767 7.4767 7.6983 7.6983 7.7587 7.7587 8.0089 8.0089 8.0377 8.0377 8.6230 8.6230 k = 0.5000-0.0000 0.1431 ( 12562 PWs) bands (ev): -9.0757 -9.0757 -9.0757 -9.0757 -8.9509 -8.9509 -8.9509 -8.9509 -7.6692 -7.6692 -7.6689 -7.6689 -7.5471 -7.5471 -7.5467 -7.5467 -3.6965 -3.6965 -3.6964 -3.6964 -3.6332 -3.6332 -3.6330 -3.6330 -0.1226 -0.1226 -0.0988 -0.0988 0.1219 0.1219 0.1643 0.1643 0.9133 0.9133 0.9478 0.9478 1.3454 1.3454 1.3608 1.3608 1.9090 1.9090 1.9264 1.9264 2.3307 2.3307 2.3934 2.3934 2.8306 2.8306 2.9129 2.9129 3.3155 3.3155 3.3647 3.3647 3.4472 3.4472 3.4486 3.4486 3.6442 3.6442 3.6662 3.6662 3.8101 3.8101 3.8181 3.8181 4.6412 4.6412 4.6429 4.6429 7.3955 7.3955 7.4709 7.4709 7.7468 7.7468 7.8004 7.8004 8.0372 8.0372 8.0779 8.0779 8.6307 8.6307 k = 0.5000-0.0000 0.1312 ( 12562 PWs) bands (ev): -9.0758 -9.0758 -9.0758 -9.0758 -8.9509 -8.9509 -8.9509 -8.9509 -7.6663 -7.6663 -7.6658 -7.6658 -7.5500 -7.5500 -7.5496 -7.5496 -3.6975 -3.6975 -3.6974 -3.6974 -3.6317 -3.6317 -3.6314 -3.6314 -0.1283 -0.1283 -0.1007 -0.1007 0.0991 0.0991 0.1461 0.1461 0.9205 0.9205 0.9557 0.9557 1.3887 1.3887 1.4051 1.4051 1.8881 1.8881 1.9021 1.9021 2.3760 2.3760 2.4501 2.4501 2.7975 2.7975 2.8943 2.8943 3.3111 3.3111 3.3662 3.3662 3.4400 3.4400 3.4514 3.4514 3.6348 3.6348 3.6480 3.6480 3.7925 3.7925 3.7996 3.7996 4.6124 4.6124 4.6141 4.6141 7.3934 7.3934 7.4669 7.4669 7.7999 7.7999 7.8432 7.8432 8.0714 8.0714 8.1263 8.1263 8.6388 8.6388 k = 0.5000-0.0000 0.1193 ( 12570 PWs) bands (ev): -9.0760 -9.0760 -9.0760 -9.0760 -8.9509 -8.9509 -8.9509 -8.9509 -7.6628 -7.6628 -7.6624 -7.6624 -7.5534 -7.5534 -7.5529 -7.5529 -3.6986 -3.6986 -3.6984 -3.6984 -3.6300 -3.6300 -3.6297 -3.6297 -0.1338 -0.1338 -0.1026 -0.1026 0.0754 0.0754 0.1257 0.1257 0.9294 0.9294 0.9639 0.9639 1.4351 1.4351 1.4526 1.4526 1.8731 1.8731 1.8831 1.8831 2.4179 2.4179 2.5069 2.5069 2.7625 2.7625 2.8757 2.8757 3.2986 3.2986 3.3577 3.3577 3.4310 3.4310 3.4620 3.4620 3.6259 3.6259 3.6311 3.6311 3.7762 3.7762 3.7803 3.7803 4.5799 4.5799 4.5811 4.5811 7.3949 7.3949 7.4649 7.4649 7.8558 7.8558 7.8866 7.8866 8.1111 8.1111 8.1818 8.1818 8.6465 8.6465 k = 0.5000-0.0000 0.1074 ( 12562 PWs) bands (ev): -9.0761 -9.0761 -9.0761 -9.0761 -8.9509 -8.9509 -8.9509 -8.9509 -7.6590 -7.6590 -7.6585 -7.6585 -7.5571 -7.5571 -7.5566 -7.5566 -3.6996 -3.6996 -3.6995 -3.6995 -3.6283 -3.6283 -3.6280 -3.6280 -0.1387 -0.1387 -0.1044 -0.1044 0.0514 0.0514 0.1040 0.1040 0.9394 0.9394 0.9721 0.9721 1.4825 1.4825 1.5017 1.5017 1.8649 1.8649 1.8702 1.8702 2.4539 2.4539 2.5620 2.5620 2.7272 2.7272 2.8601 2.8601 3.2793 3.2793 3.3402 3.3402 3.4196 3.4196 3.4766 3.4766 3.6004 3.6004 3.6340 3.6340 3.7618 3.7618 3.7630 3.7630 4.5440 4.5440 4.5447 4.5447 7.3994 7.3994 7.4648 7.4648 7.9133 7.9133 7.9307 7.9307 8.1551 8.1551 8.2429 8.2429 8.6532 8.6532 k = 0.5000-0.0000 0.0954 ( 12568 PWs) bands (ev): -9.0763 -9.0763 -9.0763 -9.0763 -8.9509 -8.9509 -8.9509 -8.9509 -7.6547 -7.6547 -7.6542 -7.6542 -7.5613 -7.5613 -7.5608 -7.5608 -3.7007 -3.7007 -3.7005 -3.7005 -3.6266 -3.6266 -3.6263 -3.6263 -0.1427 -0.1427 -0.1056 -0.1056 0.0277 0.0277 0.0818 0.0818 0.9497 0.9497 0.9800 0.9800 1.5289 1.5289 1.5502 1.5502 1.8645 1.8645 1.8647 1.8647 2.4804 2.4804 2.6081 2.6081 2.6987 2.6987 2.8509 2.8509 3.2553 3.2553 3.3163 3.3163 3.4041 3.4041 3.4910 3.4910 3.5729 3.5729 3.6413 3.6413 3.7467 3.7467 3.7547 3.7547 4.5057 4.5057 4.5057 4.5057 7.4061 7.4061 7.4661 7.4661 7.9713 7.9713 7.9753 7.9753 8.2019 8.2019 8.3073 8.3073 8.6581 8.6581 k = 0.5000-0.0000 0.0835 ( 12564 PWs) bands (ev): -9.0764 -9.0764 -9.0764 -9.0764 -8.9509 -8.9509 -8.9509 -8.9509 -7.6502 -7.6502 -7.6496 -7.6496 -7.5658 -7.5658 -7.5652 -7.5652 -3.7016 -3.7016 -3.7015 -3.7015 -3.6250 -3.6250 -3.6247 -3.6247 -0.1456 -0.1456 -0.1062 -0.1062 0.0047 0.0047 0.0595 0.0595 0.9599 0.9599 0.9871 0.9871 1.5717 1.5717 1.5955 1.5955 1.8674 1.8674 1.8735 1.8735 2.4940 2.4940 2.6132 2.6132 2.7084 2.7084 2.8513 2.8513 3.2287 3.2287 3.2891 3.2891 3.3844 3.3844 3.4972 3.4972 3.5495 3.5495 3.6474 3.6474 3.7396 3.7396 3.7527 3.7527 4.4648 4.4648 4.4657 4.4657 7.4144 7.4144 7.4683 7.4683 8.0206 8.0206 8.0291 8.0291 8.2497 8.2497 8.3725 8.3725 8.6609 8.6609 k = 0.5000-0.0000 0.0716 ( 12568 PWs) bands (ev): -9.0765 -9.0765 -9.0765 -9.0765 -8.9509 -8.9509 -8.9509 -8.9509 -7.6453 -7.6453 -7.6447 -7.6447 -7.5706 -7.5706 -7.5700 -7.5700 -3.7025 -3.7025 -3.7024 -3.7024 -3.6235 -3.6235 -3.6233 -3.6233 -0.1472 -0.1472 -0.1057 -0.1057 -0.0171 -0.0171 0.0378 0.0378 0.9694 0.9694 0.9932 0.9932 1.6090 1.6090 1.6346 1.6346 1.8808 1.8808 1.8921 1.8921 2.4929 2.4929 2.5798 2.5798 2.7534 2.7534 2.8630 2.8630 3.2015 3.2015 3.2611 3.2611 3.3615 3.3615 3.4802 3.4802 3.5442 3.5442 3.6458 3.6458 3.7455 3.7455 3.7577 3.7577 4.4232 4.4232 4.4249 4.4249 7.4237 7.4237 7.4708 7.4708 8.0661 8.0661 8.0859 8.0859 8.2958 8.2958 8.4350 8.4350 8.6620 8.6620 k = 0.5000-0.0000 0.0596 ( 12560 PWs) bands (ev): -9.0767 -9.0767 -9.0767 -9.0767 -8.9509 -8.9509 -8.9509 -8.9509 -7.6403 -7.6403 -7.6396 -7.6396 -7.5756 -7.5756 -7.5749 -7.5749 -3.7032 -3.7032 -3.7031 -3.7031 -3.6222 -3.6222 -3.6220 -3.6220 -0.1473 -0.1473 -0.1043 -0.1043 -0.0373 -0.0373 0.0171 0.0171 0.9780 0.9780 0.9980 0.9980 1.6394 1.6394 1.6648 1.6648 1.9054 1.9054 1.9199 1.9199 2.4787 2.4787 2.5378 2.5378 2.8033 2.8033 2.8841 2.8841 3.1754 3.1754 3.2346 3.2346 3.3362 3.3362 3.4471 3.4471 3.5498 3.5498 3.6366 3.6366 3.7625 3.7625 3.7696 3.7696 4.3820 4.3820 4.3846 4.3846 7.4333 7.4333 7.4733 7.4733 8.1114 8.1114 8.1408 8.1408 8.3374 8.3374 8.4889 8.4889 8.6644 8.6644 k = 0.5000-0.0000 0.0477 ( 12554 PWs) bands (ev): -9.0768 -9.0768 -9.0768 -9.0768 -8.9509 -8.9509 -8.9509 -8.9509 -7.6352 -7.6352 -7.6345 -7.6345 -7.5806 -7.5806 -7.5800 -7.5800 -3.7039 -3.7039 -3.7038 -3.7038 -3.6210 -3.6210 -3.6209 -3.6209 -0.1457 -0.1457 -0.1021 -0.1021 -0.0552 -0.0552 -0.0024 -0.0024 0.9854 0.9854 1.0016 1.0016 1.6629 1.6629 1.6857 1.6857 1.9396 1.9396 1.9547 1.9547 2.4551 2.4551 2.4938 2.4938 2.8510 2.8510 2.9105 2.9105 3.1528 3.1528 3.2118 3.2118 3.3102 3.3102 3.4094 3.4094 3.5562 3.5562 3.6242 3.6242 3.7849 3.7849 3.7866 3.7866 4.3430 4.3430 4.3461 4.3461 7.4428 7.4428 7.4752 7.4752 8.1556 8.1556 8.1923 8.1923 8.3718 8.3718 8.5244 8.5244 8.6747 8.6747 k = 0.5000-0.0000 0.0358 ( 12562 PWs) bands (ev): -9.0769 -9.0769 -9.0768 -9.0768 -8.9509 -8.9509 -8.9509 -8.9509 -7.6301 -7.6301 -7.6295 -7.6295 -7.5856 -7.5856 -7.5849 -7.5849 -3.7044 -3.7044 -3.7043 -3.7043 -3.6201 -3.6201 -3.6200 -3.6200 -0.1423 -0.1423 -0.1003 -0.1003 -0.0692 -0.0692 -0.0203 -0.0203 0.9916 0.9916 1.0038 1.0038 1.6805 1.6805 1.6988 1.6988 1.9789 1.9789 1.9924 1.9924 2.4265 2.4265 2.4507 2.4507 2.8934 2.8934 2.9372 2.9372 3.1363 3.1363 3.1937 3.1937 3.2856 3.2856 3.3708 3.3708 3.5619 3.5619 3.6114 3.6114 3.8060 3.8060 3.8077 3.8077 4.3081 4.3081 4.3114 4.3114 7.4516 7.4516 7.4761 7.4761 8.1973 8.1973 8.2377 8.2377 8.3983 8.3983 8.5335 8.5335 8.6980 8.6980 k = 0.5000-0.0000 0.0239 ( 12554 PWs) bands (ev): -9.0769 -9.0769 -9.0769 -9.0769 -8.9509 -8.9509 -8.9509 -8.9509 -7.6255 -7.6255 -7.6250 -7.6250 -7.5901 -7.5901 -7.5895 -7.5895 -3.7047 -3.7047 -3.7047 -3.7047 -3.6194 -3.6194 -3.6193 -3.6193 -0.1371 -0.1371 -0.1030 -0.1030 -0.0751 -0.0751 -0.0364 -0.0364 0.9966 0.9966 1.0048 1.0048 1.6933 1.6933 1.7059 1.7059 2.0173 2.0173 2.0274 2.0274 2.3982 2.3982 2.4120 2.4120 2.9281 2.9281 2.9583 2.9583 3.1291 3.1291 3.1793 3.1793 3.2672 3.2672 3.3334 3.3334 3.5674 3.5674 3.5996 3.5996 3.8245 3.8245 3.8274 3.8274 4.2800 4.2800 4.2829 4.2829 7.4593 7.4593 7.4758 7.4758 8.2349 8.2349 8.2722 8.2722 8.4196 8.4196 8.5212 8.5212 8.7271 8.7271 k = 0.5000-0.0000 0.0119 ( 12562 PWs) bands (ev): -9.0770 -9.0770 -9.0770 -9.0770 -8.9509 -8.9509 -8.9509 -8.9509 -7.6219 -7.6219 -7.6215 -7.6215 -7.5935 -7.5935 -7.5931 -7.5931 -3.7049 -3.7049 -3.7049 -3.7049 -3.6190 -3.6190 -3.6189 -3.6189 -0.1301 -0.1301 -0.1116 -0.1116 -0.0714 -0.0714 -0.0506 -0.0506 1.0004 1.0004 1.0045 1.0045 1.7021 1.7021 1.7085 1.7085 2.0473 2.0473 2.0528 2.0528 2.3768 2.3768 2.3829 2.3829 2.9529 2.9529 2.9689 2.9689 3.1336 3.1336 3.1646 3.1646 3.2622 3.2622 3.2999 3.2999 3.5734 3.5734 3.5892 3.5892 3.8384 3.8384 3.8404 3.8404 4.2618 4.2618 4.2635 4.2635 7.4658 7.4658 7.4740 7.4740 8.2657 8.2657 8.2891 8.2891 8.4420 8.4420 8.4973 8.4973 8.7509 8.7509 k = 0.5000-0.0000-0.0000 ( 12548 PWs) bands (ev): -9.0770 -9.0770 -9.0770 -9.0770 -8.9509 -8.9509 -8.9509 -8.9509 -7.6203 -7.6203 -7.6203 -7.6203 -7.5947 -7.5947 -7.5947 -7.5947 -3.7050 -3.7050 -3.7050 -3.7050 -3.6188 -3.6188 -3.6188 -3.6188 -0.1214 -0.1214 -0.1214 -0.1214 -0.0624 -0.0624 -0.0624 -0.0624 1.0030 1.0030 1.0030 1.0030 1.7071 1.7071 1.7071 1.7071 2.0607 2.0607 2.0607 2.0607 2.3701 2.3701 2.3701 2.3701 2.9669 2.9669 2.9669 2.9669 3.1476 3.1476 3.1476 3.1476 3.2744 3.2744 3.2744 3.2744 3.5805 3.5805 3.5805 3.5805 3.8443 3.8443 3.8443 3.8443 4.2560 4.2560 4.2560 4.2560 7.4707 7.4707 7.4707 7.4707 8.2856 8.2856 8.2856 8.2856 8.4690 8.4690 8.4690 8.4690 8.7641 8.7641 k = 0.5000 0.2405-0.0000 ( 12568 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -7.6084 -7.6084 -7.6084 -7.6084 -7.6079 -7.6079 -7.6079 -7.6079 -3.6748 -3.6748 -3.6748 -3.6748 -3.6703 -3.6703 -3.6703 -3.6703 -0.0571 -0.0571 -0.0571 -0.0571 -0.0248 -0.0248 -0.0248 -0.0248 1.4085 1.4085 1.4085 1.4085 1.4285 1.4285 1.4285 1.4285 2.1284 2.1284 2.1284 2.1284 2.1429 2.1429 2.1429 2.1429 2.9440 2.9440 2.9440 2.9440 3.0580 3.0580 3.0580 3.0580 3.3896 3.3896 3.3896 3.3896 3.3910 3.3910 3.3910 3.3910 3.9843 3.9843 3.9843 3.9843 4.0194 4.0194 4.0194 4.0194 7.8336 7.8336 7.8336 7.8336 7.9624 7.9624 7.9624 7.9624 8.4218 8.4218 8.4218 8.4218 8.4533 8.4533 k = 0.5000 0.2405 0.0119 ( 12572 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -7.6084 -7.6084 -7.6083 -7.6083 -7.6079 -7.6079 -7.6078 -7.6078 -3.6749 -3.6749 -3.6747 -3.6747 -3.6703 -3.6703 -3.6702 -3.6702 -0.0569 -0.0569 -0.0564 -0.0564 -0.0246 -0.0246 -0.0245 -0.0245 1.4028 1.4028 1.4109 1.4109 1.4201 1.4201 1.4335 1.4335 2.1269 2.1269 2.1327 2.1327 2.1335 2.1335 2.1552 2.1552 2.9234 2.9234 2.9606 2.9606 3.0451 3.0451 3.0618 3.0618 3.3728 3.3728 3.3843 3.3843 3.4055 3.4055 3.4151 3.4151 3.9784 3.9784 3.9894 3.9894 4.0137 4.0137 4.0243 4.0243 7.8262 7.8262 7.8408 7.8408 7.9552 7.9552 7.9678 7.9678 8.4185 8.4185 8.4270 8.4270 8.4451 8.4451 k = 0.5000 0.2405 0.0239 ( 12600 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0144 -9.0143 -9.0143 -7.6085 -7.6085 -7.6083 -7.6083 -7.6080 -7.6080 -7.6078 -7.6078 -3.6748 -3.6748 -3.6745 -3.6745 -3.6703 -3.6703 -3.6700 -3.6700 -0.0558 -0.0558 -0.0550 -0.0550 -0.0238 -0.0238 -0.0235 -0.0235 1.3941 1.3941 1.4085 1.4085 1.4100 1.4100 1.4347 1.4347 2.1272 2.1272 2.1284 2.1284 2.1395 2.1395 2.1698 2.1698 2.9008 2.9008 2.9718 2.9718 3.0255 3.0255 3.0565 3.0565 3.3617 3.3617 3.3895 3.3895 3.4297 3.4297 3.4431 3.4431 3.9715 3.9715 3.9938 3.9938 4.0077 4.0077 4.0284 4.0284 7.8185 7.8185 7.8478 7.8478 7.9459 7.9459 7.9712 7.9712 8.4170 8.4170 8.4343 8.4343 8.4375 8.4375 k = 0.5000 0.2405 0.0358 ( 12596 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0143 -9.0143 -9.0143 -9.0143 -7.6086 -7.6086 -7.6083 -7.6083 -7.6082 -7.6082 -7.6078 -7.6078 -3.6746 -3.6746 -3.6742 -3.6742 -3.6703 -3.6703 -3.6698 -3.6698 -0.0540 -0.0540 -0.0528 -0.0528 -0.0224 -0.0224 -0.0220 -0.0220 1.3827 1.3827 1.3944 1.3944 1.4061 1.4061 1.4322 1.4322 2.1240 2.1240 2.1324 2.1324 2.1482 2.1482 2.1857 2.1857 2.8784 2.8784 2.9774 2.9774 3.0023 3.0023 3.0448 3.0448 3.3580 3.3580 3.4020 3.4020 3.4587 3.4587 3.4724 3.4724 3.9642 3.9642 3.9981 3.9981 4.0019 4.0019 4.0322 4.0322 7.8103 7.8103 7.8542 7.8542 7.9344 7.9344 7.9724 7.9724 8.4175 8.4175 8.4309 8.4309 8.4441 8.4441 k = 0.5000 0.2405 0.0477 ( 12588 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0143 -9.0143 -9.0142 -9.0142 -7.6088 -7.6088 -7.6083 -7.6083 -7.6083 -7.6083 -7.6079 -7.6079 -3.6744 -3.6744 -3.6738 -3.6738 -3.6701 -3.6701 -3.6695 -3.6695 -0.0514 -0.0514 -0.0498 -0.0498 -0.0205 -0.0205 -0.0200 -0.0200 1.3693 1.3693 1.3783 1.3783 1.3993 1.3993 1.4263 1.4263 2.1235 2.1235 2.1385 2.1385 2.1582 2.1582 2.2019 2.2019 2.8581 2.8581 2.9782 2.9782 2.9784 2.9784 3.0301 3.0301 3.3603 3.3603 3.4178 3.4178 3.4891 3.4891 3.5005 3.5005 3.9574 3.9574 3.9973 3.9973 4.0033 4.0033 4.0359 4.0359 7.8015 7.8015 7.8599 7.8599 7.9206 7.9206 7.9714 7.9714 8.4202 8.4202 8.4256 8.4256 8.4565 8.4565 k = 0.5000 0.2405 0.0596 ( 12576 PWs) bands (ev): -9.0144 -9.0144 -9.0144 -9.0144 -9.0142 -9.0142 -9.0142 -9.0142 -7.6089 -7.6089 -7.6085 -7.6085 -7.6084 -7.6084 -7.6079 -7.6079 -3.6740 -3.6740 -3.6733 -3.6733 -3.6700 -3.6700 -3.6692 -3.6692 -0.0481 -0.0481 -0.0462 -0.0462 -0.0181 -0.0181 -0.0176 -0.0176 1.3542 1.3542 1.3609 1.3609 1.3902 1.3902 1.4175 1.4175 2.1252 2.1252 2.1458 2.1458 2.1685 2.1685 2.2171 2.2171 2.8418 2.8418 2.9561 2.9561 2.9763 2.9763 3.0159 3.0159 3.3662 3.3662 3.4328 3.4328 3.5174 3.5174 3.5249 3.5249 3.9523 3.9523 3.9955 3.9955 4.0103 4.0103 4.0401 4.0401 7.7918 7.7918 7.8643 7.8643 7.9045 7.9045 7.9678 7.9678 8.4221 8.4221 8.4253 8.4253 8.4720 8.4720 k = 0.5000 0.2405 0.0716 ( 12580 PWs) bands (ev): -9.0144 -9.0144 -9.0143 -9.0143 -9.0142 -9.0142 -9.0141 -9.0141 -7.6091 -7.6091 -7.6087 -7.6087 -7.6085 -7.6085 -7.6080 -7.6080 -3.6736 -3.6736 -3.6728 -3.6728 -3.6698 -3.6698 -3.6689 -3.6689 -0.0443 -0.0443 -0.0420 -0.0420 -0.0154 -0.0154 -0.0149 -0.0149 1.3381 1.3381 1.3426 1.3426 1.3794 1.3794 1.4062 1.4062 2.1282 2.1282 2.1536 2.1536 2.1783 2.1783 2.2301 2.2301 2.8312 2.8312 2.9370 2.9370 2.9738 2.9738 3.0044 3.0044 3.3730 3.3730 3.4440 3.4440 3.5405 3.5405 3.5428 3.5428 3.9507 3.9507 3.9979 3.9979 4.0200 4.0200 4.0455 4.0455 7.7812 7.7812 7.8672 7.8672 7.8861 7.8861 7.9615 7.9615 8.4210 8.4210 8.4328 8.4328 8.4904 8.4904 k = 0.5000 0.2405 0.0835 ( 12572 PWs) bands (ev): -9.0143 -9.0143 -9.0143 -9.0143 -9.0141 -9.0141 -9.0141 -9.0141 -7.6093 -7.6093 -7.6089 -7.6089 -7.6085 -7.6085 -7.6081 -7.6081 -3.6731 -3.6731 -3.6722 -3.6722 -3.6695 -3.6695 -3.6686 -3.6686 -0.0399 -0.0399 -0.0374 -0.0374 -0.0124 -0.0124 -0.0119 -0.0119 1.3214 1.3214 1.3242 1.3242 1.3675 1.3675 1.3932 1.3932 2.1320 2.1320 2.1609 2.1609 2.1870 2.1870 2.2399 2.2399 2.8275 2.8275 2.9226 2.9226 2.9726 2.9726 2.9973 2.9973 3.3786 3.3786 3.4494 3.4494 3.5523 3.5523 3.5557 3.5557 3.9543 3.9543 4.0058 4.0058 4.0329 4.0329 4.0524 4.0524 7.7696 7.7696 7.8657 7.8657 7.8681 7.8681 7.9525 7.9525 8.4227 8.4227 8.4429 8.4429 8.5118 8.5118 k = 0.5000 0.2405 0.0954 ( 12580 PWs) bands (ev): -9.0143 -9.0143 -9.0143 -9.0143 -9.0140 -9.0140 -9.0140 -9.0140 -7.6094 -7.6094 -7.6091 -7.6091 -7.6086 -7.6086 -7.6083 -7.6083 -3.6726 -3.6726 -3.6716 -3.6716 -3.6693 -3.6693 -3.6682 -3.6682 -0.0351 -0.0351 -0.0324 -0.0324 -0.0093 -0.0093 -0.0088 -0.0088 1.3048 1.3048 1.3061 1.3061 1.3549 1.3549 1.3792 1.3792 2.1358 2.1358 2.1670 2.1670 2.1940 2.1940 2.2459 2.2459 2.8315 2.8315 2.9136 2.9136 2.9740 2.9740 2.9957 2.9957 3.3812 3.3812 3.4477 3.4477 3.5523 3.5523 3.5611 3.5611 3.9642 3.9642 4.0195 4.0195 4.0491 4.0491 4.0611 4.0611 7.7572 7.7572 7.8437 7.8437 7.8669 7.8669 7.9411 7.9411 8.4276 8.4276 8.4552 8.4552 8.5358 8.5358 k = 0.5000 0.2405 0.1074 ( 12560 PWs) bands (ev): -9.0143 -9.0143 -9.0142 -9.0142 -9.0140 -9.0140 -9.0139 -9.0139 -7.6096 -7.6096 -7.6093 -7.6093 -7.6087 -7.6087 -7.6084 -7.6084 -3.6721 -3.6721 -3.6710 -3.6710 -3.6691 -3.6691 -3.6679 -3.6679 -0.0300 -0.0300 -0.0272 -0.0272 -0.0061 -0.0061 -0.0057 -0.0057 1.2885 1.2885 1.2888 1.2888 1.3424 1.3424 1.3647 1.3647 2.1393 2.1393 2.1714 2.1714 2.1991 2.1991 2.2479 2.2479 2.8432 2.8432 2.9106 2.9106 2.9787 2.9787 3.0000 3.0000 3.3800 3.3800 3.4390 3.4390 3.5429 3.5429 3.5565 3.5565 3.9802 3.9802 4.0384 4.0384 4.0680 4.0680 4.0714 4.0714 7.7442 7.7442 7.8207 7.8207 7.8637 7.8637 7.9277 7.9277 8.4355 8.4355 8.4691 8.4691 8.5619 8.5619 k = 0.5000 0.2405 0.1193 ( 12556 PWs) bands (ev): -9.0142 -9.0142 -9.0142 -9.0142 -9.0139 -9.0139 -9.0139 -9.0139 -7.6098 -7.6098 -7.6095 -7.6095 -7.6088 -7.6088 -7.6085 -7.6085 -3.6716 -3.6716 -3.6703 -3.6703 -3.6689 -3.6689 -3.6676 -3.6676 -0.0249 -0.0249 -0.0219 -0.0219 -0.0031 -0.0031 -0.0028 -0.0028 1.2726 1.2726 1.2732 1.2732 1.3302 1.3302 1.3503 1.3503 2.1422 2.1422 2.1737 2.1737 2.2022 2.2022 2.2464 2.2464 2.8622 2.8622 2.9135 2.9135 2.9868 2.9868 3.0099 3.0099 3.3750 3.3750 3.4237 3.4237 3.5254 3.5254 3.5429 3.5429 4.0008 4.0008 4.0608 4.0608 4.0830 4.0830 4.0886 4.0886 7.7311 7.7311 7.7975 7.7975 7.8588 7.8588 7.9131 7.9131 8.4464 8.4464 8.4840 8.4840 8.5895 8.5895 k = 0.5000 0.2405 0.1312 ( 12552 PWs) bands (ev): -9.0142 -9.0142 -9.0142 -9.0142 -9.0138 -9.0138 -9.0138 -9.0138 -7.6099 -7.6099 -7.6097 -7.6097 -7.6089 -7.6089 -7.6086 -7.6086 -3.6710 -3.6710 -3.6697 -3.6697 -3.6687 -3.6687 -3.6673 -3.6673 -0.0197 -0.0197 -0.0168 -0.0168 -0.0003 -0.0003 -0.0002 -0.0002 1.2579 1.2579 1.2590 1.2590 1.3190 1.3190 1.3366 1.3366 2.1444 2.1444 2.1741 2.1741 2.2038 2.2038 2.2422 2.2422 2.8873 2.8873 2.9221 2.9221 2.9977 2.9977 3.0249 3.0249 3.3669 3.3669 3.4031 3.4031 3.5013 3.5013 3.5224 3.5224 4.0239 4.0239 4.0848 4.0848 4.0951 4.0951 4.1096 4.1096 7.7184 7.7184 7.7747 7.7747 7.8528 7.8528 7.8978 7.8978 8.4596 8.4596 8.4989 8.4989 8.6175 8.6175 k = 0.5000 0.2405 0.1431 ( 12560 PWs) bands (ev): -9.0142 -9.0142 -9.0141 -9.0141 -9.0138 -9.0138 -9.0138 -9.0138 -7.6101 -7.6101 -7.6099 -7.6099 -7.6090 -7.6090 -7.6088 -7.6088 -3.6705 -3.6705 -3.6691 -3.6691 -3.6685 -3.6685 -3.6671 -3.6671 -0.0147 -0.0147 -0.0119 -0.0119 0.0020 0.0020 0.0021 0.0021 1.2450 1.2450 1.2464 1.2464 1.3091 1.3091 1.3240 1.3240 2.1462 2.1462 2.1728 2.1728 2.2043 2.2043 2.2363 2.2363 2.9174 2.9174 2.9354 2.9354 3.0102 3.0102 3.0436 3.0436 3.3570 3.3570 3.3787 3.3787 3.4723 3.4723 3.4968 3.4968 4.0476 4.0476 4.1067 4.1067 4.1086 4.1086 4.1297 4.1297 7.7068 7.7068 7.7532 7.7532 7.8464 7.8464 7.8827 7.8827 8.4743 8.4743 8.5128 8.5128 8.6449 8.6449 k = 0.5000 0.2405 0.1551 ( 12552 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0137 -9.0137 -9.0137 -9.0137 -7.6102 -7.6102 -7.6100 -7.6100 -7.6090 -7.6090 -7.6089 -7.6089 -3.6700 -3.6700 -3.6686 -3.6686 -3.6684 -3.6684 -3.6669 -3.6669 -0.0101 -0.0101 -0.0073 -0.0073 0.0036 0.0036 0.0040 0.0040 1.2342 1.2342 1.2356 1.2356 1.3008 1.3008 1.3129 1.3129 2.1477 2.1477 2.1702 2.1702 2.2042 2.2042 2.2296 2.2296 2.9510 2.9510 2.9525 2.9525 3.0226 3.0226 3.0642 3.0642 3.3475 3.3475 3.3528 3.3528 3.4402 3.4402 3.4683 3.4683 4.0700 4.0700 4.1169 4.1169 4.1305 4.1305 4.1476 4.1476 7.6970 7.6970 7.7336 7.7336 7.8403 7.8403 7.8687 7.8687 8.4897 8.4897 8.5247 8.5247 8.6703 8.6703 k = 0.5000 0.2405 0.1670 ( 12564 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0137 -9.0137 -9.0137 -9.0137 -7.6103 -7.6103 -7.6101 -7.6101 -7.6091 -7.6091 -7.6090 -7.6090 -3.6696 -3.6696 -3.6684 -3.6684 -3.6681 -3.6681 -3.6668 -3.6668 -0.0059 -0.0059 -0.0033 -0.0033 0.0045 0.0045 0.0053 0.0053 1.2256 1.2256 1.2269 1.2269 1.2944 1.2944 1.3035 1.3035 2.1493 2.1493 2.1668 2.1668 2.2040 2.2040 2.2230 2.2230 2.9719 2.9719 2.9864 2.9864 3.0324 3.0324 3.0835 3.0835 3.3287 3.3287 3.3409 3.3409 3.4066 3.4066 3.4386 3.4386 4.0899 4.0899 4.1247 4.1247 4.1494 4.1494 4.1622 4.1622 7.6895 7.6895 7.7167 7.7167 7.8354 7.8354 7.8562 7.8562 8.5046 8.5046 8.5335 8.5335 8.6922 8.6922 k = 0.5000 0.2405 0.1789 ( 12584 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0137 -9.0137 -9.0137 -9.0137 -7.6103 -7.6103 -7.6102 -7.6102 -7.6091 -7.6091 -7.6090 -7.6090 -3.6692 -3.6692 -3.6684 -3.6684 -3.6677 -3.6677 -3.6668 -3.6668 -0.0023 -0.0023 0.0001 0.0001 0.0048 0.0048 0.0059 0.0059 1.2195 1.2195 1.2204 1.2204 1.2902 1.2902 1.2963 1.2963 2.1511 2.1511 2.1630 2.1630 2.2044 2.2044 2.2169 2.2169 2.9919 2.9919 3.0218 3.0218 3.0372 3.0372 3.0962 3.0962 3.3116 3.3116 3.3399 3.3399 3.3733 3.3733 3.4095 3.4095 4.1064 4.1064 4.1293 4.1293 4.1641 4.1641 4.1727 4.1727 7.6850 7.6850 7.7030 7.7030 7.8323 7.8323 7.8460 7.8460 8.5179 8.5179 8.5386 8.5386 8.7083 8.7083 k = 0.5000 0.2405 0.1909 ( 12560 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0137 -9.0137 -9.0136 -9.0136 -7.6104 -7.6104 -7.6103 -7.6103 -7.6091 -7.6091 -7.6091 -7.6091 -3.6689 -3.6689 -3.6685 -3.6685 -3.6673 -3.6673 -3.6669 -3.6669 0.0007 0.0007 0.0027 0.0027 0.0042 0.0042 0.0056 0.0056 1.2158 1.2158 1.2163 1.2163 1.2882 1.2882 1.2912 1.2912 2.1533 2.1533 2.1594 2.1594 2.2057 2.2057 2.2119 2.2119 3.0106 3.0106 3.0350 3.0350 3.0547 3.0547 3.0963 3.0963 3.3076 3.3076 3.3429 3.3429 3.3466 3.3466 3.3831 3.3831 4.1187 4.1187 4.1301 4.1301 4.1741 4.1741 4.1784 4.1784 7.6838 7.6838 7.6928 7.6928 7.8316 7.8316 7.8383 7.8383 8.5287 8.5287 8.5395 8.5395 8.7189 8.7189 k = 0.5000 0.2405 0.2028 ( 12560 PWs) bands (ev): -9.0141 -9.0141 -9.0141 -9.0141 -9.0136 -9.0136 -9.0136 -9.0136 -7.6103 -7.6103 -7.6103 -7.6103 -7.6091 -7.6091 -7.6091 -7.6091 -3.6687 -3.6687 -3.6687 -3.6687 -3.6671 -3.6671 -3.6671 -3.6671 0.0028 0.0028 0.0028 0.0028 0.0046 0.0046 0.0046 0.0046 1.2148 1.2148 1.2148 1.2148 1.2885 1.2885 1.2885 1.2885 2.1561 2.1561 2.1561 2.1561 2.2082 2.2082 2.2082 2.2082 3.0257 3.0257 3.0257 3.0257 3.0813 3.0813 3.0813 3.0813 3.3193 3.3193 3.3193 3.3193 3.3614 3.3614 3.3614 3.3614 4.1266 4.1266 4.1266 4.1266 4.1789 4.1789 4.1789 4.1789 7.6864 7.6864 7.6864 7.6864 7.8335 7.8335 7.8335 7.8335 8.5361 8.5361 8.5361 8.5361 8.7228 8.7228 Writing output data file SbSBr.save init_run : 0.33s CPU 0.48s WALL ( 1 calls) electrons : 638.15s CPU 644.48s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.04s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 638.14s CPU 644.46s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.11s CPU 0.14s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.13s CPU 0.17s WALL ( 320 calls) cegterg : 590.55s CPU 595.44s WALL ( 395 calls) Called by sum_band: Called by *egterg: h_psi : 347.55s CPU 352.25s WALL ( 7143 calls) s_psi : 27.86s CPU 27.78s WALL ( 7143 calls) g_psi : 0.66s CPU 0.59s WALL ( 6428 calls) cdiaghg : 187.20s CPU 187.80s WALL ( 6748 calls) cegterg:over : 29.44s CPU 29.40s WALL ( 6428 calls) cegterg:upda : 19.14s CPU 19.36s WALL ( 6428 calls) cegterg:last : 11.76s CPU 11.72s WALL ( 1121 calls) cdiaghg:chol : 7.85s CPU 7.98s WALL ( 6748 calls) cdiaghg:inve : 5.88s CPU 5.97s WALL ( 6748 calls) cdiaghg:para : 13.03s CPU 12.93s WALL ( 13496 calls) Called by h_psi: h_psi:vloc : 294.52s CPU 299.13s WALL ( 7143 calls) h_psi:vnl : 52.52s CPU 52.56s WALL ( 7143 calls) add_vuspsi : 27.85s CPU 27.78s WALL ( 7143 calls) General routines calbec : 24.64s CPU 24.75s WALL ( 7143 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 284.78s CPU 288.82s WALL ( 1274728 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.30s CPU 0.54s WALL ( 640 calls) Parallel routines fft_scatter : 186.87s CPU 189.02s WALL ( 1274751 calls) PWSCF : 11m56.08s CPU 12m34.47s WALL This run was terminated on: 4:39:43 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=